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Sample records for carbon atom wires

  1. Carbon atomic wires: charge transfer induced electron conduction

    NASA Astrophysics Data System (ADS)

    Larade, Brian; Taylor, Jeremy; Mehrez, Hatem; Guo, Hong

    2001-03-01

    We report a first principles theoretical analysis of quantum transport properties of carbon atomic wires. Our theory is based on density functional theory within the LDA approximation, with standard norm conserving pseudopotentials defining the atomic core, and a localized orbital basis set to model the valence states. The charge density for the open atomic wire system is calculated using the non-equilibrium Green's functions. This theory is implemented in our molecular electronics modeling package McDCAL. For carbon atomic chains with different lengths in contact with metallic electrodes, we calculated linear DC conductance as a function of the chain-electrode distance and the current-voltage characteristics. Our results show that charge transfer from the electrodes to the atomic wire plays a most important role in aligning the Fermi level of the electrodes to the LUMO state of the atomic wire, inducing a substantial conductance variation due to this effect. Our results also show that the eigenstates of the carbon chain and band structure of the electrodes are of particular importance to the transport properties. We will compare our results to those obtained previously.

  2. Electronic structure and charge transport properties of atomic carbon wires.

    PubMed

    Lambropoulos, K; Simserides, C

    2017-10-11

    Atomic carbon wires represent the ultimate one-atom-thick one-dimensional structure. We use a Tight-binding (TB) approach to determine the electronic structure of polyynic and cumulenic carbynes, in terms of their dispersion relations (for cyclic boundaries), eigenspectra (for fixed boundaries) and density of states (DOS). We further derive the transmission coefficient at zero-bias by attaching the carbynes to semi-infinite metallic leads, and demonstrate the effect of the coupling strength and asymmetry to the transparency of the system to incident carriers. Finally, we determine the current-voltage (I-V) characteristics of carbynes and study the effect of factors such as the weakening of the coupling of the system to one of the leads, the relative position of the Fermi levels of the carbyne and the leads, the leads' bandwidth and, finally, the difference in the energy structure between the leads. Our results confirm and reproduce some of the most recent experimental findings.

  3. Fabrication and Characterization of Oriented Carbon Atom Wires Assembled on Gold

    SciTech Connect

    Xue,K.H.; Wu,L.; Chen, S.-P.; Wanga, L.X.; Wei, R.-B.; Xu, S.-M.; Cui, L.; Mao, B.-W.; Tian, Z.-Q.; Zen, C.-H.; Sun, S.-G.; Zhu, Y.-M.

    2009-02-17

    Carbon atom wires (CAWs) are of the sp-hybridized allotrope of carbon. To augment the extraordinary features based on sp-hybridization, we developed an approach to make CAWs be self-assembled and orderly organized on Au substrate. The self-assembling process was investigated in situ by using scanning tunneling microscopy (STM) and electrochemical quartz crystal microbalance (EQCM). The properties of the assembled film were characterized by voltammetry, Raman spectroscopy, electron energy loss spectroscopy (EELS), and the contact angle measurements. Experimental results indicated that the assembled CAW film was of the good structural integrity and well organized, with the sp-hybridized features enhanced.

  4. Raman spectroscopy as a tool to investigate the structure and electronic properties of carbon-atom wires

    PubMed Central

    Milani, Alberto; Tommasini, Matteo; Russo, Valeria; Li Bassi, Andrea; Lucotti, Andrea; Cataldo, Franco

    2015-01-01

    Summary Graphene, nanotubes and other carbon nanostructures have shown potential as candidates for advanced technological applications due to the different coordination of carbon atoms and to the possibility of π-conjugation. In this context, atomic-scale wires comprised of sp-hybridized carbon atoms represent ideal 1D systems to potentially downscale devices to the atomic level. Carbon-atom wires (CAWs) can be arranged in two possible structures: a sequence of double bonds (cumulenes), resulting in a 1D metal, or an alternating sequence of single–triple bonds (polyynes), expected to show semiconducting properties. The electronic and optical properties of CAWs can be finely tuned by controlling the wire length (i.e., the number of carbon atoms) and the type of termination (e.g., atom, molecular group or nanostructure). Although linear, sp-hybridized carbon systems are still considered elusive and unstable materials, a number of nanostructures consisting of sp-carbon wires have been produced and characterized to date. In this short review, we present the main CAW synthesis techniques and stabilization strategies and we discuss the current status of the understanding of their structural, electronic and vibrational properties with particular attention to how these properties are related to one another. We focus on the use of vibrational spectroscopy to provide information on the structural and electronic properties of the system (e.g., determination of wire length). Moreover, by employing Raman spectroscopy and surface enhanced Raman scattering in combination with the support of first principles calculations, we show that a detailed understanding of the charge transfer between CAWs and metal nanoparticles may open the possibility to tune the electronic structure from alternating to equalized bonds. PMID:25821689

  5. Electrochemical behavior of adrenaline at the carbon atom wire modified electrode

    NASA Astrophysics Data System (ADS)

    Xue, Kuan-Hong; Liu, Jia-Mei; Wei, Ri-Bing; Chen, Shao-Peng

    2006-09-01

    Electrochemical behavior of adrenaline at an electrode modified by carbon atom wires (CAWs), a new material, was investigated by cyclic voltammetry combined with UV-vis spectrometry, and forced convection method. As to the electrochemical response of redox of adrenaline/adrenalinequinone couple in 0.50 M H 2SO 4, at a nitric acid treated CAW modified electrode, the anodic and cathodic peak potentials Epa and Epc shifted by 87 mV negatively and 139 mV in the positive direction, respectively, and standard heterogeneous rate constant k0 increased by 16 times compared to the corresponding bare electrode, indicating the extraordinary activity of CAWs in electrocatalysis for the process.

  6. Realization of a Strained Atomic Wire Superlattice.

    PubMed

    Song, Inkyung; Goh, Jung Suk; Lee, Sung-Hoon; Jung, Sung Won; Shin, Jin Sung; Yamane, Hiroyuki; Kosugi, Nobuhiro; Yeom, Han Woong

    2015-11-24

    A superlattice of strained Au-Si atomic wires is successfully fabricated on a Si surface. Au atoms are known to incorporate into the stepped Si(111) surface to form a Au-Si atomic wire array with both one-dimensional (1D) metallic and antiferromagnetic atomic chains. At a reduced density of Au, we find a regular array of Au-Si wires in alternation with pristine Si nanoterraces. Pristine Si nanoterraces impose a strain on the neighboring Au-Si wires, which modifies both the band structure of metallic chains and the magnetic property of spin chains. This is an ultimate 1D version of a strained-layer superlattice of semiconductors, defining a direction toward the fine engineering of self-assembled atomic-scale wires.

  7. Transport Through Carbon Nanotube Wires

    NASA Technical Reports Server (NTRS)

    Anantram, M. P.; Kwak, Dochan (Technical Monitor)

    2001-01-01

    This viewgraph presentation deals with the use of carbon nanotubes as a transport system. Contact, defects, tubular bend, phonons, and mechanical deformations all contribute to reflection within the nanotube wire. Bragg reflection, however, is native to an ideal energy transport system. Transmission resistance depends primarily on the level of energy present. Finally, the details regarding coupling between carbon nanotubes and simple metals are presented.

  8. Correlated atomic wires on substrates. II. Application to Hubbard wires

    NASA Astrophysics Data System (ADS)

    Abdelwahab, Anas; Jeckelmann, Eric; Hohenadler, Martin

    2017-07-01

    In the first part of our theoretical study of correlated atomic wires on substrates, we introduced lattice models for a one-dimensional quantum wire on a three-dimensional substrate and their approximation by quasi-one-dimensional effective ladder models [Abdelwahab et al., preceding paper, Phys. Rev. B 96, 035445 (2017), 10.1103/PhysRevB.96.035445]. In this second part, we apply this approach to the case of a correlated wire with a Hubbard-type electron-electron repulsion deposited on an insulating substrate. The ground-state and spectral properties are investigated numerically using the density-matrix renormalization group method and quantum Monte Carlo simulations. As a function of the model parameters, we observe various phases with quasi-one-dimensional low-energy excitations localized in the wire, namely, paramagnetic Mott insulators, Luttinger liquids, and spin-1 /2 Heisenberg chains. The validity of the effective ladder models is assessed for selected parameters by studying the dependence of results on the number of legs and comparing to the full three-dimensional model. We find that narrow ladder models accurately reproduce the quasi-one-dimensional excitations of the full three-dimensional model but predict only qualitatively whether excitations are localized around the wire or delocalized in the three-dimensional substrate.

  9. Quantum stability and magic lengths of metal atom wires

    NASA Astrophysics Data System (ADS)

    Cui, Ping; Choi, Jin-Ho; Lan, Haiping; Cho, Jun-Hyung; Niu, Qian; Yang, Jinlong; Zhang, Zhenyu

    2016-06-01

    Metal atom wires represent an important class of nanomaterials in the development of future electronic devices and other functional applications. Using first-principles calculations within density functional theory, we carry out a systematic study of the quantum stability of freestanding atom wires consisting of prototypical metal elements with s -, s p -, and s d -valence electrons. We explore how the quantum mechanically confined motion and local bonding of the valence electrons in these different wire systems can dictate their overall structural stability and find that the formation energy of essentially all the wires oscillates with respect to their length measured by the number n of atoms contained in the wires, establishing the existence of highly preferred (or magic) lengths. Furthermore, different wire classes exhibit distinctively different oscillatory characteristics and quantum stabilities. Alkali metal wires possessing an unpaired s valence electron per atom exhibit simple damped even-odd oscillations. In contrast, Al and Ga wires containing three s2p1 valence electrons per atom generally display much larger and undamped even-odd energy oscillations due to stronger local bonding of the p orbitals. Among the noble metals, the s -dominant Ag wires behave similarly to the linear alkali metal wires, while Au and Pt wires distinctly prefer to be structurally zigzagged due to strong relativistic effects. These findings are discussed in connection with existing experiments and should also be instrumental in future experimental realization of different metal atom wires in freestanding or supported environments with desirable functionalities.

  10. Onset of energy dissipation in ballistic atomic wires.

    PubMed

    Agraït, Nicolás; Untiedt, Carlos; Rubio-Bollinger, Gabino; Vieira, Sebastián

    2002-05-27

    Electronic transport at finite voltages in free-standing gold atomic chains of up to seven atoms in length is studied at low temperatures using a scanning tunneling microscope. The conductance vs voltage curves show that transport in these single-mode ballistic atomic wires is nondissipative up to a finite voltage threshold of the order of several mV. The onset of dissipation and resistance within the wire corresponds to the excitation of the atomic vibrations by the electrons traversing the wire and is very sensitive to strain.

  11. Carbon Slurry Secondary Atomization.

    DTIC Science & Technology

    1986-09-01

    ELEMENT NO. NO. N ACCESSION NO. 1 62203F 3048 I 05 I 34 11 TITLE (Include Securty Clasification ) Carbon Slurry Secondary Atomization 12. PERSONAL AUTHOR(S...density, size, and induction time. Any continuing program in this area should attempt to keep these criteria in mind . IV. VOLATILE ADDITIVE STUDIES 1

  12. Transport Through Carbon Nanotube Wires

    NASA Technical Reports Server (NTRS)

    Anantram, M. P.; Yan, Jerry (Technical Monitor)

    2000-01-01

    This viewgraph presentation gives an overview of the the current carrying capacity of nanotube wires. Information is given on the motivation for the research, models and assumptions, Bragg reflection and Zener tunneling effects, and the influence of defects. Results show that dI/dv versus V does not increase in a manner commensurate with the increase in the number of subbands; in small diameter nanotubes, Zener tunneling is ineffective; Zener tunneling contributes to current with increase in nanotube diameter; and the increase in dI/dV with bias is much smaller than the increase in the number of subbands.

  13. Self-organization of atom wires on vicinal surfaces

    NASA Astrophysics Data System (ADS)

    Snijders, Paul

    2008-03-01

    Self-organization is possibly the best way to produce nanostructures in large quantities. This also holds for the ultimate 1D system, atom wires; they can be self-assembled in large arrays on vicinal Si surfaces. Such atom wire systems often show intriguing electronic properties such as competing charge density waves and spin-orbit split one-dimensional bands. However, because of their low dimensionality, these wires also frequently show profound thermodynamic fluctuations that limit their structural uniformity and have a large influence on their electronic properties. Therefore, in this talk I will focus on structural fluctuations in Ga atom wires self-organized on the Si(112) surface. In these atom wires, strain-relieving adatom vacancies self-organize into meandering vacancy lines (VLs) similar to the well-known nx2 superstructures for Ge on Si(100). The average spacing between these line defects can be experimentally controlled continuously by adjusting the chemical potential μ of the Ga adatoms. Significant VL correlations are discovered in STM experiments that cannot be captured within a mean field analysis. These structural flucuations are well described by a new lattice model that combines Density Functional Theory (DFT) calculations for perfectly ordered structures with the fluctuating disorder seen in experiment, and the experimental control parameter μ. This hybrid approach of lattice modeling and DFT can be applied to other examples of line defects in hetero-epitaxy, especially in cases where correlation effects are significant and a mean field approach is not valid.

  14. Reaction and protection of electrical wire insulators in atomic-oxygen environments

    NASA Astrophysics Data System (ADS)

    Hung, Ching-Cheh; Cantrell, Gidget

    1994-11-01

    Atomic-oxygen erosion on spacecraft in low Earth orbit is an issue which is becoming increasingly important because of the growing number of spacecraft that will fly in the orbits which have high concentrations of atomic oxygen. In this investigation, the atomic-oxygen durability of three types of electrical wire insulation (carbon-based, fluoropolymer, and polysiloxane elastomer) were evaluated. These insulation materials were exposed to thermal-energy atomic oxygen, which was obtained by RF excitation of air at a pressure of 11-20 Pa. The effects of atomic-oxygen exposure on insulation materials indicate that all carbon-based materials erode at about the same rate as polyamide Kapton and, therefore, are not atomic-oxygen durable. However, the durability of fluoropolymers needs to be evaluated on a case by case basis because the erosion rates of fluoropolymers vary widely. For example, experimental data suggest the formation of atomic fluorine during atomic-oxygen amorphous-fluorocarbon reactions. Dimethyl polysiloxanes (silicone) do not lose mass during atomic-oxygen exposure, but develop silica surfaces which are under tension and frequently crack as a result of loss of methyl groups. However, if the silicone sample surfaces were properly pretreated to provide a certain roughness, atomic oxygen exposure resulted in a sturdy, non-cracked atomic-oxygen durable SiO2 layer. Since the surface does not crack during such silicone-atomic oxygen reaction, the crack-induced contamination by silicone can be reduced or completely stopped. Therefore, with proper pretreatment, silicone can be either a wire insulation material or a coating on wire insulation materials to provide atomic-oxygen durability.

  15. Reaction and Protection of Electrical Wire Insulators in Atomic-oxygen Environments

    NASA Technical Reports Server (NTRS)

    Hung, Ching-Cheh; Cantrell, Gidget

    1994-01-01

    Atomic-oxygen erosion on spacecraft in low Earth orbit is an issue which is becoming increasingly important because of the growing number of spacecraft that will fly in the orbits which have high concentrations of atomic oxygen. In this investigation, the atomic-oxygen durability of three types of electrical wire insulation (carbon-based, fluoropolymer, and polysiloxane elastomer) were evaluated. These insulation materials were exposed to thermal-energy atomic oxygen, which was obtained by RF excitation of air at a pressure of 11-20 Pa. The effects of atomic-oxygen exposure on insulation materials indicate that all carbon-based materials erode at about the same rate as polyamide Kapton and, therefore, are not atomic-oxygen durable. However, the durability of fluoropolymers needs to be evaluated on a case by case basis because the erosion rates of fluoropolymers vary widely. For example, experimental data suggest the formation of atomic fluorine during atomic-oxygen amorphous-fluorocarbon reactions. Dimethyl polysiloxanes (silicone) do not lose mass during atomic-oxygen exposure, but develop silica surfaces which are under tension and frequently crack as a result of loss of methyl groups. However, if the silicone sample surfaces were properly pretreated to provide a certain roughness, atomic oxygen exposure resulted in a sturdy, non-cracked atomic-oxygen durable SiO2 layer. Since the surface does not crack during such silicone-atomic oxygen reaction, the crack-induced contamination by silicone can be reduced or completely stopped. Therefore, with proper pretreatment, silicone can be either a wire insulation material or a coating on wire insulation materials to provide atomic-oxygen durability.

  16. Coupled atomic wires in a synthetic magnetic field

    NASA Astrophysics Data System (ADS)

    Budich, J. C.; Elben, A.; ŁÄ cki, M.; Sterdyniak, A.; Baranov, M. A.; Zoller, P.

    2017-04-01

    We propose and study systems of coupled atomic wires in a perpendicular synthetic magnetic field as a platform to realize exotic phases of quantum matter. This includes (fractional) quantum Hall states in arrays of many wires inspired by the pioneering work [C. L. Kane et al., Phys. Rev. Lett. 88, 036401 (2002), 10.1103/PhysRevLett.88.036401], as well as Meissner phases and vortex phases in double wires. With one continuous and one discrete spatial dimension, the proposed setup naturally complements recently realized discrete counterparts, i.e., the Harper-Hofstadter model and the two-leg flux ladder, respectively. We present both an in-depth theoretical study and a detailed experimental proposal to make the unique properties of the semicontinuous Harper-Hofstadter model accessible with cold-atom experiments. For the minimal setup of a double wire, we explore how a subwavelength spacing of the wires can be implemented. This construction increases the relevant energy scales by at least an order of magnitude compared to ordinary optical lattices, thus rendering subtle many-body phenomena such as Lifshitz transitions in Fermi gases observable in an experimentally realistic parameter regime. For arrays of many wires, we discuss the emergence of Chern bands with readily tunable flatness of the dispersion and show how fractional quantum Hall states can be stabilized in such systems. Using for the creation of optical potentials Laguerre-Gauss beams that carry orbital angular momentum, we detail how the coupled atomic wire setups can be realized in nonplanar geometries such as cylinders, disks, and tori.

  17. Atomic Configuration and Conductance of Tantalum Single-Atom Contacts and Single-Atom Wires

    NASA Astrophysics Data System (ADS)

    Kizuka, Tokushi; Murata, Satoshi

    2017-09-01

    The tensile deformation and successive fracture process of tantalum (Ta) nanocontacts (NCs) while applying various bias voltages was observed in situ by high-resolution transmission electron microscopy using a picometer-precision dual-goniometer nanotip manipulation technique. Simultaneously, the variation in the conductance of the contacts was measured. The NCs were thinned atom by atom during mechanical elongation, resulting in the formation of two types of single-atom cross-sectional contacts: single-atom contacts (SACs) and single-atom wires (SAWs), in which two electrodes, typically nanotips, are connected by a single shared atom or a one-line array of single atoms, respectively. When the bias voltage was 11 mV, Ta SACs were formed during tensile deformation; however, elongation of the single-atom cross-sectional part did not occur. In contrast, when the bias voltage was increased to 200 mV, Ta SACs were first formed during the tensile deformation, followed by elongation of the single-atom cross section up to a length of three atoms, i.e., the formation of SAWs. Thus, the present observation shows that Ta SAWs are stable even at such a high bias voltage. The conductance of the SACs was approximately 0.10G0 (G0 = 2e2/h, where e is the electron charge and h is Planck’s constant), whereas the conductance of the three-atom-long SAWs ranged from 0.01G0 to 0.22G0. Lower conductances were observed for linear SAWs, whereas higher conductances resulted from kinked SAWs.

  18. Quantum conductance of silicon-doped carbon wire nanojunctions

    PubMed Central

    2012-01-01

    Unknown quantum electronic conductance across nanojunctions made of silicon-doped carbon wires between carbon leads is investigated. This is done by an appropriate generalization of the phase field matching theory for the multi-scattering processes of electronic excitations at the nanojunction and the use of the tight-binding method. Our calculations of the electronic band structures for carbon, silicon, and diatomic silicon carbide are matched with the available corresponding density functional theory results to optimize the required tight-binding parameters. Silicon and carbon atoms are treated on the same footing by characterizing each with their corresponding orbitals. Several types of nanojunctions are analyzed to sample their behavior under different atomic configurations. We calculate for each nanojunction the individual contributions to the quantum conductance for the propagating σ, Π, and σ∗electron incidents from the carbon leads. The calculated results show a number of remarkable features, which include the influence of the ordered periodic configurations of silicon-carbon pairs and the suppression of quantum conductance due to minimum substitutional disorder and artificially organized symmetry on these nanojunctions. Our results also demonstrate that the phase field matching theory is an efficient tool to treat the quantum conductance of complex molecular nanojunctions. PMID:23130998

  19. Low carbon dual phase steels for high strength wire

    SciTech Connect

    Thomas, G.; Ahn, J.H.

    1985-08-01

    This paper shows that dual phase steels can be designed and processed as new, economical low carbon steels for cold drawing into high tensile strength steel wires. Current work indicates wires of tensile strengths up to 400,000 psi can be obtained. Potential applications for dual phase steel wire include bead wire, tire cord, wire rope and prestressed concrete. It should be possible to produce wire rods in existing rod mills by adapting the controlled rolling and quenching procedures outlined in this paper.

  20. Carbon wire chamber at sub-atmospheric pressure

    NASA Astrophysics Data System (ADS)

    Charles, G.; Audouin, L.; Bettane, J.; Dupre, R.; Genolini, B.; Hammoudi, N.; Imre, M.; Le Ven, V.; Maroni, A.; Mathon, B.; Nguyen Trung, T.; Rauly, E.

    2017-05-01

    Present in many experiments, wire and drift chambers have been used in a large variety of shapes and configurations during the last decades. Nevertheless, their readout elements has not evolved much: tungsten, sometimes gold-plated or aluminum, wires. By taking advantage of the developments in the manufacture of conducting carbon fiber, we could obtain interesting improvements for wire detectors. In this article, we present recent tests and simulations using carbon fibers to readout signal in place of traditional tungsten wires. Unlike metallic wires, their low weight guaranties a reduced quantity of material in the active area.

  1. From carbon nanotubes to carbon atomic chains

    NASA Astrophysics Data System (ADS)

    Casillas García, Gilberto; Zhang, Weijia; José-Yacamán, Miguel

    2010-10-01

    Carbyne is a linear allotrope of carbon. It is formed by a linear arrangement of carbon atoms with sp-hybridization. We present a reliable and reproducible experiment to obtain these carbon atomic chains using few-layer-graphene (FLG) sheets and a HRTEM. First the FLG sheets were synthesized from worm-like exfoliated graphite and then drop-casted on a lacey-carbon copper grid. Once in the TEM, two holes are opened near each other in a FLG sheet by focusing the electron beam into a small spot. Due to the radiation, the carbon atoms rearrange themselves between the two holes and form carbon fibers. The beam is concentrated on the carbon fibers in order excite the atoms and induce a tension until multi wall carbon nanotube (MWCNT) is formed. As the radiation continues the MWCNT breaks down until there is only a single wall carbon nanotube (SWCNT). Then, when the SWCNT breaks, an atomic carbon chain is formed, lasts for several seconds under the radiation and finally breaks. This demonstrates the stability of this carbon structure.

  2. Rectification in substituted atomic wires: a theoretical insight.

    PubMed

    Asai, Yoshihiro

    2012-04-25

    Recently, there have been discussions that the giant diode property found experimentally in diblock molecular junctions could be enhanced by the many-body electron correlation effect beyond the mean field theory. In addition, the effect of electron-phonon scattering on an electric current through the diode molecule, measured by inelastic tunneling spectroscopy (IETS), was found to be symmetric with respect to the voltage sign change even though the current is asymmetric. The reason for this behavior is a matter of speculation. In order to clarify whether or not this feature is limited to organic molecules in the off-resonant tunneling region, we discuss the current asymmetry effect on IETS in the resonant region. We introduced heterogeneous atoms into an atomic wire and found that IETS becomes asymmetric in this substituted atomic wire case. Our conclusion gives the other example of intrinsic differences between organic molecules and metallic wires. While the contribution of electron-phonon scattering to IETS is not affected by the current asymmetry in the former case, it is affected in the latter case. The importance of the contribution of the electron-hole excitation to phonon damping in bringing about the current asymmetry effect in IETS in the latter case is discussed.

  3. Iridium wire grid polarizer fabricated using atomic layer deposition.

    PubMed

    Weber, Thomas; Käsebier, Thomas; Szeghalmi, Adriana; Knez, Mato; Kley, Ernst-Bernhard; Tünnermann, Andreas

    2011-10-25

    In this work, an effective multistep process toward fabrication of an iridium wire grid polarizer for UV applications involving a frequency doubling process based on ultrafast electron beam lithography and atomic layer deposition is presented. The choice of iridium as grating material is based on its good optical properties and a superior oxidation resistance. Furthermore, atomic layer deposition of iridium allows a precise adjustment of the structural parameters of the grating much better than other deposition techniques like sputtering for example. At the target wavelength of 250 nm, a transmission of about 45% and an extinction ratio of 87 are achieved.

  4. Origin of metallicity in atomic Ag wires on Si(557)

    NASA Astrophysics Data System (ADS)

    Krieg, U.; Lichtenstein, T.; Brand, C.; Tegenkamp, C.; Pfnür, H.

    2015-04-01

    We investigated the metallicity of Ag-\\sqrt{3} ordered atomic wires close to one monolayer (ML) coverage, which are formed on Si(557) via self assembly. For this purpose we combined high resolution electron energy loss spectroscopy with tunneling microscopy. By extending the excess Ag coverage up to 0.6 ML on samples annealed at high temperatures where partial desorption occurs, we demonstrate that one-dimensional metallicity in the Ag-\\sqrt{3}× \\sqrt{3} R30° ordered atomic wires on the (111) mini-terraces originates only from Ag atoms in excess of (local) monolayer coverage, which are adsorbed and localized at the highly stepped parts of the Si(557) surface. Thus these Ag atoms act as extrinsic dopants on the atomic scale, causing coverage dependent subband filling and increasing localization as a function of doping concentration. The second layer lattice gas as well as Ag islands on the (111) terraces turn out not to be relevant as dopants. We simulated the peculiar saturation behavior within a modified lattice gas model and give evidence that the preparation dependent saturation of doping is due to changes of average terrace size and step morphology induced by high temperature treatment.

  5. Atomic transportation via carbon nanotubes.

    PubMed

    Wang, Quan

    2009-01-01

    The transportation of helium atoms in a single-walled carbon nanotube is reported via molecular dynamics simulations. The efficiency of the atomic transportation is found to be dependent on the type of the applied loading and the loading rate as well as the temperature in the process. Simulations show the transportation is a result of the van der Waals force between the nanotube and the helium atoms through a kink propagation initiated in the nanotube.

  6. Facile Synthetic Route to Atomically Thin Conductive Wires from Single-Species Molecules in One-Dimensionally Confined Space: Doped Conjugated Polymers inside Single-Walled Carbon Nanotubes.

    PubMed

    Sasaki, Makoto; Koyama, Takeshi; Kishida, Hideo; Asaka, Koji; Saito, Yahachi; Yoshida, Yukihiro; Saito, Gunzi

    2017-04-20

    A facile synthetic method for doped conjugated molecules by a heating process is demonstrated. Br-terminated terthiophene precursors are encapsulated in single-walled carbon nanotubes by a vapor-phase reaction, and additional heat treatment promotes the thermal condensation of the precursors. Transmission electron microscopy observations and optical measurements show the successful synthesis of sexithiophenes and their doping (oxidation) by Br dopants generated by the condensation reaction. This study provides a new strategy for the synthesis of the doped conjugated polymers from single-species molecules by only a heating process.

  7. Electronic instabilities in self-assembled atom wires

    SciTech Connect

    Snijders, Paul C; Weitering, Harm H

    2010-01-01

    Low dimensional systems have fascinated physicists for a long time due to their unusual properties such as charge fractionalization, semionic statistics, and Luttinger liquid behavior among others. In nature, however, low dimensional systems often suffer from thermal fluctuations that can make these systems structurally unstable. Human beings, however, can trick nature by producing artificial structures which are not naturally produced. This Colloquium reviews the problem of self-assembled atomic wires on solid surfaces from an experimental and theoretical point of view. These materials represent a class of one-dimensional systems with very unusual properties that can open doors to the study of exotic physics that cannot be studied otherwise.

  8. Numerical simulation of charged wire interferometer for atoms

    NASA Astrophysics Data System (ADS)

    Yang, Hai-Feng; Tan, Yong-Gang; Hu, Yao-Hua

    2016-10-01

    In recent paper, Nowak et al. report a charged wire interferometer for atoms, and employ analytical method to explain the interference patterns [Phys. Rev. Lett. 81 (1998) 5792]. In this paper, a numerical calculation with semi-classical method is carried out and the experimental patterns are rebuilt very well. The interference patterns are interpreted by path integral. We also calculate the fringe period for different voltages and the agreement with experiment is more rigorous than the analytical expression. Besides, the fringe visibility of the interference patterns at different applied voltages and degrees is also discussed.

  9. Crewmember repairing the Regenerative Carbon Dioxide Removal System wiring.

    NASA Technical Reports Server (NTRS)

    1992-01-01

    Mission Pilot Ken Bowersox, busy at work on the wiring harness for the Regenerative Carbon Dioxide Removal System located under the mid deck floor. Photo shows Bowersox splicing wires together to 'fool' a faulty sensor that caused the 'air conditioner' to shut down.

  10. Quantum Transport in Gated Dangling-Bond Atomic Wires.

    PubMed

    Bohloul, S; Shi, Q; Wolkow, Robert A; Guo, Hong

    2017-01-11

    A single line of dangling bonds (DBs) on Si(100)-2 × 1:H surface forms a perfect metallic atomic-wire. In this work, we investigate quantum transport properties of such dangling bond wires (DBWs) by a state-of-the-art first-principles technique. It is found that the conductance of the DBW can be gated by electrostatic potential and orbital overlap due to only a single DB center (DBC) within a distance of ∼16 Å from the DBW. The gating effect is more pronounced for two DBCs and especially, when these two DB "gates" are within ∼3.9 Å from each other. These effective length scales are in excellent agreement with those measured in scanning tunnelling microscope experiments. By analyzing transmission spectrum and density of states of DBC-DBW systems, with or without subsurface doping, for different length of the DBW, distance between DBCs and the DBW, and distance between DB gates, we conclude that charge transport in a DBW can be regulated to have both an on-state and an off-state using only one or two DBs.

  11. Carbon nanotube wires with continuous current rating exceeding 20 Amperes

    NASA Astrophysics Data System (ADS)

    Cress, Cory D.; Ganter, Matthew J.; Schauerman, Christopher M.; Soule, Karen; Rossi, Jamie E.; Lawlor, Colleen C.; Puchades, Ivan; Ubnoske, Stephen M.; Bucossi, Andrew R.; Landi, Brian J.

    2017-07-01

    A process to fabricate carbon nanotube (CNT) wires with diameters greater than 1 cm and continuous current carrying capability exceeding 20 A is demonstrated. Wires larger than 5 mm are formed using a multi-step radial densification process that begins with a densified CNT wire core followed by successive wrapping of additional CNT material to increase the wire size. This process allows for a wide range of wire diameters to be fabricated, with and without potassium tetrabromoaurate (KAuBr4) chemical doping, and the resulting electrical and thermal properties to be characterized. Electrical measurements are performed with on/off current steps to obtain the maximum current before reaching a peak CNT wire temperature of 100 °C and before failure, yielding values of instantaneous currents in excess of 45 A for KAuBr4 doped CNT wires with a diameter of 6 mm achieved prior to failure. The peak temperature of the wires at failure (˜530 °C) is correlated with the primary decomposition peak observed in thermal gravimetric analysis of a wire sample confirming that oxidation is the primary failure mode of CNT wires operated in air. The in operando stability of doped CNT wires is confirmed by monitoring the resistance and temperature, which remain largely unaltered over 40 days and 1 day for wires with 1.5 mm and 11.2 mm diameters, respectively. The 100 °C continuous current rating, or ampacity, is measured for a range of doped CNT wire diameters and corresponding linear mass densities ρL. To describe the results, a new form of the fuse-law, where the critical current is defined as I ∝ρL3 /4, is developed and shows good agreement with the experimental data. Ultimately, CNT wires are shown to be stable electrical conductors, with failure current densities in excess of 50 A in the case of a convectively cooled 11.2 mm doped CNT wire, and amenable for use in applications that have long-term, high-current demands.

  12. Modeling a ``Snap-shot'' of Cold Rydberg Atoms in the Field of a Charged Wire

    NASA Astrophysics Data System (ADS)

    Goodsell, Anne; Nawarat, Poomirat; Harper, Colleen

    2014-05-01

    We propose to cool a cloud of Rb atoms and to launch the cloud at 12 m/s toward a charge suspended wire with a cylindrically-symmetric electric field. The cloud expands slightly as it moves upward and will be illuminated by excitation light to promote these atoms into the desired Rydberg state (30S) in mid-flight. This requires de-tuning the excitation laser from the zero-field n = 30 transition to excite atoms in a region where the field causes a significant shift of the Rydberg energy levels (if the wire is charged to +10 V, the field is less than 1 / 3n5 a.u., without mixing Stark-shifted states yet). Immediately after excitation, the Rydberg atoms are located in a ring around the wire. Later studies will probe the dynamics of this ring of excited slow-moving atoms. As a method of detection, we model the effect of pulsing the wire potential to ionize the atoms. A ramp time of roughly 0.2 μs for increasing the wire potential will ``freeze'' the motion of the slow atoms; for example, a speed of 12 m/s corresponds to a distance of 2.4 μm traveled during this ramp time. This ``snap-shot'' technique may be used later to study the dynamics of Rydberg atoms around a charged wire, like previous experiments with ground-state atoms.

  13. Strong gold atom strands formed by incorporation of carbon atoms

    NASA Astrophysics Data System (ADS)

    Oshima, Yoshifumi; Kurui, Yoshihiko; Nguyen, Huy Duy; Ono, Tomoya; Takayanagi, Kunio

    2011-07-01

    Single metal atom strands have attracted significant interest because of their unique properties, such as quantization effects and a high degree of strength. Recently it was suggested that the strength of a gold atom strand can be enhanced by the insertion of an impurity atom, but it has not been experimentally investigated. Using a transmission electron microscope under ultrahigh vacuum conditions, we observed that gold atoms were pulled out one by one from a carbon-contaminated gold (111) surface to form a long atom strand. The strand was so strong that it did not break even upon bending. Supported by first-principles calculations, the strand was found to have two carbon atoms at each gold atom interval. Our observations suggest that the carbon atoms act as a glue to form a long gold atom strand.

  14. The effect of semi-infinite crystalline electrodes on transmission of gold atomic wires using DFT

    NASA Astrophysics Data System (ADS)

    Sattar, Abdul; Amjad, Raja Junaid; Yasmeen, Sumaira; Javed, Hafsa; Latif, Hamid; Mahmood, Hasan; Iqbal, Azmat; Usman, Arslan; Akhtar, Majid Niaz; Khan, Salman Naeem; Dousti, M. R.

    2016-05-01

    First principle calculations of the conductance of gold atomic wires containing chain of 3-8 atoms each with 2.39 Å bond lengths are presented using density functional theory. Three different configurations of wire/electrodes were used. For zigzag wire with semi-infinite crystalline electrodes, even-odd oscillation is observed which is consistent with the previously reported results. A lower conductance is observed for the chain in semi-infinite crystalline electrodes compared to the chains suspended in wire-like electrode. The calculated transmission spectrum for the straight and zig-zag wires suspended between semi-infinite crystalline electrodes showed suppression of transmission channels due to electron scattering occurring at the electrode-wire interface.

  15. Kinetic study on hot-wire-assisted atomic layer deposition of nickel thin films

    SciTech Connect

    Yuan, Guangjie Shimizu, Hideharu; Momose, Takeshi; Shimogaki, Yukihiro

    2014-01-15

    High-purity Ni films were deposited using hot-wire-assisted atomic layer deposition (HW-ALD) at deposition temperatures of 175, 250, and 350 °C. Negligible amount of nitrogen or carbon contamination was detected, even though the authors used NH{sub 2} radical as the reducing agent and nickelocene as the precursor. NH{sub 2} radicals were generated by the thermal decomposition of NH{sub 3} with the assist of HW and used to reduce the adsorbed metal growth precursors. To understand and improve the deposition process, the kinetics of HW-ALD were analyzed using a Langmuir-type model. Unlike remote-plasma-enhanced atomic layer deposition, HW-ALD does not lead to plasma-induced damage. This is a significant advantage, because the authors can supply sufficient NH{sub 2} radicals to deposit high-purity metallic films by adjusting the distance between the hot wire and the substrate. NH{sub 2} radicals have a short lifetime, and it was important to use a short distance between the radical generation site and substrate. Furthermore, the impurity content of the nickel films was independent of the deposition temperature, which is evidence of the temperature-independent nature of the NH{sub 2} radical flux and the reactivity of the NH{sub 2} radicals.

  16. Atomic Entanglement in Carbon Nanotubes.

    NASA Astrophysics Data System (ADS)

    Bondarev, Igor; Vlahovic, Branislav

    2006-03-01

    The development of materials that may host quantum coherent states is a critical research problem for the nearest future. Recent progress in the growth of centimeter-long small-diameter single-walled carbon nanotubes (CNs)[1] and successful experiments on the encapsulation of single atoms into CNs[2], stimulate the study of dynamical quantum processes in atomically doped CN systems. We have recently shown[3] that atomic states may be strongly coupled to vacuum surface photonic modes in the CN, thus forming quasi-1D cavity polaritons similar to those observed for quantum dots in semiconductor nanocavities[4], which were recently suggested to be a possible way to produce the excitonic qubit entanglement[5]. Here, we show that, being strongly coupled to the (resonator-like) cylindrical nanotube environment, the two atomic quasi-1D polaritons can be easily entangled as well, thus challenging a novel alternative approach towards quantum information transfer over centimeter-long distances. [1]L.X.Zheng et al, Proc. Nanotech 2005 (May 8-12, 2005, Anaheim, CA, USA), vol.3, p.126. [2]G.-H.Jeong et al, Phys. Rev. B68,075410(2003). [3]I.V.Bondarev and Ph.Lambin, in: Trends in Nanotubes Reasearch (NovaScience, NY, 2005); Phys. Rev. B70,035407(2004); Phys. Rev. B72,035451(2005). [4]T.Yoshie et al, Nature 432,200(2004). [5]S.Hughes, Phys. Rev. Lett.94,227402(2005).

  17. 77 FR 59892 - Carbon and Certain Alloy Steel Wire Rod From Mexico: Affirmative Final Determination of...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-10-01

    ... International Trade Administration Carbon and Certain Alloy Steel Wire Rod From Mexico: Affirmative Final... mm to 5.0 mm. \\1\\ See Carbon and Certain Alloy Steel Wire Rod from Mexico: Affirmative Preliminary... on said entries.\\4\\ \\2\\ See Carbon and Certain Alloy Steel Wire Rod from Mexico: Initiation of...

  18. Platinum atomic wire encapsulated in gold nanotubes: A first principle study

    SciTech Connect

    Nigam, Sandeep Majumder, Chiranjib; Sahoo, Suman K.; Sarkar, Pranab

    2014-04-24

    The nanotubes of gold incorporated with platinum atomic wire have been investigated by means of firstprinciples density functional theory with plane wave pseudopotential approximation. The structure with zig-zag chain of Pt atoms in side gold is found to be 0.73 eV lower in energy in comparison to straight chain of platinum atoms. The Fermi level of the composite tube was consisting of d-orbitals of Pt atoms. Further interaction of oxygen with these tubes reveals that while tube with zig-zag Pt prefers dissociative adsorption of oxygen molecule, the gold tube with linear Pt wire favors molecular adsorption.

  19. Selective silver atom interaction at β-SiC(100) surfaces: From anisotropic diffusion to metal atomic wires and stripes

    NASA Astrophysics Data System (ADS)

    D'Angelo, M.; Aristov, V. Yu.; Soukiassian, P.

    2007-07-01

    Silver (Ag) atom interaction on β-SiC(100) surface reconstructions is investigated by atom-resolved scanning tunneling microscopy. On the 3×2 (Si-rich) reconstruction, the adsorbate-adsorbate interaction is dominant with no surface wetting, leading to Ag cluster formation. In contrast, on the c(4×2) Si-terminated reconstruction, almost equivalent Ag-Ag and Ag-surface interactions allow selective one dimensional nano-object formation including Ag atomic wires and stripes following the substrate registry. Their orientation is mediated by anisotropic Ag atom diffusion occurring along Si-dimer rows at 25°C and perpendicularly to them at elevated temperatures, suggesting dimer flipping as diffusion barrier. These metal nanowires potentially open up cross-wiring capability in massively parallel Si atomic lines network.

  20. Dynamic polarizability of tungsten atoms reconstructed from fast electrical explosion of fine wires in vacuum

    NASA Astrophysics Data System (ADS)

    Sarkisov, G. S.; Rosenthal, S. E.; Struve, K. W.

    2016-10-01

    Nanosecond electrical explosion of fine metal wires in vacuum generates calibrated, radially expanded gas cylinders of metal atoms surrounded by a low-density fast expanding plasma corona. An integrated-phase technique, based on laser interferometry, provides the dynamic dipole polarizability of metal atoms. These data were previously unavailable for tungsten atoms. An extremely high melting temperature and significant premelt electronic emission make these measurements particularly complicated for this refractory metal. Most attempts to vaporize tungsten wire by electrical current pulse result in the disintegration of the sample into macro- and microfragments. However, application of a very fast-rising current, ˜1 kA /ns , can vaporize a thin 10-15 μm-diameter tungsten wire and generate a calibrated gas-plasma cylinder. Adding a dielectric coating to the wire leads to increased energy deposition to the wire core and a reduction of the surrounding plasma corona. Employing the integrated-phase technique on a fast-exploding coated tungsten wire, we find that the dynamic dipole polarizability of tungsten atoms at a wavelength of 532 nm equals 15 ±1.3 Å3 .

  1. Dynamic polarizability of tungsten atoms reconstructed from fast electrical explosion of fine wires in vacuum

    DOE PAGES

    Sarkisov, G. S.; Rosenthal, S. E.; Struve, K. W.

    2016-10-12

    For nanosecond electrical explosion of fine metal wires in vacuum generates calibrated, radially expanded gas cylinders of metal atoms are surrounded by low-density fast expanding plasma corona. Here, a novel integrated-phase technique, based on laser interferometry, provides the dynamic dipole polarizability of metal atoms. This data was previously unavailable for tungsten atoms. Furthermore, an extremely high melting temperature and significant pre-melt electronic emission make these measurements particularly complicated for this refractory metal.

  2. Dynamic polarizability of tungsten atoms reconstructed from fast electrical explosion of fine wires in vacuum

    SciTech Connect

    Sarkisov, G. S.; Rosenthal, S. E.; Struve, K. W.

    2016-10-12

    For nanosecond electrical explosion of fine metal wires in vacuum generates calibrated, radially expanded gas cylinders of metal atoms are surrounded by low-density fast expanding plasma corona. Here, a novel integrated-phase technique, based on laser interferometry, provides the dynamic dipole polarizability of metal atoms. This data was previously unavailable for tungsten atoms. Furthermore, an extremely high melting temperature and significant pre-melt electronic emission make these measurements particularly complicated for this refractory metal.

  3. Local Atomic Density of Microporous Carbons

    SciTech Connect

    Dmowski, Wojtek; Contescu, Cristian I.; Llobet, Anna; Gallego, Nidia C.; Egami, Takeskhi

    2012-07-12

    We investigated the structure of two disordered carbons: activated carbon fibers (ACF) and ultramicroporous carbon (UMC). These carbons have highly porous structure with large surface areas and consequently low macroscopic density that should enhance adsorption of hydrogen. We used the atomic pair distribution function to probe the local atomic arrangements. The results show that the carbons maintain an in-plane local atomic structure similar to regular graphite, but the stacking of graphitic layers is strongly disordered. Although the local atomic density of these carbons is lower than graphite, it is only {approx}20% lower and is much higher than the macroscopic density due to the porosity of the structure. For this reason, the density of graphene sheets that have optimum separation for hydrogen adsorption is lower than anticipated.

  4. Ionized Carbon Atoms in Orion

    NASA Image and Video Library

    2016-10-12

    The dusty side of the Sword of Orion is illuminated in this striking infrared image from the European Space Agency's Hershel Space Observatory. This immense nebula is the closest large region of star formation, situated about 1,500 light years away in the constellation of Orion. The parts that are easily observed in visible light, known alternatively as the Orion Nebula or Messier 42, correspond to the light blue regions. This is the glow from the warmest dust, illuminated by clusters of hot stars that have only recently been born in this chaotic region. The red spine of material running from corner to corner reveals colder, denser filaments of dust and gas that are scattered throughout the Orion nebula. In visible light this would be a dark, opaque feature, hiding the reservoir of material from which stars have recently formed and will continue to form in the future. Herschel data from the PACS instrument observations, at wavelengths of 100 and 160 microns, is displayed in blue and green, respectively, while SPIRE 250-micron data is shown in red. Within the inset image, the emission from ionized carbon atoms (C+), overlaid in yellow, was isolated and mapped out from spectrographic data obtained by the HIFI instrument. http://photojournal.jpl.nasa.gov/catalog/PIA21073

  5. Wave mechanics of a two-wire atomic beam splitter

    SciTech Connect

    Bortolotti, Daniele C.E.; Bohn, John L.

    2004-03-01

    We consider the problem of an atomic beam propagating quantum mechanically through an atom beam splitter. Casting the problem in an adiabatic representation (in the spirit of the Born-Oppenheimer approximation in molecular physics) sheds light on explicit effects due to nonadiabatic passage of the atoms through the splitter region. We are thus able to probe the fully three-dimensional structure of the beam splitter, gathering quantitative information about mode mixing, splitting ratios, and reflection and transmission probabilities.

  6. Carbon nanotube electrodes for hot-wire electrochemistry.

    PubMed

    Gründler, Peter; Frank, Otakar; Kavan, Ladislav; Dunsch, Lothar

    2009-02-23

    The use and preparation of single-walled carbon nanotubes (SWCNTs) at thin metallic wire electrodes for hot-wire electrochemical studies is described. The nanotubes were deposited on metal substrates such as gold by electrophoresis from a dispersion containing sodium dodecyl sulphate as an anionic surfactant. The formation of a layer of pure SWCNTs is achieved by thermal treatment at 350 degrees C. When heated in situ by a strong ac current, the electrodes can be used for electrochemical studies of nanotubes at increased temperatures. The state and functionality of the electrodes were characterized by Raman spectroscopy, scanning electron microscopy, and cyclic voltammetry with both anionic and cationic redox systems (dopamine, ferrocene carboxylic acid). First time experiments at the heated SWCNT electrodes demonstrated an excellent suitability of these as-prepared electrodes for thermoelectrochemical studies.

  7. Wire melting and droplet atomization in a high velocity oxy-fuel jet

    SciTech Connect

    Neiser, R.A.; Brockmann, J.E.; O`Hern, T.J.

    1995-07-01

    Coatings produced by feeding a steel wire into a high-velocity oxy-fuel (HVOF) torch are being intensively studied by the automotive industry as a cost-effective alternative to the more expensive cast iron sleeves currently used in aluminum engine blocks. The microstructure and properties of the sprayed coatings and the overall economics of the process depend critically on the melting and atomization occurring at the wire tip. This paper presents results characterizing several aspects of wire melting and droplet breakup in an HVOF device. Fluctuations in the incandescent emission of the plume one centimeter downstream from the wire tip were recorded using a fast photodiode. A Fourier transform of the light traces provided a measure of the stripping rate of molten material from the wire tip. Simultaneous in-flight measurement of atomized particle size and velocity distributions were made using a Phase Doppler Particle Analyzer (PDPA). The recorded size distributions approximate a log-normal distribution. Small particles traveled faster than large particles, but the difference was considerably smaller than simple aerodynamic drag arguments would suggest. A set of experiments was carried out to determine the effect that variations in torch gas flow rates have on wire melt rate, average particle size, and average particle velocity. The observed variation of particle size with spray condition is qualitatively consistent with a Weber breakup of the droplets coming off the wire. The measurements also showed that it was possible to significantly alter atomized particle size and velocity without appreciably changing the wire melt rate.

  8. Braiding of Atomic Majorana Fermions in Wire Networks and Implementation of the Deutsch-Jozsa Algorithm

    NASA Astrophysics Data System (ADS)

    Kraus, Christina V.; Zoller, P.; Baranov, Mikhail A.

    2013-11-01

    We propose an efficient protocol for braiding Majorana fermions realized as edge states in atomic wire networks, and demonstrate its robustness against experimentally relevant errors. The braiding of two Majorana fermions located on one side of two adjacent wires requires only a few local operations on this side which can be implemented using local site addressing available in current experiments with cold atoms and molecules. Based on this protocol we provide an experimentally feasible implementation of the Deutsch-Jozsa algorithm for two qubits in a topologically protected way.

  9. 78 FR 28190 - Carbon and Certain Alloy Steel Wire Rod From Mexico: Final Results of Antidumping Duty...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-05-14

    ... International Trade Administration Carbon and Certain Alloy Steel Wire Rod From Mexico: Final Results of... carbon and certain alloy steel wire rod (wire rod) from Mexico. The period of review (POR) is October 1... (the Act). \\1\\ See Carbon and Certain Alloy Steel Wire Rod From Mexico: Preliminary Results...

  10. Breakdown of 1D water wires inside charged carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Pant, Shashank

    2016-11-01

    Using molecular dynamics approach we investigated the structure and dynamics of water confined inside pristine and charged 6,6 carbon nanotubes (CNTs). This study reports the breakdown of 1D water wires and the emergence of triangular faced water on incorporating charges in 6,6 CNTs. Incorporation of charges results in high potential barriers to flipping of water molecules due to the formation of large number of hydrogen bonds. The PMF analyses show the presence of ∼2 kcal/mol barrier for the movement of water inside pristine CNT and almost negligible barrier in charged CNTs.

  11. Process for attaching molecular wires and devices to carbon nanotubes and compositions thereof

    NASA Technical Reports Server (NTRS)

    Tour, James M. (Inventor); Bahr, Jeffrey L. (Inventor); Yang, Jiping (Inventor)

    2008-01-01

    The present invention is directed towards processes for covalently attaching molecular wires and molecular electronic devices to carbon nanotubes and compositions thereof. Such processes utilize diazonium chemistry to bring about this marriage of wire-like nanotubes with molecular wires and molecular electronic devices.

  12. Fabrication of atomic wires on H-terminated Si (001)

    NASA Astrophysics Data System (ADS)

    Hashizume, Tomihiro

    2000-03-01

    Atomic-scale one-dimensional structures on a hydrogen-terminated Si(100)-2x1-H surface are studied by scanning tunneling microscopy/spectroscopy and the first-principles calculations. The Jahn-Teller distortion resulting from the pairing of the second-layer Si atoms of the dangling-bond (DB) linear-chain structures is observed. In a short even-numbered DB structures, an unpaired second-layer Si atom exists and behaves as a soliton accompanied by the flip-flop motion of the structure. A Ga atom on the Si(100)-2x1-H surface migrates in a linear potential well confined by adjacent dimer rows and local dihydride defects, and is observed as a continuous linear protrusion ( a Ga-bar structure) at a narrow range of temperatures near 100 K. The height of the Ga-bar structure maps out the local variation in potential energy at individual adsorption sites. [1] T. Hitosugi, S. Heike, T. Onogi, T. Hashizume, S. Watanabe, Z. -Q. Li, K. Ohno, Y. Kawazoe, T. Hasegawa, and K. Kitazawa, PRL 82, 4034 (1999). [2] T. Hitosugi, Y. Suwa, S. Matsuura, S. Heike, T. Onogi, S. Watanabe, T. Hasegawa, K. Kitazawa, and T. Hashizume, PRL 83, 4116 (1999).

  13. Stability of conductance oscillations in carbon atomic chains

    NASA Astrophysics Data System (ADS)

    Yu, Jing-Xin; Hou, Zhi-Wei; Liu, Xiu-Ying

    2015-06-01

    The conductance stabilities of carbon atomic chains (CACs) with different lengths are investigated by performing theoretical calculations using the nonequilibrium Green’s function method combined with density functional theory. Regular even-odd conductance oscillation is observed as a function of the wire length. This oscillation is influenced delicately by changes in the end carbon or sulfur atoms as well as variations in coupling strength between the chain and leads. The lowest unoccupied molecular orbital in odd-numbered chains is the main transmission channel, whereas the conductance remains relatively small for even-numbered chains and a significant drift in the highest occupied molecular orbital resonance toward higher energies is observed as the number of carbon atoms increases. The amplitude of the conductance oscillation is predicted to be relatively stable based on a thiol joint between the chain and leads. Results show that the current-voltage evolution of CACs can be affected by the chain length. The differential and second derivatives of the conductance are also provided. Project supported by the National Natural Science Foundation of China (Grant Nos. 11304079, 11404094, and 51201059), the Priority Scientific and Technological Project of Henan Province, China (Grant No. 14A140027), the School Fund (Grant No. 2012BS055), and the Plan of Natural Science Fundamental Research of Henan University of Technology, China (Grant No. 2014JCYJ15).

  14. 77 FR 66954 - Carbon and Certain Alloy Steel Wire Rod From Mexico: Preliminary Results of Antidumping Duty...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-11-08

    ... International Trade Administration Carbon and Certain Alloy Steel Wire Rod From Mexico: Preliminary Results of... on carbon and certain alloy steel wire rod (wire rod) from Mexico. The period of review is October 1... certain alloy steel wire rod. The product is currently classified under the Harmonized Tariff Schedule...

  15. Correlated atomic wires on substrates. I. Mapping to quasi-one-dimensional models

    NASA Astrophysics Data System (ADS)

    Abdelwahab, Anas; Jeckelmann, Eric; Hohenadler, Martin

    2017-07-01

    We present a theoretical study of correlated atomic wires deposited on substrates in two parts. In this first part, we propose lattice models for a one-dimensional quantum wire on a three-dimensional substrate and map them onto effective two-dimensional lattices using the Lanczos algorithm. We then discuss the approximation of these two-dimensional lattices by narrow ladder models that can be investigated with well-established methods for one-dimensional correlated quantum systems, such as the density-matrix renormalization group or bosonization. The validity of this approach is studied first for noninteracting electrons and then for a correlated wire with a Hubbard electron-electron repulsion using quantum Monte Carlo simulations. While narrow ladders cannot be used to represent wires on metallic substrates, they capture the physics of wires on insulating substrates if at least three legs are used. In the second part [Abdelwahab et al., following paper, Phys. Rev. B 96, 035446 (2017), 10.1103/PhysRevB.96.035446], we use this approach for a detailed numerical investigation of a wire with a Hubbard interaction on an insulating substrate.

  16. One-dimensional Si-in-Si(001) template for single-atom wire growth

    NASA Astrophysics Data System (ADS)

    Owen, J. H. G.; Bianco, F.; Köster, S. A.; Mazur, D.; Bowler, D. R.; Renner, Ch.

    2010-08-01

    Single atom metallic wires of arbitrary length are of immense technological and scientific interest. We present atomic-resolution scanning tunneling microscope data of a silicon-only template, which modeling predicts to enable the self-organized growth of isolated micrometer long surface and subsurface single-atom chains. It consists of a one-dimensional, defect-free Si reconstruction four dimers wide—the Haiku core—formed by hydrogenation of self-assembled Bi-nanolines on Si(001) terraces, independent of any step edges. We discuss the potential of this Si-in-Si template as an appealing alternative to vicinal surfaces for nanoscale patterning.

  17. Atomic force microscopy observation of insulated molecular wire formed by conducting polymer and molecular nanotube

    NASA Astrophysics Data System (ADS)

    Shimomura, Takeshi; Akai, Tomonori; Abe, Takumi; Ito, Kohzo

    2002-02-01

    Inclusion complex formation between a conducting polymer, polyaniline (PANI) with emeraldine base, and a molecular nanotube synthesized from α-cyclodextrin (α-CD) has been studied by atomic force microscopy. We observed a rodlike inclusion complex of PANI and the molecular nanotube on mica substrate at room temperature. The height of this structure is nearly equal to the outside diameter of α-CD and almost uniform along the whole length of the structure, which indicates that a conducting wire of PANI is fully covered by molecular nanotubes as insulator. Accordingly, this inclusion complex can be regarded as insulated molecular wire.

  18. 78 FR 2658 - Carbon and Certain Alloy Steel Wire Rod From Mexico: Rescission of Antidumping Duty...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-01-14

    ... From the Federal Register Online via the Government Publishing Office DEPARTMENT OF COMMERCE International Trade Administration Carbon and Certain Alloy Steel Wire Rod From Mexico: Rescission of... its administrative review of the antidumping duty order on carbon and certain alloy steel wire...

  19. Conductance decay of a surface hydrogen tunneling junction fabricated along a Si(001)- (2×1) -H atomic wire

    NASA Astrophysics Data System (ADS)

    Kawai, Hiroyo; Yeo, Yong Kiat; Saeys, Mark; Joachim, Christian

    2010-05-01

    On a Si(001)- (2×1) -H substrate, electrons tunneling through hydrogen atomic junctions fabricated between two surface dangling-bond (DB) wires are theoretically investigated using the elastic-scattering quantum-chemistry method. The surface states introduced in the Si band gap by removing H atoms from a Si(001)- (2×1) -H surface were calculated and also analyzed using a simple tight-binding model. The two-channel surface conductance of a DB wire results from a combination of through-space and through-lattice electronic couplings between DB states. The conductance of the DB wire-H-junction-DB wire structure decreases exponentially with the length of H junction with an inverse decay rate ranging from 0.20 to 0.23Å-1 , depending on the energy. When the DB wire-H-junction-DB wire structure is contacted by Au nanoelectrodes, the transmission resonances corresponding to the DB wire states split, demonstrating a coupling of the DB wires through short surface hydrogen atomic junctions. This splitting decreases with the length of H junction between the DB wires with an inverse decay length ranging from 0.22 to 0.44Å-1 , indicating that such an atomic scale surface tunneling junction is not a very good insulator.

  20. Formation of indium arsenide atomic wires on the In/Si(111)-4 × 1 surface

    NASA Astrophysics Data System (ADS)

    Guerrero-Sánchez, J.

    2017-03-01

    Density functional theory calculations have been applied to describe the formation of InAs atomic-size wires on the In/Si(111)-4 × 1 surface. Two different coverages, ¼ ML and ½ ML, were considered. We have taken in to consideration different high symmetry sites for As adsorption. At ¼ ML coverage, in the energetically stable configuration, As and In atoms form atomic wires. Upon increasing the coverage up to ½ ML of As, a pair of InAs atomic wires are formed. Surface formation energy calculations help to clarify the stability ranges of these structures: for arsenic poor conditions the stable configuration corresponds to the In/Si(111)-4 × 1 surface (with no As atoms). Increasing the arsenic content, for intermediate to rich As conditions, results in the formation of an InAs wire. At the arsenic rich limit, the formation of two InAs wires is favorable. The InAs wires are highly symmetric, and charge density distributions and projected density of states show the covalent character of the Insbnd As bonds of the wire. These results demonstrate that the In/Si(111)-4 × 1 surface may be used as a substrate to growth quasi-unidimensional InAs wires.

  1. Wiring-up hydrogenase with single-walled carbon nanotubes.

    PubMed

    McDonald, Timothy J; Svedruzic, Drazenka; Kim, Yong-Hyun; Blackburn, Jeffrey L; Zhang, S B; King, Paul W; Heben, Michael J

    2007-11-01

    Many envision a future where hydrogen is the centerpiece of a sustainable, carbon-free energy supply. For example, the energy in sunlight may be stored by splitting water into H2 and O2 using inorganic semiconductors and photoelectrochemical approaches or with artificial photosynthetic systems that seek to mimic the light absorption, energy transfer, electron transfer, and redox catalysis that occurs in green plants. Unfortunately, large scale deployment of artificial water-splitting technologies may be impeded by the need for the large amounts of precious metals required to catalyze the multielectron water-splitting reactions. Nature provides a variety of microbes that can activate the dihydrogen bond through the catalytic activity of [NiFe] and [FeFe] hydrogenases, and photobiological approaches to water splitting have been advanced. One may also consider a biohybrid approach; however, it is difficult to interface these sensitive, metalloenzymes to other materials and systems. Here we show that surfactant-suspended carbon single-walled nanotubes (SWNTs) spontaneously self-assemble with [FeFe] hydrogenases in solution to form catalytically active biohybrids. Photoluminescence excitation and Raman spectroscopy studies show that SWNTs act as molecular wires to make electrical contact to the biocatalytic region of hydrogenase. Hydrogenase mediates electron injection into nanotubes having appropriately positioned lowest occupied molecular orbital levels when the H2 partial pressure is varied. The hydrogenase is strongly attached to the SWNTs, so mass transport effects are eliminated and the absolute potential of the electronic levels of the nanotubes can be unambiguously measured. Our findings reveal new nanotube physics and represent the first example of "wiring-up" an hydrogenase with another nanoscale material. This latter advance offers a nonprecious metal route to the design of new biohybrid architectures and building blocks for hydrogen-related technologies.

  2. Electronic conductance via atomic wires: a phase field matching theory approach

    NASA Astrophysics Data System (ADS)

    Szczęśniak, D.; Khater, A.

    2012-06-01

    A model is presented for the quantum transport of electrons, across finite atomic wire nanojunctions between electric leads, at zero bias limit. In order to derive the appropriate transmission and reflection spectra, familiar in the Landauer-Büttiker formalism, we develop the algebraic phase field matching theory (PFMT). In particular, we apply our model calculations to determine the electronic conductance for freely suspended monatomic linear sodium wires (MLNaW) between leads of the same element, and for the diatomic copper-cobalt wires (DLCuCoW) between copper leads on a Cu(111) substrate. Calculations for the MLNaW system confirm the correctness and functionality of our PFMT approach. We present novel transmission spectra for this system, and show that its transport properties exhibit the conductance oscillations for the odd- and even-number wires in agreement with previously reported first-principle results. The numerical calculations for the DLCuCoW wire nanojunctions are motivated by the stability of these systems at low temperatures. Our results for the transmission spectra yield for this system, at its Fermi energy, a monotonic exponential decay of the conductance with increasing wire length of the Cu-Co pairs. This is a cumulative effect which is discussed in detail in the present work, and may prove useful for applications in nanocircuits. Furthermore, our PFMT formalism can be considered as a compact and efficient tool for the study of the electronic quantum transport for a wide range of nanomaterial wire systems. It provides a trade-off in computational efficiency and predictive capability as compared to slower first-principle based methods, and has the potential to treat the conductance properties of more complex molecular nanojunctions.

  3. Effect of roller die drawing on structure, texture and other properties of high carbon steel wires

    NASA Astrophysics Data System (ADS)

    Pilarczyk, Jan W.; Dyja, Henryk; Golis, Bogdan; Tabuda, Elzbieta

    1998-08-01

    In the work the effect of application of roller dies in process of drawing of high carbon steel wires for their structure, texture, residual stresses, surface roughness and mechanical properties has been investigated. Among structural features alignment of cementite lamellae to the wire axis by means of SEM and Pericolor 1500 has been quantitatively determined. Degree of cementite lamellae fracture in colonies parallel to wire axis has been estimated by Langford method. Obtained results were compared with those structural features for conventionally and hydrodynamically drawn wires. It has been found that degree of alignment of cementite lamellae in wires drawn in roller dies was smaller than in wires drawn conventionally and hydrodynamically but in the case of fracture degree the opposite result was noticed. Residual stresses were determined by electrochemical reversal pickling in water solution of sulphuric acid. A significant drop of longitudinal residual stresses in surface layer of wires drawn in roller die has been observed as compared to those stresses for conventionally and hydrodynamically drawn wires. Surface roughness of wires was measured with FORM TALYSURF profilographometer. It has been proved thad roller die drawing has formed very smooth surface with much smaller longitudinal and circumferential roghness parameters that for surface of wires drawn conventionally and hydrodynamically. In the work the tensile, yield and fatigue strength of tested wires were determined. It has been concluded that roller die drawing has many advantages as compared to conventional process and should be implemented in wire industry for larger scale.

  4. Detection of gas atoms with carbon nanotubes

    PubMed Central

    Arash, B.; Wang, Q.

    2013-01-01

    Owning to their unparalleled sensitivity resolution, nanomechanical resonators have excellent capabilities in design of nano-sensors for gas detection. The current challenge is to develop new designs of the resonators for differentiating distinct gas atoms with a recognizably high sensitivity. In this work, the characteristics of impulse wave propagation in carbon nanotube-based sensors are investigated using molecular dynamics simulations to provide a new method for detection of noble gases. A sensitivity index based on wave velocity shifts in a single-walled carbon nanotube, induced by surrounding gas atoms, is defined to explore the efficiency of the nano-sensor. The simulation results indicate that the nano-sensor is able to differentiate distinct noble gases at the same environmental temperature and pressure. The inertia and the strengthening effects by the gases on wave characteristics of carbon nanotubes are particularly discussed, and a continuum mechanics shell model is developed to interpret the effects.

  5. 78 FR 33103 - Carbon and Certain Alloy Steel Wire Rod From Brazil, Indonesia, Mexico, Moldova, Trinidad and...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-06-03

    ... countervailing duty order on carbon and certain alloy steel wire rod (``wire rod'') from Brazil and the antidumping duty orders on wire rod from Brazil, Indonesia, Mexico, Moldova, Trinidad and Tobago, and Ukraine... (``Commerce'') issued a countervailing duty order on imports of wire rod from Brazil (67 FR 64871). On October...

  6. 78 FR 60850 - Carbon and Certain Alloy Steel Wire Rod From Brazil: Final Results of the Expedited Second Sunset...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-10-02

    ... International Trade Administration Carbon and Certain Alloy Steel Wire Rod From Brazil: Final Results of the... certain alloy steel wire rod (wire rod) from Brazil would be likely to lead to continuation or recurrence... Alloy Steel Wire Rod from Brazil, 67 FR 55805 (August 30, 2002). \\2\\ See Initiation of...

  7. Atomization and merging of two Al and W wires driven by a 1 kA, 10 ns current pulse

    NASA Astrophysics Data System (ADS)

    Wu, Jian; Li, Xingwen; Lu, Yihan; Lebedev, S. V.; Yang, Zefeng; Jia, Shenli; Qiu, Aici

    2016-11-01

    Possibility of preconditioning of wires in wire array Z-pinch loads by an auxiliary low-level current pulse was investigated in experiments with two aluminum or two polyimide-coated tungsten wires. It was found that the application of a 1 kA, 10 ns current pulse could convert all the length of the Al wires (1 cm long, 15 μm diameter) and ˜70% of length of the W wires (1 cm long, 15 μm diameter, 2 μm polyimide coating) into a gaseous state via ohmic heating. The expansion and merging of the wires, positioned at separations of 1-3 mm, were investigated with two-wavelength (532 nm and 1064 nm) laser interferometry. The gasified wire expanded freely in a vacuum and its density distribution at different times could be well described using an analytic model for the expansion of the gas into vacuum. Under an energy deposition around its atomization enthalpy of the wire material, the aluminum vapor column had an expansion velocity of 5-7 km/s, larger than the value of ˜4 km/s from tungsten wires. The dynamic atomic polarizabilities of tungsten for 532 nm and 1064 nm were also estimated.

  8. High conductivity carbon nanotube wires from radial densification and ionic doping

    NASA Astrophysics Data System (ADS)

    Alvarenga, Jack; Jarosz, Paul R.; Schauerman, Chris M.; Moses, Brian T.; Landi, Brian J.; Cress, Cory D.; Raffaelle, Ryne P.

    2010-11-01

    Application of drawing dies to radially densify sheets of carbon nanotubes (CNTs) into bulk wires has shown the ability to control electrical conductivity and wire density. Simultaneous use of KAuBr4 doping solution, during wire drawing, has led to an electrical conductivity in the CNT wire of 1.3×106 S/m. Temperature-dependent electrical measurements show that conduction is dominated by fluctuation-assisted tunneling, and introduction of KAuBr4 significantly reduces the tunneling barrier between individual nanotubes. Ultimately, the concomitant doping and densification process leads to closer packed CNTs and a reduced charge transfer barrier, resulting in enhanced bulk electrical conductivity.

  9. Solution chemistry approach to fabricate vertically aligned carbon nanotubes on gold wires: towards vertically integrated electronics

    NASA Astrophysics Data System (ADS)

    Flavel, Benjamin S.; Yu, Jingxian; Ellis, Amanda V.; Quinton, Jamie S.; Shapter, Joseph G.

    2008-11-01

    A monolayer of hexadecyltrichlorosilane, 3-aminopropyltriethoxysilane or 3-mercaptopropyltrimethoxysilane was self-assembled onto a p-type silicon (100) substrate to provide a resist for electrochemical anodization with an atomic force microscope cantilever. Silane treatment of the oxide nanostructures created by anodization lithography allowed for the creation of a chemically heterogeneous surface, containing regions of -NH2 or -SH surrounded by -CH3 functionality. These patterned regions of -NH2 or -SH provided the point of attachment for citrate-stabilized gold colloid nanoparticles, which act as 'seed' particles for the electro-less deposition of gold. This has allowed the creation of gold wires on a silicon surface. Carbon nanotubes, with high carboxylic acid functionality, were vertically immobilized on the patterned gold wires with the use of a cysteamine monolayer and a condensation reaction. Such a material may prove useful in the creation of future vertically integrated electronic devices where it is desirable for electron transport to be in three dimensions and this electron transport is demonstrated with cyclic voltammetry.

  10. 78 FR 76653 - Carbon and Certain Alloy Steel Wire Rod From Brazil, Indonesia, Mexico, Moldova, Trinidad and...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-12-18

    ... Certain Alloy Steel Wire Rod From Brazil, Indonesia, Mexico, Moldova, Trinidad and Tobago, and Ukraine Scheduling of full five-year reviews concerning the countervailing duty order on carbon and certain alloy steel ] wire rod from Brazil and the antidumping duty orders on carbon and certain alloy steel wire...

  11. 78 FR 60316 - Carbon and Certain Alloy Steel Wire Rod From Brazil, Indonesia, Mexico, Moldova, Trinidad and...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-10-01

    ... Certain Alloy Steel Wire Rod From Brazil, Indonesia, Mexico, Moldova, Trinidad and Tobago, and Ukraine... determine whether revocation of the countervailing duty order on carbon and certain alloy steel wire rod from Brazil and antidumping duty orders on carbon and certain alloy steel wire rod from...

  12. Modeling Ballistic Current Flow in Carbon Nanotube Wires

    NASA Technical Reports Server (NTRS)

    Anantram, M. P.; Biegel, Bryan (Technical Monitor)

    2001-01-01

    Experiments have shown carbon nanotubes (CNT) to be almost perfect conductors at small applied biases. The features of the CNT band structure, large velocity of the crossing subbands and the small number of modes that an electron close to the band center / Fermi energy can scatter into, are the reasons for the near perfect small bias conductance. We show that the CNT band structure does not help at large applied biases - electrons injected into the non crossing subbands can either be Bragg reflected or undergo Zener-type tunneling. This limits the current carrying capacity of CNT. We point out that the current carrying capacity of semiconductor quantum wires in the ballistic limit is different, owing to its band structure. The second aspect addressed is the relationship of nanotube chirality in determining the physics of metal-nanotube coupling. We show that a metallic-zigzag nanotube couples better than an armchair nanotube to a metal contact. This arises because in the case of armchair nanotubes, while the pi band couples well, the pi* band does not couple well to the metal. In the case of zigzag nanotube both crossing modes couple reasonably well to the metal. Many factors such as the role of curvature, strain and defects will play a role in determining the suitability of nanotubes as nanowires. From the limited view point of metal-nanotube coupling, we feel that metallic-zigzag nanotubes are preferable to armchair nanotubes.

  13. Atomic resolution studies of carbonic anhydrase II

    PubMed Central

    Behnke, Craig A.; Le Trong, Isolde; Godden, Jeff W.; Merritt, Ethan A.; Teller, David C.; Bajorath, Jürgen; Stenkamp, Ronald E.

    2010-01-01

    Carbonic anhydrase has been well studied structurally and functionally owing to its importance in respiration. A large number of X-ray crystallographic structures of carbonic anhydrase and its inhibitor complexes have been determined, some at atomic resolution. Structure determination of a sulfonamide-containing inhibitor complex has been carried out and the structure was refined at 0.9 Å resolution with anisotropic atomic displacement parameters to an R value of 0.141. The structure is similar to those of other carbonic anhydrase complexes, with the inhibitor providing a fourth nonprotein ligand to the active-site zinc. Comparison of this structure with 13 other atomic resolution (higher than 1.25 Å) isomorphous carbonic anhydrase structures provides a view of the structural similarity and variability in a series of crystal structures. At the center of the protein the structures superpose very well. The metal complexes superpose (with only two exceptions) with standard deviations of 0.01 Å in some zinc–protein and zinc–ligand bond lengths. In contrast, regions of structural variability are found on the protein surface, possibly owing to flexibility and disorder in the individual structures, differences in the chemical and crystalline environments or the different approaches used by different investigators to model weak or complicated electron-density maps. These findings suggest that care must be taken in interpreting structural details on protein surfaces on the basis of individual X-ray structures, even if atomic resolution data are available. PMID:20445237

  14. Measurement of Dynamic Atomic Dipole Polarizability for Tungsten and Molybdenum using Integrated Phase Technique and Electrical Exploding Wires in Vacuum

    NASA Astrophysics Data System (ADS)

    Sarkisov, G. S.; Cowan, T. E.; Rosenthal, S. E.; Struve, K. W.

    2006-10-01

    The Integrated Phase Technique [1] was applied to measure dynamic atomic dipole polarizability for two refractory metals. A fast-rising current pulse ˜1000A/ns vaporized 16μm diameter wires of either W or Mo in vacuum. To avoid the generation of dense plasma we used wire coated with polyimide. Under these conditions the deposited energy totally converts the wire to metallic vapor. In this case the radial integration of the interference phase shift allows the reconstruction of atomic polarizability for the probing wavelength [1]. Partial vaporization of the metal or its ionization gives a lower value of the reconstructed atomic polarizability. In this case the correct atomic polarizability can be reconstructed as the maximum value vs. deposited energy. [1]. G.S. Sarkisov, et al., Phys. Rev. A, 73, 042501 (2006).

  15. Texturing Carbon-carbon Composite Radiator Surfaces Utilizing Atomic Oxygen

    NASA Technical Reports Server (NTRS)

    Raack, Taylor

    2004-01-01

    Future space nuclear power systems will require radiator technology to dissipate excess heat created by a nuclear reactor. Large radiator fins with circulating coolant are in development for this purpose and an investigation of how to make them most efficient is underway. Maximizing the surface area while minimizing the mass of such radiator fins is critical for obtaining the highest efficiency in dissipating heat. Processes to develop surface roughness are under investigation to maximize the effective surface area of a radiator fin. Surface roughness is created through several methods including oxidation and texturing. The effects of atomic oxygen impingement on carbon-carbon surfaces are currently being investigated for texturing a radiator surface. Early studies of atomic oxygen impingement in low Earth orbit indicate significant texturing due to ram atomic oxygen. The surface morphology of the affected surfaces shows many microscopic cones and valleys which have been experimentally shown to increase radiation emittance. Further study of this morphology proceeded in the Long Duration Exposure Facility (LDEF). Atomic oxygen experiments on the LDEF successfully duplicated the results obtained from materials in spaceflight by subjecting samples to 4.5 eV atomic oxygen from a fixed ram angle. These experiments replicated the conical valley morphology that was seen on samples subjected to low Earth orbit.

  16. Limits to metallic conduction in atomic-scale quasi-one-dimensional silicon wires.

    PubMed

    Weber, Bent; Ryu, Hoon; Tan, Y-H Matthias; Klimeck, Gerhard; Simmons, Michelle Y

    2014-12-12

    The recent observation of ultralow resistivity in highly doped, atomic-scale silicon wires has sparked interest in what limits conduction in these quasi-1D systems. Here we present electron transport measurements of gated Si:P wires of widths 4.6 and 1.5 nm. At 4.6 nm we find an electron mobility, μ(el)≃60  cm²/V s, in excellent agreement with that of macroscopic Hall bars. Metallic conduction persists to millikelvin temperatures where we observe Gaussian conductance fluctuations of order δG∼e²/h. In thinner wires (1.5 nm), metallic conduction breaks down at G≲e²/h, where localization of carriers leads to Coulomb blockade. Metallic behavior is explained by the large carrier densities in Si:P δ-doped systems, allowing the occupation of all six valleys of the silicon conduction band, enhancing the number of 1D channels and hence the localization length.

  17. The influence of carbon content on cyclic fatigue of NiTi SMA wires.

    PubMed

    Matheus, T C U; Menezes, W M M; Rigo, O D; Kabayama, L K; Viana, C S C; Otubo, J

    2011-06-01

    To evaluate two NiTi wires with different carbon and oxygen contents in terms of mechanical resistance to rotary bending fatigue (RBF) under varied parameters of strain amplitude and rotational speed. The wires produced from two vacuum induction melting (VIM) processed NiTi ingots were tested, Ti-49.81 at%Ni and Ti-50.33 at%Ni, named VIM 1 and VIM 2. A brief analysis related to wire fabrication is also presented, as well as chemical and microstructural analysis by energy dispersive spectroscopy (EDS) and optical microscope, respectively. A computer controlled RBF machine was specially constructed for the tests. Three radii of curvature were used: 50.0, 62.5 and 75.0 mm, respectively, R(1), R(2) and R(3), resulting in three strain amplitudes ε(a) : 1.00%, 0.80% and 0.67%. The selected rotational speeds were 250 and 455 rpm. The VIM 1 wire had a high carbon content of 0.188 wt% and a low oxygen content of 0.036 wt%. The oxygen and carbon contents of wire VIM 2 did not exceed their maximum, of 0.070 and 0.050 wt%, according to ASTM standard (ASTM F-2063-00 2001). The wire with lower carbon content performed better when compared to the one with higher carbon content, withstanding 29,441 and 12,895 cycles, respectively, to fracture. The surface quality of the wire was associated with resistance to cyclic fatigue. Surface defects acted as stress concentrators points. Overall, the number of cycles to failure was higher for VIM 2 wires with lower carbon content. © 2011 International Endodontic Journal.

  18. Non-equilibrium 8π Josephson effect in atomic Kitaev wires

    PubMed Central

    Laflamme, C.; Budich, J. C.; Zoller, P.; Dalmonte, M.

    2016-01-01

    The identification of fractionalized excitations, such as Majorana quasi-particles, would be a striking signal of the realization of exotic quantum states of matter. While the paramount demonstration of such excitations would be a probe of their non-Abelian statistics via controlled braiding operations, alternative proposals exist that may be easier to access experimentally. Here we identify a signature of Majorana quasi-particles, qualitatively different from the behaviour of a conventional superconductor, which can be detected in cold atom systems using alkaline-earth-like atoms. The system studied is a Kitaev wire interrupted by an extra site, which gives rise to super-exchange coupling between two Majorana-bound states. We show that this system hosts a tunable, non-equilibrium Josephson effect with a characteristic 8π periodicity of the Josephson current. The visibility of the 8π periodicity of the Josephson current is then studied including the effects of dephasing and particle losses. PMID:27481540

  19. Modelling of drawing and rolling of high carbon flat wires

    NASA Astrophysics Data System (ADS)

    Bobadilla, C.; Persem, N.; Foissey, S.

    2007-04-01

    In order to meet customer requirements, it is necessary to develop new flat wires with a high tensile strength and a high width/thickness ratio. These products are manufactured from wire rod. The first step is to draw the wire until we have the required mechanical properties and required surface area of the section. After this, the wire is rolled from a round to a rectangular section. During the flat rolling process it can be reduced by more than 50%. Then the wire is exposed to a high level of stress during this process. Modelling allows us to predetermine this stress level, taking into account the final dimensions and the mechanical properties, thus optimising both rolling and drawing process. Forge2005 was used in order to simulate these processes. The aim of this study is to determine the value of residual stresses after drawing and so to optimise rolling. Indeed, the highest stress values are reached at this step of the process by changing the section of the wire from a round to a rectangular one. In order to evaluate the stress value accuracy for high strain levels, a behaviour law has been identified. This is a result of tensile tests carried out at each step of the drawing process. Finally, a multi-axial damage criterion was implemented using Forge2005. The optimisation of the rolling is directly linked to the minimisation of this criterion.

  20. Modelling of drawing and rolling of high carbon flat wires

    SciTech Connect

    Bobadilla, C.; Persem, N.; Foissey, S.

    2007-04-07

    In order to meet customer requirements, it is necessary to develop new flat wires with a high tensile strength and a high width/thickness ratio. These products are manufactured from wire rod. The first step is to draw the wire until we have the required mechanical properties and required surface area of the section. After this, the wire is rolled from a round to a rectangular section. During the flat rolling process it can be reduced by more than 50%. Then the wire is exposed to a high level of stress during this process. Modelling allows us to predetermine this stress level, taking into account the final dimensions and the mechanical properties, thus optimising both rolling and drawing process. Forge2005 was used in order to simulate these processes. The aim of this study is to determine the value of residual stresses after drawing and so to optimise rolling. Indeed, the highest stress values are reached at this step of the process by changing the section of the wire from a round to a rectangular one. In order to evaluate the stress value accuracy for high strain levels, a behaviour law has been identified. This is a result of tensile tests carried out at each step of the drawing process. Finally, a multi-axial damage criterion was implemented using Forge2005. The optimisation of the rolling is directly linked to the minimisation of this criterion.

  1. Functionalization of Carbon Nanotubes using Atomic Hydrogen

    NASA Technical Reports Server (NTRS)

    Khare, Bishun N.; Cassell, Alan M.; Nguyen, Cattien V.; Meyyappan, M.; Han, Jie; Arnold, Jim (Technical Monitor)

    2001-01-01

    We have investigated the irradiation of multi walled and single walled carbon nanotubes (SWNTs) with atomic hydrogen. After irradiating the SWNT sample, a band at 2940/cm (3.4 microns) that is characteristic of the C-H stretching mode is observed using Fourier transform infrared (FTIR) spectroscopy. Additional confirmation of SWNT functionalization is tested by irradiating with atomic deuterium. A weak band in the region 1940/cm (5.2 micron) to 2450/cm (4.1 micron) corresponding to C-D stretching mode is also observed in the FTIR spectrum. This technique provides a clean gas phase process for the functionalization of SWNTs, which could lead to further chemical manipulation and/or the tuning of the electronic properties of SWNTs for nanodevice applications.

  2. 75 FR 21658 - Carbon and Certain Alloy Steel Wire Rod From Trinidad and Tobago

    Federal Register 2010, 2011, 2012, 2013, 2014

    2010-04-26

    ... From the Federal Register Online via the Government Publishing Office INTERNATIONAL TRADE COMMISSION Carbon and Certain Alloy Steel Wire Rod From Trinidad and Tobago AGENCY: United States... in the antidumping duty Investigation No. 731-TA-961 concerning carbon and certain alloy steel...

  3. Carbon nanospikes grown on metal wires as microelectrode sensors for dopamine

    DOE PAGES

    Zestos, Alexander G.; Yang, Cheng; Jacobs, Christopher B.; ...

    2015-09-14

    Carbon nanomaterials are advantageous as electrodes for neurotransmitter detection, but the difficulty of nanomaterials deposition on electrode substrates limits the reproducibility and future applications. In our study, we used plasma enhanced chemical vapor deposition (PECVD) to directly grow a thin layer of carbon nanospikes (CNS) on cylindrical metal substrates. No catalyst is required and the CNS surface coverage is uniform over the cylindrical metal substrate. We characterized the CNS growth on several metallic substrates including tantalum, niobium, palladium, and nickel wires. Using fast-scan cyclic voltammetry (FSCV), bare metal wires could not detect 1 mu M dopamine while carbon nanospike coatedmore » wires could. Moreover, the highest sensitivity and optimized S/N ratio was recorded from carbon nanospike-tantalum (CNS-Ta) microwires grown for 7.5 minutes, which had a LOD of 8 +/- 2 nM for dopamine with FSCV. CNS-Ta microelectrodes were more reversible and had a smaller Delta E-p for dopamine than carbon-fiber microelectrodes, suggesting faster electron transfer kinetics. The kinetics of dopamine redox were adsorption controlled at CNS-Ta microelectrodes and repeated electrochemical measurements displayed stability for up to ten hours in vitro and over a ten day period as well. The oxidation potential was significantly different for ascorbic acid and uric acid compared to dopamine. Finally, growing carbon nanospikes on metal wires is a promising method to produce uniformly-coated, carbon nanostructured cylindrical microelectrodes for sensitive dopamine detection.« less

  4. Carbon nanospikes grown on metal wires as microelectrode sensors for dopamine

    SciTech Connect

    Zestos, Alexander G.; Yang, Cheng; Jacobs, Christopher B.; Hensley, Dale; Venton, B. Jill

    2015-09-14

    Carbon nanomaterials are advantageous as electrodes for neurotransmitter detection, but the difficulty of nanomaterials deposition on electrode substrates limits the reproducibility and future applications. In our study, we used plasma enhanced chemical vapor deposition (PECVD) to directly grow a thin layer of carbon nanospikes (CNS) on cylindrical metal substrates. No catalyst is required and the CNS surface coverage is uniform over the cylindrical metal substrate. We characterized the CNS growth on several metallic substrates including tantalum, niobium, palladium, and nickel wires. Using fast-scan cyclic voltammetry (FSCV), bare metal wires could not detect 1 mu M dopamine while carbon nanospike coated wires could. Moreover, the highest sensitivity and optimized S/N ratio was recorded from carbon nanospike-tantalum (CNS-Ta) microwires grown for 7.5 minutes, which had a LOD of 8 +/- 2 nM for dopamine with FSCV. CNS-Ta microelectrodes were more reversible and had a smaller Delta E-p for dopamine than carbon-fiber microelectrodes, suggesting faster electron transfer kinetics. The kinetics of dopamine redox were adsorption controlled at CNS-Ta microelectrodes and repeated electrochemical measurements displayed stability for up to ten hours in vitro and over a ten day period as well. The oxidation potential was significantly different for ascorbic acid and uric acid compared to dopamine. Finally, growing carbon nanospikes on metal wires is a promising method to produce uniformly-coated, carbon nanostructured cylindrical microelectrodes for sensitive dopamine detection.

  5. Carbon Nanospikes Grown on Metal Wires as Microelectrode Sensors for Dopamine

    PubMed Central

    Zestos, Alexander G.; Yang, Cheng; Jacobs, Christopher B.; Hensley, Dale; Venton, B. Jill

    2015-01-01

    Carbon nanomaterials are advantageous as electrodes for neurotransmitter detection, but the difficulty of nanomaterials deposition on electrode substrates limits the reproducibility and future applications. In this study, we used plasma enhanced chemical vapor deposition (PECVD) to directly grow a thin layer of carbon nanospikes (CNS) on cylindrical metal substrates. No catalyst is required and the CNS surface coverage is uniform over the cylindrical metal substrate. The CNS growth was characterized on several metallic substrates including tantalum, niobium, palladium, and nickel wires. Using fast-scan cyclic voltammetry (FSCV), bare metal wires could not detect 1 μM dopamine while carbon nanospike coated wires could. The highest sensitivity and optimized S/N ratio was recorded from carbon nanospike-tantalum (CNS-Ta) microwires grown for 7.5 minutes, which had a LOD of 8 ± 2 nM for dopamine with FSCV. CNS-Ta microelectrodes were more reversible and had a smaller ΔEp for dopamine than carbon-fiber microelectrodes, suggesting faster electron transfer kinetics. The kinetics of dopamine redox were adsorption controlled at CNS-Ta microelectrodes and repeated electrochemical measurements displayed stability for up to ten hours in vitro and over a ten day period as well. The oxidation potential was significantly different for ascorbic acid and uric acid compared to dopamine. Growing carbon nanospikes on metal wires is a promising method to produce uniformly-coated, carbon nanostructured cylindrical microelectrodes for sensitive dopamine detection. PMID:26389138

  6. Carbon nanospikes grown on metal wires as microelectrode sensors for dopamine.

    PubMed

    Zestos, Alexander G; Yang, Cheng; Jacobs, Christopher B; Hensley, Dale; Venton, B Jill

    2015-11-07

    Carbon nanomaterials are advantageous as electrodes for neurotransmitter detection, but the difficulty of nanomaterials deposition on electrode substrates limits the reproducibility and future applications. In this study, we used plasma enhanced chemical vapor deposition (PECVD) to directly grow a thin layer of carbon nanospikes (CNS) on cylindrical metal substrates. No catalyst is required and the CNS surface coverage is uniform over the cylindrical metal substrate. The CNS growth was characterized on several metallic substrates including tantalum, niobium, palladium, and nickel wires. Using fast-scan cyclic voltammetry (FSCV), bare metal wires could not detect 1 μM dopamine while carbon nanospike coated wires could. The highest sensitivity and optimized S/N ratio was recorded from carbon nanospike-tantalum (CNS-Ta) microwires grown for 7.5 minutes, which had a LOD of 8 ± 2 nM for dopamine with FSCV. CNS-Ta microelectrodes were more reversible and had a smaller ΔE(p) for dopamine than carbon-fiber microelectrodes, suggesting faster electron transfer kinetics. The kinetics of dopamine redox were adsorption controlled at CNS-Ta microelectrodes and repeated electrochemical measurements displayed stability for up to ten hours in vitro and over a ten day period as well. The oxidation potential was significantly different for ascorbic acid and uric acid compared to dopamine. Growing carbon nanospikes on metal wires is a promising method to produce uniformly-coated, carbon nanostructured cylindrical microelectrodes for sensitive dopamine detection.

  7. High strength, low carbon, dual phase steel rods and wires and process for making same

    DOEpatents

    Thomas, Gareth; Nakagawa, Alvin H.

    1986-01-01

    A high strength, high ductility, low carbon, dual phase steel wire, bar or rod and process for making the same is provided. The steel wire, bar or rod is produced by cold drawing to the desired diameter in a single multipass operation a low carbon steel composition characterized by a duplex microstructure consisting essentially of a strong second phase dispersed in a soft ferrite matrix with a microstructure and morphology having sufficient cold formability to allow reductions in cross-sectional area of up to about 99.9%. Tensile strengths of at least 120 ksi to over 400 ksi may be obtained.

  8. Atom probe study on microstructure change in severely deformed pearlitic steels: application to rail surfaces and drawn wires

    NASA Astrophysics Data System (ADS)

    Takahashi, Jun

    2017-07-01

    Pearlitic steel is used as the material for high tensile steel wires, rails and wheels due to its high work hardening and wear resistance. These properties arise from a layered structure comprising deformable lamellar ferrite and hard lamellar cementite. This paper reviews the microstructural change in heavily drawn pearlitic steels wires and worn surfaces of pearlitic rails using atom probe tomography analysis. The cementite decomposition mechanism was elucidated for heavily drawn pearlitic steel wires. For pearlitic rail steels, atomic scale characterization of worn surfaces and of the white etching layer (WEL) were performed, and a mechanism for the formation of the WEL was proposed. The differences and similarities in microstructure and in the state of the cementite in these severely deformed pearlitic steels are discussed.

  9. Method for the preparation of high-strength fine wire of high-carbon steel

    SciTech Connect

    Nishiura, Shuji; Izumisano-shi; Osaka-fu; Nishiura, Yoshitaka.

    1993-06-22

    In a method for the manufacture of a fine high-carbon steel wire having a diameter not exceeding 50[mu]m by repeating a plural number of cycles each consisting of a cold die-drawing treatment and a patenting treatment of a steel wire ending in a final cold die-drawing to successively reduce the diameter of the wire in each cold die-drawing, the improvement is described which comprises heating the wire having a diameter reduced to 100 to 500 [mu]m, prior to the final cold die-drawing treatment, in an atmosphere of a gaseous mixture consisting of from 90 to 98% by volume of nitrogen and from 10 to 2% by volume of hydrogen at a temperature in the range from 750 to 900 C for a length of time in the range from 1 to 30 seconds.

  10. Atomic Carbon in the Southern Milky Way

    NASA Astrophysics Data System (ADS)

    Oka, Tomoharu; Kamegai, Kazuhisa; Hayashida, Masaaki; Nagai, Makoto; Ikeda, Masafumi; Kuboi, Nobuyuki; Tanaka, Kunihiko; Bronfman, Leonardo; Yamamoto, Satoshi

    2005-04-01

    We present a coarsely sampled longitude-velocity (l-V) map of the region l=300deg-354°, b=0deg in the 492 GHz fine-structure transition of neutral atomic carbon (C0 3P1-3P0 [C I]), observed with the Portable 18 cm Submillimeter-wave Telescope (POST18). The l-V distribution of the [C I] emission resembles closely that of the CO J=1-0 emission, showing a widespread distribution of atomic carbon on the Galactic scale. The ratio of the antenna temperatures, RCI/CO, concentrates on the narrow range from 0.05 to 0.3. A large velocity gradient (LVG) analysis shows that the [C I] emission from the Galactic disk is dominated by a population of neutral gas with high C0/CO abundance ratios and moderate column densities, which can be categorized as diffuse translucent clouds. The ratio of bulk emissivity, JCI/JCO, shows a systematic trend, suggesting the bulk C0/CO abundance ratio increasing with the Galactic radius. A mechanism related to kiloparsec-scale structure of the Galaxy may control the bulk C0/CO abundance ratio in the Galactic disk. Two groups of high-ratio (RCI/CO>0.3) areas reside in the l-V loci several degrees inside of tangential points of the Galactic spiral arms. These could be gas condensations just accumulated in the potential well of spiral arms and be in the early stages of molecular cloud formation.

  11. Optically excited structural transition in atomic wires on surfaces at the quantum limit

    NASA Astrophysics Data System (ADS)

    Frigge, T.; Hafke, B.; Witte, T.; Krenzer, B.; Streubühr, C.; Samad Syed, A.; Mikšić Trontl, V.; Avigo, I.; Zhou, P.; Ligges, M.; von der Linde, D.; Bovensiepen, U.; Horn-von Hoegen, M.; Wippermann, S.; Lücke, A.; Sanna, S.; Gerstmann, U.; Schmidt, W. G.

    2017-03-01

    Transient control over the atomic potential-energy landscapes of solids could lead to new states of matter and to quantum control of nuclear motion on the timescale of lattice vibrations. Recently developed ultrafast time-resolved diffraction techniques combine ultrafast temporal manipulation with atomic-scale spatial resolution and femtosecond temporal resolution. These advances have enabled investigations of photo-induced structural changes in bulk solids that often occur on timescales as short as a few hundred femtoseconds. In contrast, experiments at surfaces and on single atomic layers such as graphene report timescales of structural changes that are orders of magnitude longer. This raises the question of whether the structural response of low-dimensional materials to femtosecond laser excitation is, in general, limited. Here we show that a photo-induced transition from the low- to high-symmetry state of a charge density wave in atomic indium (In) wires supported by a silicon (Si) surface takes place within 350 femtoseconds. The optical excitation breaks and creates In-In bonds, leading to the non-thermal excitation of soft phonon modes, and drives the structural transition in the limit of critically damped nuclear motion through coupling of these soft phonon modes to a manifold of surface and interface phonons that arise from the symmetry breaking at the silicon surface. This finding demonstrates that carefully tuned electronic excitations can create non-equilibrium potential energy surfaces that drive structural dynamics at interfaces in the quantum limit (that is, in a regime in which the nuclear motion is directed and deterministic). This technique could potentially be used to tune the dynamic response of a solid to optical excitation, and has widespread potential application, for example in ultrafast detectors.

  12. Optically excited structural transition in atomic wires on surfaces at the quantum limit.

    PubMed

    Frigge, T; Hafke, B; Witte, T; Krenzer, B; Streubühr, C; Samad Syed, A; Mikšić Trontl, V; Avigo, I; Zhou, P; Ligges, M; von der Linde, D; Bovensiepen, U; Horn-von Hoegen, M; Wippermann, S; Lücke, A; Sanna, S; Gerstmann, U; Schmidt, W G

    2017-03-29

    Transient control over the atomic potential-energy landscapes of solids could lead to new states of matter and to quantum control of nuclear motion on the timescale of lattice vibrations. Recently developed ultrafast time-resolved diffraction techniques combine ultrafast temporal manipulation with atomic-scale spatial resolution and femtosecond temporal resolution. These advances have enabled investigations of photo-induced structural changes in bulk solids that often occur on timescales as short as a few hundred femtoseconds. In contrast, experiments at surfaces and on single atomic layers such as graphene report timescales of structural changes that are orders of magnitude longer. This raises the question of whether the structural response of low-dimensional materials to femtosecond laser excitation is, in general, limited. Here we show that a photo-induced transition from the low- to high-symmetry state of a charge density wave in atomic indium (In) wires supported by a silicon (Si) surface takes place within 350 femtoseconds. The optical excitation breaks and creates In-In bonds, leading to the non-thermal excitation of soft phonon modes, and drives the structural transition in the limit of critically damped nuclear motion through coupling of these soft phonon modes to a manifold of surface and interface phonons that arise from the symmetry breaking at the silicon surface. This finding demonstrates that carefully tuned electronic excitations can create non-equilibrium potential energy surfaces that drive structural dynamics at interfaces in the quantum limit (that is, in a regime in which the nuclear motion is directed and deterministic). This technique could potentially be used to tune the dynamic response of a solid to optical excitation, and has widespread potential application, for example in ultrafast detectors.

  13. 76 FR 34044 - Carbon and Certain Alloy Steel Wire Rod From Mexico: Extension of Time Limits for the Preliminary...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-06-10

    ... From the Federal Register Online via the Government Publishing Office ] DEPARTMENT OF COMMERCE International Trade Administration Carbon and Certain Alloy Steel Wire Rod From Mexico: Extension of Time Limits... administrative review of the antidumping duty order on carbon and certain alloy steel wire rod from...

  14. Chains of carbon atoms: A vision or a new nanomaterial?

    PubMed

    Banhart, Florian

    2015-01-01

    Linear strings of sp(1)-hybridized carbon atoms are considered as a possible phase of carbon since decades. Whereas the debate about the stability of the corresponding bulk phase carbyne continues until today, the existence of isolated chains of carbon atoms has meanwhile been corroborated experimentally. Since graphene, as the two-dimensional sp(2)-bonded allotrope of carbon, has become a vast field, the question about the importance of one-dimensional carbon became of renewed interest. The present article gives an overview of the work that has been carried out on chains of carbon atoms in the past one or two decades. The review concentrates on isolated chains of carbon atoms and summarizes the experimental observations to date. While the experimental information is still very limited, many calculations of the physical and chemical properties have been published in the past years. Some of the most important theoretical studies and their importance in the present experimental situation are reviewed.

  15. Chains of carbon atoms: A vision or a new nanomaterial?

    PubMed Central

    2015-01-01

    Summary Linear strings of sp1-hybridized carbon atoms are considered as a possible phase of carbon since decades. Whereas the debate about the stability of the corresponding bulk phase carbyne continues until today, the existence of isolated chains of carbon atoms has meanwhile been corroborated experimentally. Since graphene, as the two-dimensional sp2-bonded allotrope of carbon, has become a vast field, the question about the importance of one-dimensional carbon became of renewed interest. The present article gives an overview of the work that has been carried out on chains of carbon atoms in the past one or two decades. The review concentrates on isolated chains of carbon atoms and summarizes the experimental observations to date. While the experimental information is still very limited, many calculations of the physical and chemical properties have been published in the past years. Some of the most important theoretical studies and their importance in the present experimental situation are reviewed. PMID:25821697

  16. Structurally uniform and atomically precise carbon nanostructures

    NASA Astrophysics Data System (ADS)

    Segawa, Yasutomo; Ito, Hideto; Itami, Kenichiro

    2016-01-01

    Nanometre-sized carbon materials consisting of benzene units oriented in unique geometric patterns, hereafter named nanocarbons, conduct electricity, absorb and emit light, and exhibit interesting magnetic properties. Spherical fullerene C60, cylindrical carbon nanotubes and sheet-like graphene are representative forms of nanocarbons, and theoretical simulations have predicted several exotic 3D nanocarbon structures. At present, synthetic routes to nanocarbons mainly lead to mixtures of molecules with a range of different structures and properties, which cannot be easily separated or refined into pure forms. Some researchers believe that it is impossible to synthesize these materials in a precise manner. Obtaining ‘pure’ nanocarbons is a great challenge in the field of nanocarbon science, and the construction of structurally uniform nanocarbons, ideally as single molecules, is crucial for the development of functional materials in nanotechnology, electronics, optics and biomedical applications. This Review highlights the organic chemistry approach — more specifically, bottom-up construction with atomic precision — that is currently the most promising strategy towards this end.

  17. Carbon based thirty six atom spheres

    DOEpatents

    Piskoti, Charles R.; Zettl, Alex K.; Cohen, Marvin L.; Cote, Michel; Grossman, Jeffrey C.; Louie, Steven G.

    2005-09-06

    A solid phase or form of carbon is based on fullerenes with thirty six carbon atoms (C.sub.36). The C.sub.36 structure with D.sub.6h symmetry is one of the two most energetically favorable, and is conducive to forming a periodic system. The lowest energy crystal is a highly bonded network of hexagonal planes of C.sub.36 subunits with AB stacking. The C.sub.36 solid is not a purely van der Waals solid, but has covalent-like bonding, leading to a solid with enhanced structural rigidity. The solid C.sub.36 material is made by synthesizing and selecting out C.sub.36 fullerenes in relatively large quantities. A C.sub.36 rich fullerene soot is produced in a helium environment arc discharge chamber by operating at an optimum helium pressure (400 torr). The C.sub.36 is separated from the soot by a two step process. The soot is first treated with a first solvent, e.g. toluene, to remove the higher order fullerenes but leave the C.sub.36. The soot is then treated with a second solvent, e.g. pyridine, which is more polarizable than the first solvent used for the larger fullerenes. The second solvent extracts the C.sub.36 from the soot. Thin films and powders can then be produced from the extracted C.sub.36. Other materials are based on C.sub.36 fullerenes, providing for different properties.

  18. Carbon nanotube-clamped metal atomic chain

    PubMed Central

    Tang, Dai-Ming; Yin, Li-Chang; Li, Feng; Liu, Chang; Yu, Wan-Jing; Hou, Peng-Xiang; Wu, Bo; Lee, Young-Hee; Ma, Xiu-Liang; Cheng, Hui-Ming

    2010-01-01

    Metal atomic chain (MAC) is an ultimate one-dimensional structure with unique physical properties, such as quantized conductance, colossal magnetic anisotropy, and quantized magnetoresistance. Therefore, MACs show great potential as possible components of nanoscale electronic and spintronic devices. However, MACs are usually suspended between two macroscale metallic electrodes; hence obvious technical barriers exist in the interconnection and integration of MACs. Here we report a carbon nanotube (CNT)-clamped MAC, where CNTs play the roles of both nanoconnector and electrodes. This nanostructure is prepared by in situ machining a metal-filled CNT, including peeling off carbon shells by spatially and elementally selective electron beam irradiation and further elongating the exposed metal nanorod. The microstructure and formation process of this CNT-clamped MAC are explored by both transmission electron microscopy observations and theoretical simulations. First-principles calculations indicate that strong covalent bonds are formed between the CNT and MAC. The electrical transport property of the CNT-clamped MAC was experimentally measured, and quantized conductance was observed. PMID:20427743

  19. Pipe-Wire TiO2-Sn@Carbon Nanofibers Paper Anodes for Lithium and Sodium Ion Batteries.

    PubMed

    Mao, Minglei; Yan, Feilong; Cui, Chunyu; Ma, Jianmin; Zhang, Ming; Wang, Taihong; Wang, Chunsheng

    2017-06-14

    Metallic tin has been considered as one of the most promising anode materials both for lithium (LIBs) and sodium ion battery (NIBs) because of a high theoretical capacity and an appropriate low discharge potential. However, Sn anodes suffer from a rapid capacity fading during cycling due to pulverization induced by severe volume changes. Here we innovatively synthesized pipe-wire TiO2-Sn@carbon nanofibers (TiO2-Sn@CNFs) via electrospinning and atomic layer deposition to suppress pulverization-induced capacity decay. In pipe-wire TiO2-Sn@CNFs paper, nano-Sn is uniformly dispersed in carbon nanofibers, which not only act as a buffer material to prevent pulverization, but also serve as a conductive matrix. In addition, TiO2 pipe as the protection shell outside of Sn@carbon nanofibers can restrain the volume variation to prevent Sn from aggregation and pulverization during cycling, thus increasing the Coulombic efficiency. The pipe-wire TiO2-Sn@CNFs show excellent electrochemical performance as anodes for both LIBs and NIBs. It exhibits a high and stable capacity of 643 mA h/g at 200 mA/g after 1100 cycles in LIBs and 413 mA h/g at 100 mA/g after 400 cycles in NIBs. These results would shed light on the practical application of Sn-based materials as a high capacity electrode with good cycling stability for next-generation LIBs and NIBs.

  20. Mechanical behavior of ultrahigh strength ultrahigh carbon steel wire and rod

    SciTech Connect

    Lesuer, D.R.; Syn, C.K.; Sberby, O.D.; Whittenherger, W.D.

    1997-07-22

    Ultrahigh-carbon steels (UHCSS) can achieve very high strengths in wire or rod form. These high strengths result from the mechanical work introduced during wire and rod processing. These strengths have been observed to increase with carbon content. In wire form, tensile strengths approaching 6000 MPa are predicted for UHCS containing 1. 8%C. In this paper, we will discuss the influence of processing (including rapid transformation during wire patenting) and micros ct- ure on the mechanical behavior of UHCS wire. The tensile properties of as- extruded rods are described as a function of extrusion temperature and composition. For spheroidized steels, yield and ultimate tensile strength are a function of grain size, interparticle spacing and particle size. For pearlitic steels, yield and ultimate strength were found to be functions of colony size, carbide size and plate spacing and orientation. Alloying additions (such as C, Cr, Si, Al and Co) can influence the effect of processing on these microstructural features. For spheroidized steels, fracture was found to be a function of the size of coarse carbides and of composition.

  1. Influence of severe plastic deformation on the structure and properties of ultrahigh carbon steel wire

    SciTech Connect

    Leseur, D R; Sherby, O D; Syn, C K

    1999-07-01

    Ultrahigh-carbon steel wire can achieve very high strength after severe plastic deformation, because of the fine, stable substructures produce. Tensile strengths approaching 6000 MPa are predicted for UHCS containing 1.8%C. This paper discusses the microstructural evolution during drawing of UHCS wire, the resulting strength produced and the factors influencing fracture. Drawing produces considerable alignment of the pearlite plates. Dislocation cells develop within the ferrite plates and, with increasing strain, the size normal to the axis ({lambda}) decreases. These dislocation cells resist dynamic recovery during wire drawing and thus extremely fine substructures can be developed ({lambda} < 10 nm). Increasing the carbon content reduces the mean free ferrite path in the as-patented wire and the cell size developed during drawing. For UHCS, the strength varies as {lambda}{sup {minus}5}. Fracture of these steels was found to be a function of carbide size and composition. The influence of processing and composition on achieving high strength in these wires during severe plastic deformation is discussed.

  2. Novel graphene/carbon nanotube composite fibers for efficient wire-shaped miniature energy devices.

    PubMed

    Sun, Hao; You, Xiao; Deng, Jue; Chen, Xuli; Yang, Zhibin; Ren, Jing; Peng, Huisheng

    2014-05-01

    Novel nanostructured composite fibers based on graphene and carbon nanotubes are developed with high tensile strength, electrical conductivity, and electrocatalytic activity. As two application demonstrations, these composite fibers are used to fabricate flexible, wire-shaped dye-sensitized solar cells and electrochemical supercapacitors, both with high performances, for example, a maximal energy conversion efficiency of 8.50% and a specific capacitance of ca. 31.50 F g(-1). These miniature wire-shaped devices are further shown to be promising for flexible and portable electronic facilities.

  3. ATOMIC CARBON IN THE UPPER ATMOSPHERE OF TITAN

    SciTech Connect

    Zhang, X.; Yung, Y. L.; Ajello, J. M.

    2010-01-01

    The atomic carbon emission C I line feature at 1657 A ({sup 3} P {sup 0} {sub J}-{sup 3} P{sub J} ) in the upper atmosphere of Titan is first identified from the airglow spectra obtained by the Cassini Ultra-violet Imaging Spectrograph. A one-dimensional photochemical model of Titan is used to study the photochemistry of atomic carbon on Titan. Reaction between CH and atomic hydrogen is the major source of atomic carbon, and reactions with hydrocarbons (C{sub 2}H{sub 2} and C{sub 2}H{sub 4}) are the most important loss processes. Resonance scattering of sunlight by atomic carbon is the dominant emission mechanism. The emission intensity calculations based on model results show good agreement with the observations.

  4. Multiple Majorana zero modes in atomic Fermi double wires with spin-orbit coupling

    NASA Astrophysics Data System (ADS)

    Wang, Liang-Liang; Gong, Ming; Liu, W.-M.

    2017-08-01

    Majorana zero modes, quasiparticles with non-Abelian statistics, have gained increasing interest for their fundamental role as building blocks in topological quantum computation. Previous studies have mainly focused on two well-separated Majorana zero modes, which could form two degenerate states serving as one nonlocal qubit for fault-tolerant quantum memory. However, creating and manipulating multiple Majorana zero modes, which could encode more qubits, remain an ongoing research topic. Here we report that multiple Majorana zero modes can exist in atomic Fermi double wires with spin-orbit coupling and perpendicular Zeeman field. This system belongs to the topological BDI class, thus all the topological superfluids are classified by integer numbers. Especially, diverse topological superfluids can be formed in a trap, where the zero energy modes can be found at the interfaces between different topological superfluids. The structure of these zero energy modes in the trap can be engineered by the trapping potential as well as other system parameters. This system would be a significant step towards utilization of Majorana zero modes in quantum computation.

  5. Direct observation of the spin polarization in Au atomic wires on Si(553)

    NASA Astrophysics Data System (ADS)

    Yeom, H. W.; Jung, S. W.; Shin, J. S.; Kim, J.; Kim, K. S.; Miyamoto, K.; Okuda, T.; Namatame, H.; Kimura, A.; Taniguchi, M.

    2014-09-01

    The spin-resolved electronic band structure of Au-induced metallic atomic wires on a vicinal silicon surface, Si(553), was investigated using spin- and angle-resolved photoelectron spectroscopy. We directly measured the spin polarization of three partially filled one-dimensional metallic bands, a one-third-filled band, and the doublet of nearly half-filled bands. For the half-filled doublet, the strong apparent spin polarization was observed near the Fermi energy with a minor out-of-plane spin component. This observation is consistent with the Rashba-type spin-orbit splitting and with a recent experiment on a similar doublet of Si(557)-Au. In contrast, the one-third-filled band does not show a substantial spin polarization within the experimental accuracy, indicating a much smaller spin splitting, if any. These results are discussed for the origin of the partially filled bands and for the intriguing broken-symmetry ground state observed at low temperature.

  6. Semiconductor nanorod-carbon nanotube biomimetic films for wire-free photostimulation of blind retinas.

    PubMed

    Bareket, Lilach; Waiskopf, Nir; Rand, David; Lubin, Gur; David-Pur, Moshe; Ben-Dov, Jacob; Roy, Soumyendu; Eleftheriou, Cyril; Sernagor, Evelyne; Cheshnovsky, Ori; Banin, Uri; Hanein, Yael

    2014-11-12

    We report the development of a semiconductor nanorod-carbon nanotube based platform for wire-free, light induced retina stimulation. A plasma polymerized acrylic acid midlayer was used to achieve covalent conjugation of semiconductor nanorods directly onto neuro-adhesive, three-dimensional carbon nanotube surfaces. Photocurrent, photovoltage, and fluorescence lifetime measurements validate efficient charge transfer between the nanorods and the carbon nanotube films. Successful stimulation of a light-insensitive chick retina suggests the potential use of this novel platform in future artificial retina applications.

  7. Semiconductor Nanorod–Carbon Nanotube Biomimetic Films for Wire-Free Photostimulation of Blind Retinas

    PubMed Central

    2014-01-01

    We report the development of a semiconductor nanorod-carbon nanotube based platform for wire-free, light induced retina stimulation. A plasma polymerized acrylic acid midlayer was used to achieve covalent conjugation of semiconductor nanorods directly onto neuro-adhesive, three-dimensional carbon nanotube surfaces. Photocurrent, photovoltage, and fluorescence lifetime measurements validate efficient charge transfer between the nanorods and the carbon nanotube films. Successful stimulation of a light-insensitive chick retina suggests the potential use of this novel platform in future artificial retina applications. PMID:25350365

  8. Stress Writing Textured Graphite Conducting Wires/Patterns in Insulating Amorphous Carbon Matrix as Interconnects.

    PubMed

    Wang, Ding-Shiang; Chang, Shou-Yi; Chen, Tai-Sheng; Chou, Tung-Huan; Huang, Yi-Ching; Wu, Jin-Bao; Leu, Ming-Sheng; Lai, Hong-Jen

    2017-08-29

    This study reports a mechanical stress-based technique that involves scratching or imprinting to write textured graphite conducting wires/patterns in an insulating amorphous carbon matrix for potential use as interconnects in future carbonaceous circuits. With low-energy post-annealing below the temperature that is required for the thermal graphitization of amorphous carbon, the amorphous carbon phase only in the mechanically stressed regions transforms into a well aligned crystalline graphite structure with a low electrical resistivity of 420 μΩ-cm, while the surrounding amorphous carbon matrix remains insulating. Micro-Raman spectra with obvious graphitic peaks and high-resolution transmission electron microscopic observations of clear graphitic lattice verified the localized phase transformation of amorphous carbon into textured graphite exactly in the stressed regions. The stress-induced reconstruction of carbon bonds to generate oriented graphitic nuclei is believed to assist in the pseudo-self-formation of textured graphite during low-temperature post annealing.

  9. V-shaped metallic-wire cantilevers for combined atomic force microscopy and Fowler-Nordheim imaging

    NASA Astrophysics Data System (ADS)

    Peterson, Charles A.; Workman, Richard K.; Yao, Xiaowei; Hunt, Jeffery P.; Sarid, Dror

    1998-12-01

    A method for fabricating V-shaped cantilevers from a flattened Pt/Ir metal wire for combined atomic force microscopy and Fowler-Nordheim imaging is described. These novel cantilevers have been found to be more robust then conventional ones used for scanning capacitance and magnetic force microscopy as their conductivity is maintained even after a large number of surface scans. The use of a V-shaped geometry improves on earlier single-beam geometries by reducing rms imaging noise. Characterization of these cantilevers and combined atomic force microscopy and Fowler-Nordheim images are reported.

  10. Crewmember repairing the Regenerative Carbon Dioxide Removal System wiring.

    NASA Image and Video Library

    1992-07-09

    STS050-20-012 (26 June 1992) --- Astronaut Kenneth D. Bowersox, pilot, performs in-flight maintenance (IFM) on the Regenerative Carbon Dioxide Removal System (RCRS) on the mid-deck of the Earth-orbiting Space Shuttle Columbia. Bowersox was joined by four other astronauts and two scientists from the private sector for a record-setting 14-day stay aboard the Space Shuttle in support of the United States Microgravity Laboratory 1 (USML-1).

  11. Stretchable glucose biofuel cell with wirings made of multiwall carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Fujimagari, Yusuke; Nishioka, Yasushiro

    2015-12-01

    In this study, we fabricated a flexible and stretchable glucose-biofuel cell with wirings made of multi wall carbon nanotube (MWCNTs) on a polydimethylsiloxane substrate. The biofuel cell investigated consists of a porous carbon anode (area of 30 mm2) modified by glucose oxidase and ferrocene, and a cathode (area of 30 mm2) modified by bilirubin oxidase. The anode and the cathode were connected with the MWCNT wirings. The maximum power of 0.31 μW at 76.6 mV, which corresponds to a power density of 1.04 μW/cm2, was realized by immersing the biofuel cell in a phosphate buffer solution with a glucose concentration of 100 mM, at room temperature.

  12. Aging life evaluation of a new carbon fiber composite core wire

    NASA Astrophysics Data System (ADS)

    Cao, Jiangming; Wang, Zhihua; Zhang, Yongbo; Fu, Huimin

    2017-01-01

    The carbon fiber composite core wire is the key component for new overhead transmission lines in the power industry. As the primary load-bearing member, the composite mandrel will produce long-term creep because of the tensile during operation. Therefore, designers need to understand the long-term deformation behaviour of the composite mandrel to assess its durability. To this end, an accelerated creep test on the composite core rod under different temperatures and stresses has been conducted in the current study. According to the time- temperature- stress superposition principle, the shift factors are calculated, and the creep under normal working condition is predicted. Results show that the carbon fiber composite core wire can satisfy the design requirements under normal working condition.

  13. Angular distribution of photoelectrons from atomic oxygen, nitrogen, and carbon

    NASA Technical Reports Server (NTRS)

    Manson, S. T.; Kennedy, D. J.; Starace, A. F.; Dill, D.

    1974-01-01

    The angular distribution of photoelectrons from atomic oxygen is investigated using Hartree-Fock (HF) wave functions. The correct formulation is used to compare HS and HF results. Agreement between these results is good and the HS calculations have been extended to atomic nitrogen and carbon as well.

  14. Automated manipulation of carbon nanotubes using atomic force microscopy.

    PubMed

    Zhang, Chao; Wu, Sen; Fu, Xing

    2013-01-01

    The manipulation of carbon nanotubes is an important and essential step for carbon-based nanodevice or nanocircuit assembly. However, the conventional push-and-image approach of manipulating carbon nanotubes using atomic force microscopy has low efficiency on account of the reduplicated scanning process during manipulation. In this article, an automated manipulation system is designed and tested. This automated manipulation system, which includes an atomic force microscope platform and a self-developed computer program for one-dimensional manipulation, is capable of automatically moving any assigned individual carbon nanotube to a defined target location without any intermediate scanning procedure. To demonstrate the high-efficiency of this automated manipulation system and its potential applications in nanoassembly, two experiments were conducted. The first experiment used this system to manipulate a carbon nanotube to a defined target location. In the second experiment, this system was used to automatically manipulate several carbon nanotubes for generating and translating a defined pattern of nanotubes.

  15. Properties of carbon nanotubes-doped Fe-sheath MgB2 for superconducting wires

    NASA Astrophysics Data System (ADS)

    Herbirowo, Satrio; Sofyan, Nofrijon; Saragih, Risuliniko; Imaduddin, Agung; Hendrik, Sebleku, Pius; Yuwono, Akhmad Herman

    2017-03-01

    Magnesium diboride (MgB2) is a potential superconductor materials that could be applied as superconducting wires due to its relatively high critical temperature. To study the influence of carbon nanotubes (CNT) on MgB2 wire manufacture, CNT-doped MgB2 superconducting wires have been fabricated from MgB2 and CNT powders sheathed in a SS304 stainless steel tube. In the process, the mixtures of MgB2 and CNT powders were inserted into the SS304 tubes and then were rolled and drawn. The properties of the fabricated superconducting wires were then analyzed through the crystal structure, surface morphology and temperature dependence of resistivity. The addition of CNT did not seem to have a significant influence on the crystal structure of Magnesium diboride. However, the addition of CNT caused the particle size of MgB2 became smaller. The temperature dependence of resistivity results showed that the critical temperatures were shifting linearly toward low temperatures due to the addition of CNT.

  16. Atomic scale simulation of carbon nanotube nucleation from hydrocarbon precursors

    PubMed Central

    Khalilov, Umedjon; Bogaerts, Annemie; Neyts, Erik C.

    2015-01-01

    Atomic scale simulations of the nucleation and growth of carbon nanotubes is essential for understanding their growth mechanism. In spite of over twenty years of simulation efforts in this area, limited progress has so far been made on addressing the role of the hydrocarbon growth precursor. Here we report on atomic scale simulations of cap nucleation of single-walled carbon nanotubes from hydrocarbon precursors. The presented mechanism emphasizes the important role of hydrogen in the nucleation process, and is discussed in relation to previously presented mechanisms. In particular, the role of hydrogen in the appearance of unstable carbon structures during in situ experimental observations as well as the initial stage of multi-walled carbon nanotube growth is discussed. The results are in good agreement with available experimental and quantum-mechanical results, and provide a basic understanding of the incubation and nucleation stages of hydrocarbon-based CNT growth at the atomic level. PMID:26691537

  17. Charge-signal multiplication mediated by urea wires inside Y-shaped carbon nanotubes

    SciTech Connect

    Lv, Mei; Liu, Zengrong; He, Bing; Xiu, Peng E-mail: ystu@shu.edu.cn; Tu, Yusong E-mail: ystu@shu.edu.cn

    2014-07-28

    In previous studies, we reported molecular dynamics (MD) simulations showing that single-file water wires confined inside Y-shaped single-walled carbon nanotubes (Y-SWNTs) held strong and robust capability to convert and multiply charge signals [Y. S. Tu, P. Xiu, R. Z. Wan, J. Hu, R. H. Zhou, and H. P. Fang, Proc. Natl. Acad. Sci. U.S.A. 106, 18120 (2009); Y. Tu, H. Lu, Y. Zhang, T. Huynh, and R. Zhou, J. Chem. Phys. 138, 015104 (2013)]. It is fascinating to see whether the signal multiplication can be realized by other kinds of polar molecules with larger dipole moments (which make the experimental realization easier). In this article, we use MD simulations to study the urea-mediated signal conversion and multiplication with Y-SWNTs. We observe that when a Y-SWNT with an external charge of magnitude 1.0 e (the model of a signal at the single-electron level) is solvated in 1 M urea solutions, urea can induce drying of the Y-SWNT and fill its interiors in single-file, forming Y-shaped urea wires. The external charge can effectively control the dipole orientation of the urea wire inside the main channel (i.e., the signal can be readily converted), and this signal can further be multiplied into 2 (or more) output signals by modulating dipole orientations of urea wires in bifurcated branch channels of the Y-SWNT. This remarkable signal transduction capability arises from the strong dipole-induced ordering of urea wires under extreme confinement. We also discuss the advantage of urea as compared with water in the signal multiplication, as well as the robustness and biological implications of our findings. This study provides the possibility for multiplying signals by using urea molecules (or other polar organic molecules) with Y-shaped nanochannels and might also help understand the mechanism behind signal conduction in both physical and biological systems.

  18. Dispersion forces between ultracold atoms and a carbon nanotube.

    PubMed

    Schneeweiss, P; Gierling, M; Visanescu, G; Kern, D P; Judd, T E; Günther, A; Fortágh, J

    2012-08-01

    Dispersion forces are long-range interactions between polarizable objects that arise from fluctuations in the electromagnetic field between them. Dispersion forces have been observed between microscopic objects such as atoms and molecules (the van der Waals interaction), between macroscopic objects (the Casimir interaction) and between an atom and a macroscopic object (the Casimir-Polder interaction). Dispersion forces are known to increase the attractive forces between the components in nanomechanical devices, to influence adsorption rates onto nanostructures, and to influence the interactions between biomolecules in biological systems. In recent years, there has been growing interest in studying dispersion forces in nanoscale systems and in exploring the interactions between carbon nanotubes and cold atoms. However, there are considerable difficulties in developing dispersion force theories for general, finite geometries such as nanostructures. Thus, there is a need for new experimental methods that are able to go beyond measurements of planar surfaces and nanoscale gratings and make measurements on isolated nanostructures. Here, we measure the dispersion force between a rubidium atom and a multiwalled carbon nanotube by inserting the nanotube into a cloud of ultracold rubidium atoms and monitoring the loss of atoms from the cloud as a function of time. We perform these experiments with both thermal clouds of ultracold atoms and with Bose-Einstein condensates. The results obtained with this approach will aid the development of theories describing quantum fields near nanostructures, and hybrid cold-atom/solid-state devices may also prove useful for applications in quantum sensing and quantum information.

  19. Relative stopping powers for atomic and molecular ions in carbon

    NASA Astrophysics Data System (ADS)

    Steuer, Malcolm F.

    1986-03-01

    Electronic stopping powers of carbon for atomic and molecular nitrogen ions have been calculated using semi-classical free electron scattering from Herman-Skillman potentials, parametrized to include an adjustable exponential screening factor F( tv, Z), representing atomic ions. For molecular ions, aligned along the beam direction and having velocity 1.2 a.u., the stopping powers for individual atomic components were calculated as a function of internuclear separation. Screening factors for the two centers of force were assumed to decrease linearly from the value at zero internuclear separation, equivalent to that of a silicon ion, to that for nitrogen ions at large separations. Results are consistent with the diminishment of average stopping power per atomic ion which has been observed for beam-aligned nitrogen molecular ions. Similar calculations for molecular hydrogen in carbon agree with the enhancement of stopping power which has been observed. Evidence of nonlinear effects is indicated.

  20. Mid-Atomic-Number Cylindrical Wire Array Precursor Plasma Studies on Zebra

    DOE PAGES

    Stafford, A; Safronova, A. S.; Kantsyrev, V. L.; ...

    2014-12-30

    The precursor plasmas from low wire number cylindrical wire arrays (CWAs) were previously shown to radiate at temperatures >300 eV for Ni-60 (94% Cu and 6% Ni) wires in experiments on the 1-MA Zebra generator. Continued research into precursor plasmas has studied additional midatomic-number materials including Cu and Alumel (95% Ni, 2% Al, 2% Mn, and 1% Si) to determine if the >300 eV temperatures are common for midatomic-number materials. Additionally, current scaling effects were observed by performing CWA precursor experiments at an increased current of 1.5 MA using a load current multiplier. Our results show an increase in amore » linear radiation yield of ~50% (16 versus 10 kJ/cm) for the experiments at increased current. However, plasma conditions inferred through the modeling of X-ray time-gated spectra are very similar for the precursor plasma in both current conditions.« less

  1. Mid-Atomic-Number Cylindrical Wire Array Precursor Plasma Studies on Zebra

    SciTech Connect

    Stafford, A; Safronova, A. S.; Kantsyrev, V. L.; Coverdale, Christine Anne; Weller, M. E.; Shrestha, I.; Shlyaptseva, V. V.; Chuvatin, A. S.

    2014-12-30

    The precursor plasmas from low wire number cylindrical wire arrays (CWAs) were previously shown to radiate at temperatures >300 eV for Ni-60 (94% Cu and 6% Ni) wires in experiments on the 1-MA Zebra generator. Continued research into precursor plasmas has studied additional midatomic-number materials including Cu and Alumel (95% Ni, 2% Al, 2% Mn, and 1% Si) to determine if the >300 eV temperatures are common for midatomic-number materials. Additionally, current scaling effects were observed by performing CWA precursor experiments at an increased current of 1.5 MA using a load current multiplier. Our results show an increase in a linear radiation yield of ~50% (16 versus 10 kJ/cm) for the experiments at increased current. However, plasma conditions inferred through the modeling of X-ray time-gated spectra are very similar for the precursor plasma in both current conditions.

  2. Reactions of carbon atoms in pulsed molecular beams

    SciTech Connect

    Reisler, H.

    1993-12-01

    This research program consists of a broad scope of experiments designed to unravel the chemistry of atomic carbon in its two spin states, P and D, by using well-controlled initial conditions and state-resolved detection of products. Prerequisite to the proposed studies (and the reason why so little is known about carbon atom reactions), is the development of clean sources of carbon atoms. Therefore, in parallel with the studies of its chemistry and reaction dynamics, the authors continuously explore new, state-specific and efficient ways of producing atomic carbon. In the current program, C({sup 3}P) is produced via laser ablation of graphite, and three areas of study are being pursued: (i) exothermic reactions with small inorganic molecules (e.g., O{sub 2}, N{sub 2}O, NO{sub 2}) that can proceed via multiple pathways; (ii) the influence of vibrational and translational energy on endothermic reactions involving H-containing reactants that yield CH products (e.g., H{sub 2}O H{sub 2}CO); (iii) reactions of C({sup 3}P) with free radicals (e.g., HCO, CH{sub 3}O). In addition, the authors plan to develop a source of C({sup 1}D) atoms by exploiting the pyrolysis of diazotetrazole and its salts in the ablation source. Another important goal involves collaboration with theoreticians in order to obtain relevant potential energy surfaces, rationalize the experimental results and predict the roles of translational and vibrational energies.

  3. The doping effect of multiwall carbon nanotube on MgB2/Fe superconductor wire

    NASA Astrophysics Data System (ADS)

    Kim, J. H.; Yeoh, W. K.; Qin, M. J.; Xu, X.; Dou, S. X.

    2006-07-01

    We evaluated the doping effect of two types of multiwall carbon nanotubes (CNTs) with different aspect ratios on MgB2/Fe monofilament wires. Relationships between microstructure, magnetic critical current density (Jc), critical temperature (Tc), upper critical field (Hc2), and irreversibility field (Hirr) for pure and CNT doped wires were systematically studied for sintering temperature from 650to1000°C. As the sintering temperature increased, Tc for short CNT doped sample slightly decreased, while Tc for long CNT doped sample increased. This indicates better reactivity between MgB2 and short CNT due to its small aspect ratio, and substitution of carbon (C) from short CNT for boron (B) occurs. In addition, short CNT doped samples sintered at high temperatures of 900 and 1000°C exhibited excellent Jc, and this value was approximately 104A /cm2 in fields up to 8T at 5K. This suggests that short CNT is a promising carbon source for MgB2 superconductor with excellent Jc. In particular, inclusion of nanosized MgO particles and substitution of C into the MgB2 lattice could result in strong flux pinning centers.

  4. Arc spraying of nano-structured wire on carbon steel: examination of coating microstructures

    SciTech Connect

    Al Askandarani, A.; Hashmi, M. S. J.; Yilbas, B. S.

    2011-01-17

    Arc spraying of nano-structured wire (TAFA 95MX) onto carbon steel is carried out. The workpieces coated were heat treated at temperature similar to the operating temperature of the hot-path components of power gas turbines. The morphological and microstructural changes in the coating are examined using optical and Scanning Electron Microscope (SEM). The surface roughness and microhardness of the resulting coatings are measured. It is found that the formation of dimples like structure at surface increased the surface roughness of the coating. The microhardness of the resulting coating is significantly higher than the base material hardness. Heat treatment does not alter the microstructure and microhardness of the coating.

  5. Atomic scale investigation of redistribution of alloying elements in pearlitic steel wires upon cold-drawing and annealing.

    PubMed

    Li, Y J; Choi, P; Goto, S; Borchers, C; Raabe, D; Kirchheim, R

    2013-09-01

    A local electrode atom probe has been employed to analyze the redistribution of alloying elements including Si, Mn, and Cr in pearlitic steel wires upon cold-drawing and subsequent annealing. It has been found that the three elements undergo mechanical mixing upon cold-drawing at large strains, where Mn and Cr exhibit a nearly homogeneous distribution throughout both ferrite and cementite, whereas Si only dissolves slightly in cementite. Annealing at elevated temperatures leads to a reversion of the mechanical alloying. Si atoms mainly segregate at well-defined ferrite (sub)grain boundaries formed during annealing. Cr and Mn are strongly concentrated in cementite adjacent to the ferrite/cementite interface due to their lower diffusivities in cementite than in ferrite. Copyright © 2012 Elsevier B.V. All rights reserved.

  6. Influence of the Manufacturing Process on Defects in the Galvanized Coating of High Carbon Steel Wires

    PubMed Central

    Gelfi, Marcello; Solazzi, Luigi; Poli, Sandro

    2017-01-01

    This study is a detailed failure analysis of galvanized high carbon steel wires, which developed coating cracks during the torsion test performed as a quality control at the end of the manufacturing process. Careful visual inspections showed that the cracks are already present in the coating before the torsion test. In order to explain the origin of these cracks, systematic metallographic investigations were performed by means of optical and scanning electron microscope on both the wires and the rods that have been cold drawn to produce the wire. The chemical composition of the galvanized coatings was evaluated by means of energy dispersive spectroscopy. Micro bidimensional X-ray diffraction experiments were also performed to measure the residual stresses in the galvanized coating. The results showed that the failure is related to two main factors: the relatively high content of silicon in the steel and the unsuitable cooling rate of the rods at the exit from the galvanizing bath. The mechanism proposed to explain the origin of the defects was supported by Finite Elements Methods simulations and verified with in-plant tests. The proper countermeasures were then applied and the problem successfully solved. PMID:28772623

  7. Influence of the Manufacturing Process on Defects in the Galvanized Coating of High Carbon Steel Wires.

    PubMed

    Gelfi, Marcello; Solazzi, Luigi; Poli, Sandro

    2017-03-06

    This study is a detailed failure analysis of galvanized high carbon steel wires, which developed coating cracks during the torsion test performed as a quality control at the end of the manufacturing process. Careful visual inspections showed that the cracks are already present in the coating before the torsion test. In order to explain the origin of these cracks, systematic metallographic investigations were performed by means of optical and scanning electron microscope on both the wires and the rods that have been cold drawn to produce the wire. The chemical composition of the galvanized coatings was evaluated by means of energy dispersive spectroscopy. Micro bidimensional X-ray diffraction experiments were also performed to measure the residual stresses in the galvanized coating. The results showed that the failure is related to two main factors: the relatively high content of silicon in the steel and the unsuitable cooling rate of the rods at the exit from the galvanizing bath. The mechanism proposed to explain the origin of the defects was supported by Finite Elements Methods simulations and verified with in-plant tests. The proper countermeasures were then applied and the problem successfully solved.

  8. Single Particle Transport Through Carbon Nanotube Wires: Effect of Defects and Polyhedral Cap

    NASA Technical Reports Server (NTRS)

    Anantram, M. P.; Govidan, T. R.

    1999-01-01

    The ability to manipulate carbon nanotubes with increasing precision has enabled a large number of successful electron transport experiments. These studies have primarily focussed on characterizing transport through both metallic and semiconducting wires. Tans et al. demonstrated ballistic transport in single-wall nanotubes for the first time, although the experimental configuration incurred large contact resistance. Subsequently, methods of producing low contact resistances have been developed and two terminal conductances smaller than 50 k-ohms have been repeatably demonstrated in single-wall and multi-wall nanotubes. In multi-wall nanotubes, Frank et al. demonstrated a resistance of approximately h/2e(exp 2) in a configuration where the outermost layer made contact to a liquid metal. This was followed by the work of de Pablo et al. where a resistance of h(bar)/27e(exp 2) (approximately 478 ohms) was measured in a configuration where electrical contact was made to many layers of a multi-wall nanotube. Frank et al. and Pablo et al. note that each conducting layer contributes a conductance of only 2e(exp 2)/h, instead of the 4e(exp 2)/h that a single particle mode counting picture yields. These small resistances have been obtained in microns long nanotubes, making them the best conducting molecular wires to date. The large conductance of nanotube wires stems from the fact that the crossing bands of nanotubes are robust to defect scattering.

  9. Fabrication and static characterization of carbon-fiber-reinforced polymers with embedded NiTi shape memory wire actuators

    NASA Astrophysics Data System (ADS)

    de Araújo, C. J.; Rodrigues, L. F. A.; Coutinho Neto, J. F.; Reis, R. P. B.

    2008-12-01

    In this work, unidirectional carbon-fiber-reinforced polymers (CFRP) with embedded NiTi shape memory alloy (SMA) wire actuators were manufactured using a universal testing machine equipped with a thermally controlled chamber. Beam specimens containing cold-worked, annealed and trained NiTi SMA wires distributed along their neutral plane were fabricated. Several tests in a three-point bending mode at different constant temperatures were performed. To verify thermal buckling effects, electrical activation of the specimens was realized in a cantilevered beam mode and the influence of the SMA wire actuators on the tip deflection of the composite is demonstrated.

  10. Determination of heavy metals in bee honey with connected and not connected metal wires using inductively coupled plasma atomic emission spectrometry (ICP-AES).

    PubMed

    Özcan, Mehmet Musa; Al Juhaimi, Fahad Y

    2012-04-01

    Two honey samples are taken from two parts of the same honeycomb: one that contacts to the surface of the wire and the other taken from the surface that does not contact the wires. Heavy metal contents of these two samples were determined by inductively coupled plasma atomic emission spectrometry). The Mo, Cd, Cr, Fe, Mn, Ni and Zn contents of the honey in contact with wire is higher when compared to the other. Especially, Fe and Zn contents of honey in contact with wire is much higher than the non-contact one. These values are, respectively, 190.21 and 112.76 ppm. Besides, Ni content of honey in contact with wire is approximately 50% higher.

  11. Highly Conductive Wire: Cu Carbon Nanotube Composite Ampacity and Metallic CNT Buckypaper Conductivity

    NASA Technical Reports Server (NTRS)

    de Groh, Henry C.

    2017-01-01

    NASA is currently working on developing motors for hybrid electric propulsion applications in aviation. To make electric power more feasible in airplanes higher power to weight ratios are sought for electric motors. One facet to these efforts is to improve (increase) the conductivity and (lower) density of the magnet wire used in motors. Carbon nanotubes (CNT) and composites containing CNT are being explored as a possible way to increase wire conductivity and lower density. Presented here are measurements of the current carrying capacity (ampacity) of a composite made from CNT and copper. The ability of CNT to improve the conductivity of such composites is hindered by the presence of semiconductive CNT (s-CNT) that exist in CNT supplies naturally, and currently, unavoidably. To solve this problem, and avoid s-CNT, various preferential growth and sorting methods are being explored. A supply of sorted 95 metallic CNT (m-CNT) was acquired in the form of thick film Buckypaper (BP) as part of this work and characterized using Raman spectroscopy, resistivity, and density measurements. The ampacity (Acm2) of the Cu-5volCNT composite was 3.8 lower than the same gauge pure Cu wire similarly tested. The lower ampacity in the composite wire is believed to be due to the presence of s-CNT in the composite and the relatively low (proper) level of longitudinal cooling employed in the test method. Although Raman spectroscopy can be used to characterize CNT, a strong relation between the ratios of the primary peaks GGand the relative amounts of m-CNT and s-CNT was not observed. The average effective conductivity of the CNT in the sorted, 95 m-CNT BP was 2.5 times higher than the CNT in the similar but un-sorted BP. This is an indication that improvements in the conductivity of CNT composites can be made by the use of sorted, highly conductive m-CNT.

  12. Neutral atomic carbon in dense molecular clouds

    NASA Technical Reports Server (NTRS)

    Zmuidzinas, J.; Betz, A. L.; Boreiko, R. T.; Goldhaber, D. M.

    1988-01-01

    The 370 micron 3P2-3P1 fine-structure line of neutral carbon was detected in seven sources: OMC 1, NGC 2024, S140, W3, DR 21, M17, and W51. Simultaneous analysis of J = 2-1 data and available observations of the J = 1-0 line make it possible to deduce optical depths and excitation temperatures for these lines. These data indicate that both C I lines are likely to be optically thin, and that the ratio of C I to CO column densities in these clouds is typically about 0.1.

  13. Dielectric barrier discharge carbon atomic emission spectrometer: universal GC detector for volatile carbon-containing compounds.

    PubMed

    Han, Bingjun; Jiang, Xiaoming; Hou, Xiandeng; Zheng, Chengbin

    2014-01-07

    It was found that carbon atomic emission can be excited in low temperature dielectric barrier discharge (DBD), and an atmospheric pressure, low power consumption, and compact microplasma carbon atomic emission spectrometer (AES) was constructed and used as a universal and sensitive gas chromatographic (GC) detector for detection of volatile carbon-containing compounds. A concentric DBD device was housed in a heating box to increase the plasma operation temperature to 300 °C to intensify carbon atomic emission at 193.0 nm. Carbon-containing compounds directly injected or eluted from GC can be decomposed, atomized, and excited in this heated DBD for carbon atomic emission. The performance of this new optical detector was first evaluated by determination of a series of volatile carbon-containing compounds including formaldehyde, ethyl acetate, methanol, ethanol, 1-propanol, 1-butanol, and 1-pentanol, and absolute limits of detection (LODs) were found at a range of 0.12-0.28 ng under the optimized conditions. Preliminary experimental results showed that it provided slightly higher LODs than those obtained by GC with a flame ionization detector (FID). Furthermore, it is a new universal GC detector for volatile carbon-containing compounds that even includes those compounds which are difficult to detect by FID, such as HCHO, CO, and CO2. Meanwhile, hydrogen gas used in conventional techniques was eliminated; and molecular optical emission detection can also be performed with this GC detector for multichannel analysis to improve resolution of overlapped chromatographic peaks of complex mixtures.

  14. Conductive graphene fibers for wire-shaped supercapacitors strengthened by unfunctionalized few-walled carbon nanotubes.

    PubMed

    Ma, Yanwen; Li, Pan; Sedloff, Jennifer W; Zhang, Xiao; Zhang, Hongbo; Liu, Jie

    2015-02-24

    Graphene fibers are a promising electrode material for wire-shaped supercapacitors (WSSs) that can be woven into textiles for future wearable electronics. However, the main concern is their high linear resistance, which could be effectively decreased by the addition of highly conductive carbon nanotubes (CNTs). During the incorporation process, CNTs are typically preoxidized by acids or dispersed by surfactants, which deteriorates their electrical and mechanical properties. Herein, unfunctionalized few-walled carbon nanotubes (FWNTs) were directly dispersed in graphene oxide (GO) without preoxidation or surfactants, allowing them to maintain their high conductivity and perfect structure, and then used to prepare CNT-reduced GO (RGO) composite fibers by wet-spinning followed by reduction. The pristine FWNTs increased the stress strength of the parent RGO fibers from 193.3 to 385.7 MPa and conductivity from 53.3 to 210.7 S cm(-1). The wire-shaped supercapacitors (WSSs) assembled based on these CNT-RGO fibers presented a high volumetric capacitance of 38.8 F cm(-3) and energy density of 3.4 mWh cm(-3). More importantly, the performance of WSSs was revealed to decrease with increasing length due to increased resistance, revealing a key issue for graphene-based electrodes in WSSs.

  15. Abundance of atomic carbon /C I/ in dense interstellar clouds

    NASA Technical Reports Server (NTRS)

    Phillips, T. G.; Huggins, P. J.

    1981-01-01

    The abundance of interstellar neutral atomic carbon is investigated by means of its ground state fine-structure line emission at 492 GHz using the 91.5 cm telescope of NASAs Kuiper Airborne Observatory. Atomic carbon is found to be very abundant in dense interstellar molecular clouds with column densities of about 10 to the 19th per sq cm. Because the observations have considerably greater column densities than current theories of carbon chemistry, it is suggested that the physical conditions of these clouds are not as simple as assumed in the models. Various situations are discussed which would lead to large C I abundances, including the possibility that the chemical lifetimes of the clouds are relatively short.

  16. Exploring excited-state hydrogen atom transfer along an ammonia wire cluster: Competitive reaction paths and vibrational mode selectivity

    NASA Astrophysics Data System (ADS)

    Tanner, Christian; Manca, Carine; Leutwyler, Samuel

    2005-05-01

    The excited-state hydrogen-atom transfer (ESHAT) reaction of the 7-hydroxyquinoline•(NH3)3 cluster involves a crossing from the initially excited π1π* to a π1σ* state. The nonadiabatic coupling between these states induces homolytic dissociation of the O-H bond and H-atom transfer to the closest NH3 molecule, forming a biradical structure denoted HT1, followed by two more Grotthus-type translocation steps along the ammonia wire. We investigate this reaction at the configuration interaction singles level, using a basis set with diffuse orbitals. Intrinsic reaction coordinate calculations of the enol→HT1 step predict that the H-atom transfer is preceded and followed by extensive twisting and bending of the ammonia wire, as well as large O -H⋯NH3 hydrogen bond contraction and expansion. The calculations also predict an excited-state proton transfer path involving synchronous proton motions; however, it lies 20-25kcal/mol above the ESHAT path. Higher singlet and triplet potential curves are calculated along the ESHAT reaction coordinate: Two singlet-triplet curve crossings occur within the HT1 product well and intersystem crossing to these Tn states branches the reaction back to the enol reactant side, decreasing the ESHAT yield. In fact, a product yield of ≈40% 7-ketoquinoline•(NH3)3 is experimentally observed. The vibrational mode selectivity of the enol→HT1 reaction step [C. Manca, C. Tanner, S. Coussan, A. Bach, and S. Leutwyler, J. Chem. Phys. 121, 2578 (2004)] is shown to be due to the large sensitivity of the diffuse πσ* state to vibrational displacements along the intermolecular coordinates.

  17. Enhanced Electrical Conductivity in Extruded Single-Wall Carbon Nanotube Wires from Modified Coagulation Parameters and Mechanical Processing.

    PubMed

    Bucossi, Andrew R; Cress, Cory D; Schauerman, Christopher M; Rossi, Jamie E; Puchades, Ivan; Landi, Brian J

    2015-12-16

    Single-wall carbon nanotubes (SWCNTs) synthesized via laser vaporization have been dispersed using chlorosulfonic acid (CSA) and extruded under varying coagulation conditions to fabricate multifunctional wires. The use of high purity SWCNT material based upon established purification methods yields wires with highly aligned nanoscale morphology and an over 4× improvement in electrical conductivity over as-produced SWCNT material. A series of eight liquids have been evaluated for use as a coagulant bath, and each coagulant yielded unique wire morphology based on its interaction with the SWCNT-CSA dispersion. In particular, dimethylacetamide as a coagulant bath is shown to fabricate highly uniform SWCNT wires, and acetone coagulant baths result in the highest specific conductivity and tensile strength. A 2× improvement in specific conductivity has been measured for SWCNT wires following tensioning induced both during extrusion via increased coagulant bath depth and during solvent evaporation via mechanical strain, over that of as-extruded wires from shallower coagulant baths. Overall, combination of the optimized coagulation parameters has yielded acid-doped wires with the highest reported room temperature electrical conductivities to date of 4.1-5.0 MS/m and tensile strengths of 210-250 MPa. Such improvements in bulk electrical conductivity can impact the adoption of metal-free, multifunctional SWCNT materials for advanced cabling architectures.

  18. Integrated atom detector based on field ionization near carbon nanotubes

    SciTech Connect

    Gruener, B.; Jag, M.; Stibor, A.; Visanescu, G.; Haeffner, M.; Kern, D.; Guenther, A.; Fortagh, J.

    2009-12-15

    We demonstrate an atom detector based on field ionization and subsequent ion counting. We make use of field enhancement near tips of carbon nanotubes to reach extreme electrostatic field values of up to 9x10{sup 9} V/m, which ionize ground-state rubidium atoms. The detector is based on a carpet of multiwall carbon nanotubes grown on a substrate and used for field ionization, and a channel electron multiplier used for ion counting. We measure the field enhancement at the tips of carbon nanotubes by field emission of electrons. We demonstrate the operation of the field ionization detector by counting atoms from a thermal beam of a rubidium dispenser source. By measuring the ionization rate of rubidium as a function of the applied detector voltage we identify the field ionization distance, which is below a few tens of nanometers in front of nanotube tips. We deduce from the experimental data that field ionization of rubidium near nanotube tips takes place on a time scale faster than 10{sup -10} s. This property is particularly interesting for the development of fast atom detectors suitable for measuring correlations in ultracold quantum gases. We also describe an application of the detector as partial pressure gauge.

  19. Formation and manipulation of a metallic wire of single gold atoms

    NASA Astrophysics Data System (ADS)

    Yanson, A. I.; Bollinger, G. Rubio; van den Brom, H. E.; Agraït, N.; van Ruitenbeek, J. M.

    1998-10-01

    The continuing miniaturization of microelectronics raises the prospect of nanometre-scale devices with mechanical and electrical properties that are qualitatively different from those at larger dimensions. The investigation of these properties, and particularly the increasing influence of quantum effects on electron transport, has therefore attracted much interest. Quantum properties of the conductance can be observed when `breaking' a metallic contact: as two metal electrodes in contact with each other are slowly retracted, the contact area undergoes structural rearrangements until it consists in its final stages of only a few bridging atoms. Just before the abrupt transition to tunnelling occurs, the electrical conductance through a monovalent metal contact is always close to a value of 2e2/h (~12.9Ω-1), where e is the charge on an electron and h is Planck's constant. This value corresponds to one quantum unit of conductance, thus indicating that the `neck' of the contact consists of a single atom. In contrast to previous observations of only single-atom necks, here we describe the breaking of atomic-scale gold contacts, which leads to the formation of gold chains one atom thick and at least four atoms long. Once we start to pull out a chain, the conductance never exceeds 2e2/h, confirming that it acts as a one-dimensional quantized nanowire. Given their high stability and the ability to support ballistic electron transport, these structures seem well suited for the investigation of atomic-scale electronics.

  20. An EEG (electroencephalogram) recording system with carbon wire electrodes for simultaneous EEG-fMRI (functional magnetic resonance imaging) recording

    PubMed Central

    Negishi, Michiro; Abildgaard, Mark; Laufer, Ilan; Nixon, Terry; Constable, Robert Todd

    2008-01-01

    Simultaneous EEG-fMRI (Electroencephalography-functional Magnetic Resonance Imaging) recording provides a means for acquiring high temporal resolution electrophysiological data and high spatial resolution metabolic data of the brain in the same experimental runs. Carbon wire electrodes (not metallic EEG electrodes with carbon wire leads) are suitable for simultaneous EEG-fMRI recording, because they cause less RF (radio-frequency) heating and susceptibility artifacts than metallic electrodes. These characteristics are especially desirable for recording the EEG in high field MRI scanners. Carbon wire electrodes are also comfortable to wear during long recording sessions. However, carbon electrodes have high electrode-electrolyte potentials compared to widely used Ag/AgCl (silver/silver-chloride) electrodes, which may cause slow voltage drifts. This paper introduces a prototype EEG recording system with carbon wire electrodes and a circuit that suppresses the slow voltage drift. The system was tested for the voltage drift, RF heating, susceptibility artifact, and impedance, and was also evaluated in a simultaneous ERP (event-related potential)-fMRI experiment. PMID:18588913

  1. X-ray emission from a high-atomic-number z-pinch plasma created from compact wire arrays

    SciTech Connect

    Sanford, T.W.L.; Nash, T.J.; Marder, B.M.

    1996-03-01

    Thermal and nonthermal x-ray emission from the implosion of compact tungsten wire arrays, driven by 5 MA from the Saturn accelerator, are measured and compared with LLNL Radiation-Hydro-Code (RHC) and SNL Hydro-Code (HC) numerical models. Multiple implosions, due to sequential compressions and expansions of the plasma, are inferred from the measured multiple x-radiation bursts. Timing of the multiple implosions and the thermal x-ray spectra measured between 1 and 10 keV are consistent with the RHC simulations. The magnitude of the nonthermal x-ray emission measured from 10 to 100 keV ranges from 0.02 to 0.08% of the total energy radiated and is correlated with bright-spot emission along the z-axis, as observed in earlier Gamble-11 single exploding-wire experiments. The similarities of the measured nonthermal spectrum and bright-spot emission with those measured at 0.8 MA on Gamble-II suggest a common production mechanism for this process. A model of electron acceleration across magnetic fields in highly-collisional, high-atomic-number plasmas is developed, which shows the existence of a critical electric field, E{sub c}, below which strong nonthermal electron creation (and the associated nonthermal x rays) do not occur. HC simulations show that significant nonthermal electrons are not expected in this experiment (as observed) because the calculated electric fields are at least one to two orders-of-magnitude below E{sub c}. These negative nonthermal results are confirmed by RHC simulations using a nonthermal model based on a Fokker-Plank analysis. Lastly, the lower production efficiency and the larger, more irregular pinch spots formed in this experiment relative to those measured on Gamble II suggest that implosion geometries are not as efficient as single exploding-wire geometries for warm x-ray production.

  2. Single-shell carbon nanotubes imaged by atomic force microscopy

    NASA Astrophysics Data System (ADS)

    Höper, Ralf; Workman, Richard K.; Chen, Dong; Sarid, Dror; Yadav, Tapesh; Withers, James C.; Loutfy, Raouf O.

    1994-05-01

    Single-shell carbon nanotubes, approximately 1 nm in diameter, have been imaged for the first time by atomic force microscopy operating in both the contact and tapping modes. For the contact mode, the height of the imaged nanotubes has been calibrated using the atomic steps of the silicon substrate on which the nanotubes were deposited. For the tapping mode, the calibration was performed using an industry-standard grating. The paper discusses substrate and sample preparation methods for the characterization by scanning probe microscopy of nanotubes deposited on a substrate.

  3. Atomic-scale deformation in N-doped carbon nanotubes.

    PubMed

    Sun, Chia-Liang; Wang, Houng-Wei; Hayashi, Michitoshi; Chen, Li-Chyong; Chen, Kuei-Hsien

    2006-07-05

    We present the N-doping induced atomic-scale structural deformation in N-doped carbon nanotubes by using density functional theory calculations. For substitutional N-doped nanotube clusters, the N dopant with an excess electron lone pair exhibits the high negative charge, and the homogeneously distributed dopants enlarge the tube diameter in both zigzag and armchair cases. On the other hand, in pyridine-like N-doped ones, the concentrated N atoms result in a positively curved graphene layer and, thus, can be responsible for tube wall roughness and the formation of interlinked structures.

  4. Atomic hydrogen maser measurements with wall surfaces of carbon tetrafluoride

    NASA Technical Reports Server (NTRS)

    Vessot, R. F. C.; Mattison, E. M.; Imbier, E. A.; Zhai, Z. C.

    1984-01-01

    The principal objectives of the Smithsonian Astrophysical Observatory cold maser research programs are given. This work is aimed principally at understanding more about the interaction of hydrogen atoms with wall coatings of fluorinated ethylene propylene (Dupont Teflon FEP-120 co-polymer) and of carbon tetrafluoride (CE4). The principal measured quantity in these experiments is the wall shift of the maser's output frequency. The wall shift per atomic collision was calculated from the measured wall frequency shift. This assumes that the wall surface area is smooth on a molecular scale.

  5. Mechanical evaluation of hip cement spacer reinforcement with stainless steel Kirschner wires, titanium and carbon rods, and stainless steel mesh.

    PubMed

    Kaku, Nobuhiro; Tabata, Tomonori; Tsumura, Hiroshi

    2015-04-01

    In two-stage treatments for infections after total hip arthroplasty, antibiotic-loaded cement spacers help treat the infection by antibiotic elution and prevent contraction. However, such spacers are weak and may fracture while awaiting replacement, impairing functionality. We evaluated whether a Kirschner wire (K-wire) mounted into the spacer reinforced its strength along with the effects of the reinforcing material, position, and intensity. Spacers without reinforcing materials constituted the control group. As reinforcing materials, stainless steel K-wires (diameters 3 and 6 mm), titanium alloy and carbon fibers (diameter 3.175 mm), and stainless steel meshes (inner and outer diameters, 6 and 9 mm, respectively) were inserted into the spacer mold before filling with cement. The spacers complied with ISO 7206-4; a compressive load was applied using a testing machine with a velocity of 25.4 mm/min, and the maximum load was recorded. We used 1-3 K-wires positioned on the medial side, lateral side, neck only, and stem only and tested 3 specimens for each condition. The control group withstood the highest load. Stainless steel was the strongest material; 3-mm K-wires in the neck and lateral side withstood a higher load. The computed tomography (CT) imaging revealed a cavity between the K-wires and cement. When K-wires were inserted along the whole length, despite cement fractures, continuity was maintained because of the reinforcing materials. It is difficult to improve the reinforcing strength of spacers using K-wires; however, K-wires prevented dislocation of cement spacer fragments, which can help prevent contraction and facilitate spacer removal during replacement.

  6. Ab initio quantum transport in atomic carbon chains

    NASA Astrophysics Data System (ADS)

    Botello-Méndez, Andrés R.; Charlier, Jean-Christophe; Banhart, Florian; NAPS Team; Carbyne Collaboration

    2015-03-01

    Carbyne, the sp-hybridized phase of carbon, is still a missing link in the family of carbon allotropes. Recently, detailed electrical measurements and first-principles electronic transport calculations have been performed on monoatomic carbon chains. When the 1D system is under strain, the current-voltage curves exhibit a semiconducting behavior, which corresponds to the polyyne structure of the atomic chain with alternating single and triple bonds. Conversely, when the chain is unstrained, the ohmic behavior is observed in agreement with the metallic cumulene structure with double bonds, confirming recent theoretical predictions, namely that a metal-insulator transition can be induced by adjusting the strain. The key role of the contacting leads is also scrutinized by ab initio quantum conductance calculations, explaining the rectifying behavior measured in monoatomic carbon chains in a non-symmetric contact configuration.

  7. Electroanalytical performance of carbon films with near-atomic flatness.

    PubMed

    Ranganathan, S; McCreery, R L

    2001-03-01

    Physicochemical and electrochemical characterization of carbon films obtained by pyrolyzing a commercially available photoresist has been performed. Photoresist spin-coated on to a silicon wafer was pyrolyzed at 1,000 degrees C in a reducing atmosphere (95% nitrogen and 5% hydrogen) to produce conducting carbon films. The pyrolyzed photoresist films (PPF) show unusual surface properties compared to other carbon electrodes. The surfaces are nearly atomically smooth with a root-mean-square roughness of <0.5 nm. PPF have a very low background current and oxygen/carbon atomic ratio compared to conventional glassy carbon and show relatively weak adsorption of methylene blue and anthraquinone-2,6-disulfonate. The low oxygen/carbon ratio and the relative stability of PPF indicate that surfaces may be partially hydrogen terminated. The pyrolyzed films were compared to glassy carbon (GC) heat treated under the same conditions as pyrolysis to evaluate the electroanalytical utility of PPF. Heterogeneous electron-transfer kinetics of various redox systems were evaluated. For Ru(NH3)6(3+/2+), Fe(CN)6(3-/4-), and chlorpromazine, fresh PPF surfaces show electron-transfer rates similar to those on GC, but for redox systems such as Fe3+/2+, ascorbic acid, dopamine, and oxygen, the kinetics on PPF are slower. Very weak interactions between the PPF surface and these redox systems lead to their slow electron-transfer kinetics. Electrochemical anodization results in a simultaneous increase in background current, adsorption, and electron-transfer kinetics. The PPF surfaces can be chemically modified via diazonium ion reduction to yield a covalently attached monolayer. Such a modification could help in the preparation of low-cost, high-volume analyte-specific electrodes for diverse electroanalytical applications. Overall, pyrolysis of the photoresist yields an electrode surface with properties similar to a very smooth version of glassy carbon, with some important differences in surface

  8. Carbon nanotube forests growth using catalysts from atomic layer deposition

    SciTech Connect

    Chen, Bingan; Zhang, Can; Esconjauregui, Santiago; Xie, Rongsi; Zhong, Guofang; Robertson, John; Bhardwaj, Sunil; Cepek, Cinzia

    2014-04-14

    We have grown carbon nanotubes using Fe and Ni catalyst films deposited by atomic layer deposition. Both metals lead to catalytically active nanoparticles for growing vertically aligned nanotube forests or carbon fibres, depending on the growth conditions and whether the substrate is alumina or silica. The resulting nanotubes have narrow diameter and wall number distributions that are as narrow as those grown from sputtered catalysts. The state of the catalyst is studied by in-situ and ex-situ X-ray photoemission spectroscopy. We demonstrate multi-directional nanotube growth on a porous alumina foam coated with Fe prepared by atomic layer deposition. This deposition technique can be useful for nanotube applications in microelectronics, filter technology, and energy storage.

  9. Heat conduction in double-walled carbon nanotubes with intertube additional carbon atoms.

    PubMed

    Cui, Liu; Feng, Yanhui; Tan, Peng; Zhang, Xinxin

    2015-07-07

    Heat conduction of double-walled carbon nanotubes (DWCNTs) with intertube additional carbon atoms was investigated for the first time using a molecular dynamics method. By analyzing the phonon vibrational density of states (VDOS), we revealed that the intertube additional atoms weak the heat conduction along the tube axis. Moreover, the phonon participation ratio (PR) demonstrates that the heat transfer in DWCNTs is dominated by low frequency modes. The added atoms cause the mode weight factor (MWF) of the outer tube to decrease and that of the inner tube to increase, which implies a lower thermal conductivity. The effects of temperature, tube length, and the number and distribution of added atoms were studied. Furthermore, an orthogonal array testing strategy was designed to identify the most important structural factor. It is indicated that the tendencies of thermal conductivity of DWCNTs with added atoms change with temperature and length are similar to bare ones. In addition, thermal conductivity decreases with the increasing number of added atoms, more evidently for atom addition concentrated at some cross-sections rather than uniform addition along the tube length. Simultaneously, the number of added atoms at each cross-section has a considerably more remarkable impact, compared to the tube length and the density of chosen cross-sections to add atoms.

  10. Probing the improbable: imaging carbon atoms in alumina

    SciTech Connect

    Marquis, E A; Yahia, Noor; Larson, David J.; Miller, Michael K; Todd, Richard

    2010-01-01

    Atom-probe tomography has proven very powerful to analyze the detailed structure and chemistry of metallic alloys and semiconductor structures while ceramic materials have remained outside its standard purview. In the current work, we demonstrate that bulk alumina can be quantitatively analyzed and microstructural features observed. The analysis of grain boundary carbon segregation - barely achievable by electron microscopy - opens the possibility of understanding the mechanistic effects of dopants on mechanical properties, fracture and wear properties of bulk oxides.

  11. Highly dense and perfectly aligned single-walled carbon nanotubes fabricated by diamond wire drawing dies.

    PubMed

    Liu, Guangtong; Zhao, Yuanchun; Deng, Ke; Liu, Zheng; Chu, Weiguo; Chen, Jingran; Yang, Yanlian; Zheng, Kaihong; Huang, Haibo; Ma, Wenjun; Song, Li; Yang, Haifang; Gu, Changzhi; Rao, Guanghui; Wang, Chen; Xie, Sishen; Sun, Lianfeng

    2008-04-01

    We have developed a low-cost and effective method to align single-walled carbon nanotubes (SWNTs) using a series of diamond wire drawing dies. The obtained SWNTs are highly dense and perfectly aligned. X-ray diffraction (XRD) indicates that the highly dense and perfectly aligned SWNTs (HDPA-SWNTs) form a two-dimensional triangular lattice with a lattice constant of 19.62 A. We observe a sharp (002) reflection in the XRD pattern, which should be ascribed to an intertube spacing 3.39 A of adjacent SWNTs. Raman spectra reveal that the radical breath mode (RBM) of SWNTs with larger diameter in the HDPA-SWNTs is suppressed compared with that of as-grown SWNTs. The HDPA-SWNTs have a large density, approximately 1.09 g/cm 3, and a low resistivity, approximately 2 m Omega cm, at room temperature, as well as a large response to light illumination.

  12. Notch toughness in hot-rolled low carbon steel wire rod

    SciTech Connect

    Baarman, M.H.

    1999-12-01

    Charpy V-notch toughness has been investigated in four hot-rolled, low carbon steels with different grain sizes and carbon contents between 0.019 and 0.057%. The raw material was wire rod designed for drawing and possible subsequent cold heading operations and manufactured from continuous cast billets. In this study, the influence of microstructure, mechanical properties, and alloying elements on the ductile-brittle transition behavior has been assessed. A particular emphasis has been given to the influence of boron with contents up to 0.0097%. As a result, transition temperatures between {minus}29 and +50 C explicated by the material properties have been obtained. The examination also shows that the transition temperature raises with circa 0.5 C for each added ppm boron most likely as a consequence of an enlargement of the ferrite grain size and the reduction of yield and tensile strength. The highest upper shelf energy and lowest transition temperature can be observed in a steel without boron additions and with maximum contents of carbon, silicon, and manganese.

  13. Atomization and particle-jet interactions in the wire-arc spraying process

    NASA Astrophysics Data System (ADS)

    Hussary, N. A.; Heberlein, J. V. R.

    2001-12-01

    The wire-arc spraying process, one of several thermal spray processes, has gained a sizable part of the thermal spray market. However, better control is needed for this process to be used for applications of high precision coatings. This study is aimed at investigating the liquid-metal droplet formation process in order to identify methods for droplet trajectory control. A high speed Kodak imaging system has been used to observe the droplet formation for different operating conditions. Decreasing the upstream pressure and the current levels leads to a reduction in the asymmetric melting of both the anode and cathode. By decreasing the interactions of the large eddy structures with the formed metal agglomerates, one can achieve better control of the particle trajectories and jet divergence. Thus, coatings can be obtained with higher definition and improved reliability.

  14. Voronoi analysis of the short–range atomic structure in iron and iron–carbon melts

    SciTech Connect

    Sobolev, Andrey; Mirzoev, Alexander

    2015-08-17

    In this work, we simulated the atomic structure of liquid iron and iron–carbon alloys by means of ab initio molecular dynamics. Voronoi analysis was used to highlight changes in the close environments of Fe atoms as carbon concentration in the melt increases. We have found, that even high concentrations of carbon do not affect short–range atomic order of iron atoms — it remains effectively the same as in pure iron melts.

  15. Synthesis of vertical MnO2 wire arrays on hemp-derived carbon for efficient and robust green catalysts

    NASA Astrophysics Data System (ADS)

    Yang, MinHo; Kim, Dong Seok; Sim, Jae-Wook; Jeong, Jae-Min; Kim, Do Hyun; Choi, Jae Hyung; Kim, Jinsoo; Kim, Seung-Soo; Choi, Bong Gill

    2017-06-01

    Three-dimensional (3D) carbon materials derived from waste biomass have been attracted increasing attention in catalysis and materials science because of their great potential of catalyst supports with respect to multi-functionality, unique structures, high surface area, and low cost. Here, we present a facile and efficient way for preparing 3D heterogeneous catalysts based on vertical MnO2 wires deposited on hemp-derived 3D porous carbon. The 3D porous carbon materials are fabricated by carbonization and activation processes using hemp (Cannabis Sttiva L.). These 3D porous carbon materials are employed as catalyst supports for direct deposition of vertical MnO2 wires using a one-step hydrothermal method. The XRD and XPS results reveal the crystalline structure of α-MnO2 wires. The resultant composites are further employed as a catalyst for glycolysis of poly(ethylene terephthalate) (PET) with high conversion yield of 98%, which is expected to be expressly profitable for plastics recycling industry.

  16. Study on Exploding Wire Compression for Evaluating Electrical Conductivity in Warm-Dense Diamond-Like-Carbon

    NASA Astrophysics Data System (ADS)

    Sasaki, Toru; Takahashi, Kazumasa; Kudo, Takahiro; Kikuchi, Takashi; Aso, Tsukasa; Harada, Nob.; Fujioka, Shinsuke; Horioka, Kazuhiko

    2016-03-01

    To improve a coupling efficiency for the fast ignition scheme of the inertial confinement fusion, fast electron behaviors as a function of an electrical conductivity are required. To evaluate the electrical conductivity for low-Z materials as a diamond-like-carbon (DLC), we have proposed a concept to investigate the properties of warm dense matter (WDM) by using pulsed-power discharges. The concept of the evaluation of DLC for WDM is a shock compression driven by an exploding wire discharge with confined by a rigid capillary. The qualitatively evaluation of the electrical conductivity for the WDM DLC requires a small electrical conductivity of the exploding wire. To analyze the electrical conductivity of exploding wire, we have demonstrated an exploding wire discharge in water for gold. The results indicated that the electrical conductivity of WDM gold for 5000 K of temperature has an insulator regime. It means that the shock compression driven by the exploding wire discharge with confined by the rigid capillary is applied for the evaluation of electrical conductivity for WDM DLC.

  17. Atomic-focuser imaging in electron nanodiffraction from carbon nanoshells

    PubMed

    Cowley

    2000-03-01

    When nanodiffraction patterns are obtained by transmission through the top and bottom walls of near-spherical, hollow carbon nano-shells, using the focused probe of a STEM instrument, a graphitic crystal in one wall may act as an atomic focuser to produce high-resolution images of small regions of the other wall within the central beam and the diffraction disks of the nanodiffraction pattern. A theoretical analysis of the imaging process is given. Images showing one- and two-dimensional periodicities, with fringe spacings as small as 0.124 nm, and also images showing non-periodic features have been obtained from carbon nanoshells having diameters of the order of 100 nm.

  18. An important atomic process in the CVD growth of graphene: Sinking and up-floating of carbon atom on copper surface

    NASA Astrophysics Data System (ADS)

    Li, Yingfeng; Li, Meicheng; Gu, TianSheng; Bai, Fan; Yu, Yue; Trevor, Mwenya; Yu, Yangxin

    2013-11-01

    By density functional theory (DFT) calculations, the early stages of the growth of graphene on copper (1 1 1) surface are investigated. At the very first time of graphene growth, the carbon atom sinks into subsurface. As more carbon atoms are adsorbed nearby the site, the sunken carbon atom will spontaneously form a dimer with one of the newly adsorbed carbon atoms, and the formed dimer will up-float on the top of the surface. We emphasize the role of the co-operative relaxation of the co-adsorbed carbon atoms in facilitating the sinking and up-floating of carbon atoms. In detail: when two carbon atoms are co-adsorbed, their co-operative relaxation will result in different carbon-copper interactions for the co-adsorbed carbon atoms. This difference facilitates the sinking of a single carbon atom into the subsurface. As a third carbon atom is co-adsorbed nearby, it draws the sunken carbon atom on top of the surface, forming a dimer. Co-operative relaxations of the surface involving all adsorbed carbon atoms and their copper neighbors facilitate these sinking and up-floating processes. This investigation is helpful for the deeper understanding of graphene synthesis and the choosing of optimal carbon sources or process.

  19. Carbon atom-initiated degradation of carbon tetrachloride in the presence of molecular oxygen: A product and mechanistic study

    SciTech Connect

    Nicoll, G.; Francisco, J.S.

    1998-10-15

    This paper reports an investigation of the gas-phase reaction of atomic carbon with carbon tetrachloride in the presence of molecular oxygen. It is demonstrated that carbon tetrachloride can be oxidatively degraded by this method. Results from FT-IR and GC/MS studies suggest that the major products from the reaction are phosgene and carbon dioxide. The initial step involves breaking the carbon-chlorine bond as a result of the reaction of atomic carbon with carbon tetrachloride. Laser-induced fluorescence studies have shown the presence of CCl as an intermediate produced from this reaction. A tentative mechanism is proposed to describe the details of the chemistry.

  20. Carbon atom adsorption on and diffusion into Fe(110) and Fe(100) from first principles

    NASA Astrophysics Data System (ADS)

    Jiang, D. E.; Carter, Emily A.

    2005-01-01

    We employ spin-polarized periodic density functional theory (DFT) to examine carbon atom adsorption on, absorption in, and diffusion into Fe(110) and Fe(100). We find that carbon atoms bind strongly with Fe surfaces and prefer high coordination sites. The carbon atom is predicted to adsorb on the long-bridge site on Fe(110) and the fourfold hollow site on Fe(100). Due to the very short distance between the carbon atom and the subsurface Fe atom of Fe(100), the carbon atom binds more strongly with Fe(100) than with Fe(110). In the subsurface region, the carbon atom prefers the octahedral site, as in bulk Fe. We find that the carbon atom is more stable in the subsurface octahedral site of Fe(110) than that of Fe(100), since the strain caused by the interstitial carbon atom is released by pushing one surface Fe atom towards vacuum by 0.5 Å in Fe(110), while the distortion in Fe(100) propagates far into the lattice. Diffusion of carbon atoms into Fe(110) and Fe(100) subsurfaces goes through transition states where the carbon atom is coordinated to four Fe atoms. The barriers to diffusion into Fe(110) and Fe(100) are 1.18 eV and 1.47 eV, respectively. The larger diffusion barrier into Fe(100) is mainly due to the stronger bonding between carbon and the Fe(100) surface. We predict that the rate-limiting step for C incorporation into bulk Fe is the initial diffusion to subsurface sites, while the rate-limiting step for absorbed carbon segregation to the surface is bulk diffusion, with no expected difference between rates to segregate to different surfaces. Lastly, we predict that graphite formation will be more favorable on C -covered Fe(110) than C -covered Fe(100).

  1. Effect of microalloying on pearlite transformation of high carbon wire steels

    NASA Astrophysics Data System (ADS)

    Miller, Stephanie L.

    Microalloying has been shown to improve strength in eutectoid steels for wire applications, and previous work on vanadium-microalloyed eutectoid steels showed delayed pearlite transformation with additions of niobium and accelerated pearlite transformation with additional nitrogen. This study investigates the origin of the CCT shifts with microalloying additions and whether trends in hardness and microstructural feature sizes observed in continuous cooling tests persist through industrial hot rolling simulations. An industrially hot rolled 1080 wire rod with vanadium additions and three laboratory-prepared alloys were studied. The base alloy, denoted the V steel, had a composition of 0.80C-0.50Mn-0.24Si-0.20Cr-0.079V-0.0059N (wt pct). The V+N steel contained 0.0088 wt pct N, and the V+Nb steel contained an additional 0.010 wt pct Nb. All alloys were subjected to a GleebleRTM 3500 torsion hot rolling simulation based on industrial wire rod hot rolling parameters. Microstructural constituents, Vickers hardness, pearlite colony size, and pearlite interlamellar spacing (ILS) were characterized for each alloy. All alloys exhibited pearlitic microstructures with some proeutectoid ferrite at prior austenite grain boundaries, with no evidence of shear transformation products. The V steel has the lowest overall hardness, while both nitrogen and niobium additions increase hardness by approximately 15 HV, correlating to a 43 MPa increase in yield strength. Niobium additions refined ILS, with an average ILS of 92 +/- 3 nm for the V+Nb steel compared to 113 +/- 5 nm for the V steel and 113 +/- 3 nm for the V+N alloy. Vanadium additions produced precipitation strengthening for all alloys and heat treatments, and additional precipitation strengthening with nitrogen and niobium additions was not apparent based on a Taleff regression analysis. Atom probe tomography of an industrially processed wire rod with vanadium additions revealed vanadium enrichment of cementite, and vanadium

  2. A first-principle study of one-dimensional carbon atomic chain inserted single-wall carbon nanotubes.

    PubMed

    Mao, Yuliang; Zhong, JianXin; Yuan, JianMei; Zhao, Xinluo; Ando, Yoshinori

    2006-05-01

    Using first principles calculations, we investigate the atomic and electronic structure of carbon nanowires (CNWs) as the carbon chain inserted into single wall carbon nanotubes (SWCNTs). It indicates that the (5,5) CNW system exhibits metallic character, however, the insertion of carbon chain can transit a semi-conducting (9,0) SWCNT into a metallic.

  3. Highly flexible, mechanically robust superconducting wire consisting of NbN-carbon-nanotube nanofibril composites

    NASA Astrophysics Data System (ADS)

    Kim, Jeong-Gyun; Kang, Haeyong; Kim, Joonggyu; Lee, Young Hee; Suh, Dongseok

    A flexible superconducting fiber is prepared by twisting carbon nanotube (CNT) sheets coated with sputter-deposited niobium nitride (NbN) layer to form the shape of yarn. Twisted CNT yarn, which has been extensively studied due to its high flexibility as well as excellent mechanical properties, and NbN, which is a superconducting material with high transition temperature (Tc) and critical magnetic field (Hc), are combined together by the deposition of NbN layer on free-standing CNT-sheet substrate followed by the biscrolling process. We tried many experimental conditions to investigate the superconducting properties of NbN-CNT yarn as a function of NbN thickness and number of CNT-sheet layers, and found out that the superconducting property of NbN on CNT-sheet can be comparable to that of NbN thin film on the normal solid substrate. In addition, the superconducting property survived even under the condition of severe mechanical deformation such as knotting. These results show the potential application of this technology as a large-scale fabrication method of flexible, mechanically robust, high performance superconducting wire. This work is supported by the Institute for Basic Science (IBS-R011-D1), and by the National Research Foundation (BSR-2013R1A1A1076063) funded by the Ministry of Science, ICT & Future Planning, Republic of Korea.

  4. Atomic layer confined vacancies for atomic-level insights into carbon dioxide electroreduction

    PubMed Central

    Gao, Shan; Sun, Zhongti; Liu, Wei; Jiao, Xingchen; Zu, Xiaolong; Hu, Qitao; Sun, Yongfu; Yao, Tao; Zhang, Wenhua; Wei, Shiqiang; Xie, Yi

    2017-01-01

    The role of oxygen vacancies in carbon dioxide electroreduction remains somewhat unclear. Here we construct a model of oxygen vacancies confined in atomic layer, taking the synthetic oxygen-deficient cobalt oxide single-unit-cell layers as an example. Density functional theory calculations demonstrate the main defect is the oxygen(II) vacancy, while X-ray absorption fine structure spectroscopy reveals their distinct oxygen vacancy concentrations. Proton transfer is theoretically/experimentally demonstrated to be a rate-limiting step, while energy calculations unveil that the presence of oxygen(II) vacancies lower the rate-limiting activation barrier from 0.51 to 0.40 eV via stabilizing the formate anion radical intermediate, confirmed by the lowered onset potential from 0.81 to 0.78 V and decreased Tafel slope from 48 to 37 mV dec−1. Hence, vacancy-rich cobalt oxide single-unit-cell layers exhibit current densities of 2.7 mA cm−2 with ca. 85% formate selectivity during 40-h tests. This work establishes a clear atomic-level correlation between oxygen vacancies and carbon dioxide electroreduction. PMID:28220847

  5. Atomic layer confined vacancies for atomic-level insights into carbon dioxide electroreduction

    NASA Astrophysics Data System (ADS)

    Gao, Shan; Sun, Zhongti; Liu, Wei; Jiao, Xingchen; Zu, Xiaolong; Hu, Qitao; Sun, Yongfu; Yao, Tao; Zhang, Wenhua; Wei, Shiqiang; Xie, Yi

    2017-02-01

    The role of oxygen vacancies in carbon dioxide electroreduction remains somewhat unclear. Here we construct a model of oxygen vacancies confined in atomic layer, taking the synthetic oxygen-deficient cobalt oxide single-unit-cell layers as an example. Density functional theory calculations demonstrate the main defect is the oxygen(II) vacancy, while X-ray absorption fine structure spectroscopy reveals their distinct oxygen vacancy concentrations. Proton transfer is theoretically/experimentally demonstrated to be a rate-limiting step, while energy calculations unveil that the presence of oxygen(II) vacancies lower the rate-limiting activation barrier from 0.51 to 0.40 eV via stabilizing the formate anion radical intermediate, confirmed by the lowered onset potential from 0.81 to 0.78 V and decreased Tafel slope from 48 to 37 mV dec-1. Hence, vacancy-rich cobalt oxide single-unit-cell layers exhibit current densities of 2.7 mA cm-2 with ca. 85% formate selectivity during 40-h tests. This work establishes a clear atomic-level correlation between oxygen vacancies and carbon dioxide electroreduction.

  6. Carbon Nanotube Devices Engineered by Atomic Force Microscopy

    NASA Astrophysics Data System (ADS)

    Prisbrey, Landon

    This dissertation explores the engineering of carbon nanotube electronic devices using atomic force microscopy (AFM) based techniques. A possible application for such devices is an electronic interface with individual biological molecules. This single molecule biosensing application is explored both experimentally and with computational modeling. Scanning probe microscopy techniques, such as AFM, are ideal to study nanoscale electronics. These techniques employ a probe which is raster scanned above a sample while measuring probe-surface interactions as a function of position. In addition to topographical and electrostatic/magnetic surface characterization, the probe may also be used as a tool to manipulate and engineer at the nanoscale. Nanoelectronic devices built from carbon nanotubes exhibit many exciting properties including one-dimensional electron transport. A natural consequence of onedimensional transport is that a single perturbation along the conduction channel can have extremely large effects on the device's transport characteristics. This property may be exploited to produce electronic sensors with single-molecule resolution. Here we use AFM-based engineering to fabricate atomic-sized transistors from carbon nanotube network devices. This is done through the incorporation of point defects into the carbon nanotube sidewall using voltage pulses from an AFM probe. We find that the incorporation of an oxidative defect leads to a variety of possible electrical signatures including sudden switching events, resonant scattering, and breaking of the symmetry between electron and hole transport. We discuss the relationship between these different electronic signatures and the chemical structure/charge state of the defect. Tunneling through a defect-induced Coulomb barrier is modeled with numerical Verlet integration of Schrodinger's equation and compared with experimental results. Atomic-sized transistors are ideal for single-molecule applications due to their

  7. Atomic nanotube welders: boron interstitials triggering connections in double-walled carbon nanotubes.

    PubMed

    Endo, Morinobu; Muramatsu, Hiroyuki; Hayashi, Takuya; Kim, Yoong-Ahm; Van Lier, Gregory; Charlier, Jean-Christophe; Terrones, Humberto; Terrones, Mauricio; Dresselhaus, Mildred S

    2005-06-01

    Here we demonstrate that the incorporation of boron (B) atoms between double-walled carbon nanotubes (DWNTs) during thermal annealing (1400-1600 degrees C) results in covalent nanotube "Y" junctions, DWNT coalescence, and the formation of flattened multiwalled carbon nanotubes (MWNTs). These processes occur via the merging of adjacent tubes, which is triggered by B interstitial atoms. We observe that B atom interstitials between DWNTs are responsible for the rapid establishment of covalent connections between neighboring tubes (polymerization), thereby resulting in the fast annealing of the carbon cylinders with B atoms embedded in the newly created carbon nanotube network. Once B is in the lattice, tube faceting (polygonization) starts to occur, and the electronic properties are expected to change dramatically. Therefore, B atoms indeed act as atomic nanotube fusers (or welders), and this process could now be used in assembling novel electronic nanotube devices, nanotube networks, carbon nanofoams and heterojunctions exhibiting p-type electronic properties.

  8. Atomic-Scale Investigations of Multiwall Carbon Nanotube Growth

    NASA Astrophysics Data System (ADS)

    Behr, Michael John

    The combination of unique mechanical, thermal, optical, and electronic properties of carbon nanotubes (CNTs) make them a desirable material for use in a wide range of applications. Many of these unique properties are highly sensitive to how carbon atoms are arranged within the graphene nanotube wall. Precise structural control of this arrangement remains the key challenge of CNT growth to realizing their technological potential. Plasma-enhanced chemical vapor deposition (PECVD) from methane-hydrogen gas mixtures using catalytic nanoparticles enables large-scale growth of CNT films and controlled spatial placement of CNTs on a substrate, however, much is still unknown about what happens to the catalyst particle during growth, the atomistic mechanisms involved, and how these dictate the final nanotube structure. To investigate the fundamental processes of CNT growth by PECVD, a suite of characterization techniques were implemented, including attenuated total-reflection Fourier transform infrared spectroscopy (ATR-FTIR), optical emission spectroscopy (OES), Raman spectroscopy, convergent-beam electron diffraction (CBED), high-resolution transmission and scanning-transmission electron microscopy (TEM, STEM), energy dispersive x-ray spectroscopy, and electron energy-loss spectroscopy (EELS). It is found that hydrogen plays a critical role in determining the final CNT structure through controlling catalyst crystal phase and morphology. At low hydrogen concentrations in the plasma iron catalysts are converted to Fe3C, from which high-quality CNTs grow; however, catalyst particles remain as pure iron when hydrogen is in abundance, and produce highly defective CNTs with large diameters. The initially faceted and equiaxed catalyst nanocrystals become deformed and are elongated into a teardrop morphology once a tubular CNT structure is formed around the catalyst particles. Although catalyst particles are single crystalline, they exhibit combinations of small-angle (˜1°-3

  9. The Relativistic Effects on the Carbon-Carbon Coupling Constants Mediated by a Heavy Atom.

    PubMed

    Wodyński, Artur; Malkina, Olga L; Pecul, Magdalena

    2016-07-21

    The (2)JCC, (3)JCC, and (4)JCC spin-spin coupling constants in the systems with a heavy atom (Cd, In, Sn, Sb, Te, Hg, Tl, Pb, Bi, and Po) in the coupling path have been calculated by means of density functional theory. The main goal was to estimate the relativistic effects on spin-spin coupling constants and to explore the factors which may influence them, including the nature of the heavy atom and carbon hybridization. The methods applied range, in order of reduced complexity, from the Dirac-Kohn-Sham (DKS) method (density functional theory with four-component Dirac-Coulomb Hamiltonian), through DFT with two- and one-component zeroth-order regular approximation (ZORA) Hamiltonians, to scalar effective core potentials (ECPs) with the nonrelativistic Hamiltonian. The use of DKS and ZORA methods leads to very similar results, and small-core ECPs of the MDF and MWB variety reproduce correctly the scalar relativistic effects. Scalar relativistic effects usually are larger than the spin-orbit coupling effects. The latter tend to influence the most the coupling constants of the sp(3)-hybridized carbon atoms and in compounds of the p-block heavy atoms. Large spin-orbit coupling contributions for the Po compounds are probably connected with the inverse of the lowest triplet excitation energy.

  10. Rotational Spectrum and Carbon Atom Structure of Dihydroartemisinic Acid

    NASA Astrophysics Data System (ADS)

    Evangelisti, Luca; Seifert, Nathan A.; Spada, Lorenzo; Pate, Brooks

    2016-06-01

    Dihydroartemisinic acid (DHAA, C15H24O2, five chiral centers) is a precursor in proposed low-cost synthetic routes to the antimalarial drug artemisinin. In one reaction process being considered in pharmaceutical production, DHAA is formed from an enantiopure sample of artemisinic acid through hydrogenation of the alkene. This reaction needs to properly set the stereochemistry of the asymmetric carbon for the synthesis to produce artemisinin. A recrystallization process can purify the diastereomer mixture of the hydrogenation reaction if the unwanted epimer is produced in less than 10% abundance. There is a need in the process analytical chemistry to rapidly (less than 1 min) measure the diastereomer excess and current solutions, such a HPLC, lack the needed measurement speed. The rotational spectrum of DHAA has been measured at 300:1 signal-to-noise ratio in a chirped-pulsed Fourier transform microwave spectrometer operating from 2-8 GHz using simple heating of the compound. The 13C isotope analysis provides a carbon atom structure that confirms the diastereomer. This structure is in excellent agreement with quantum chemistry calculations at the B2PLYPD3/ 6-311++G** level of theory. The DHAA spectrum is expected to be fully resolved from the unwanted diastereomer raising the potential for fast diastereomer excess measurement by rotational spectroscopy in the pharmaceutical production process.

  11. In situ nucleation of carbon nanotubes by the injection of carbon atoms into metal particles

    NASA Astrophysics Data System (ADS)

    Rodríguez-Manzo, Julio A.; Terrones, Mauricio; Terrones, Humberto; Kroto, Harold W.; Sun, Litao; Banhart, Florian

    2007-05-01

    The synthesis of carbon nanotubes (CNTs) of desired chiralities and diameters is one of the most important challenges in nanotube science and achieving such selectivity may require a detailed understanding of their growth mechanism. We report the formation of CNTs in an entirely condensed phase process that allows us, for the first time, to monitor the nucleation of a nanotube on the spherical surface of a metal particle. When multiwalled CNTs containing metal particle cores are irradiated with an electron beam, carbon from graphitic shells surrounding the metal particles is ingested into the body of the particle and subsequently emerges as single-walled nanotubes (SWNTs) or multiwalled nanotubes (MWNTs) inside the host nanotubes. These observations, at atomic resolution in an electron microscope, show that there is direct bonding between the tubes and the metal surface from which the tubes sprout and can be readily explained by bulk diffusion of carbon through the body of catalytic particles, with no evidence of surface diffusion.

  12. Trapping of metal atoms in vacancies of carbon nanotubes and graphene.

    PubMed

    Rodríguez-Manzo, Julio A; Cretu, Ovidiu; Banhart, Florian

    2010-06-22

    Lattice defects in carbon nanotubes and graphene are created by focusing an electron beam in a scanning transmission electron microscope onto a 0.1 nm spot on the objects. Metal atoms migrating on the graphenic surfaces are observed to be trapped by these defects. Depending on the size of the defect, single metal atoms or clusters of several atoms can be localized in or on nanotubes or graphene layers. Subsequent escape of the metal atoms from the trapping centers gives information about the bonding between the metal atom and the defect. The process of trapping and detrapping is studied in a temperature range of 20-670 degrees C. The technique allows one to place metal atoms with almost atomic precision in graphenic structures and to create a predefined pattern of foreign atoms in graphene or carbon nanotubes.

  13. Sintered wire annode

    DOEpatents

    Falce, Louis R.; Ives, R. Lawrence

    2007-12-25

    A plurality of high atomic number wires are sintered together to form a porous rod that is parted into porous disks which will be used as x-ray targets. A thermally conductive material is introduced into the pores of the rod, and when a stream of electrons impinges on the sintered wire target and generates x-rays, the heat generated by the impinging x-rays is removed by the thermally conductive material interspersed in the pores of the wires.

  14. Site specific atomic polarizabilities in endohedral fullerenes and carbon onions.

    PubMed

    Zope, Rajendra R; Bhusal, Shusil; Basurto, Luis; Baruah, Tunna; Jackson, Koblar

    2015-08-28

    We investigate the polarizability of trimetallic nitride endohedral fullerenes by partitioning the total polarizability into site specific components. This analysis indicates that the polarizability of the endohedral fullerene is essentially due to the outer fullerene cage and has insignificant contribution from the encapsulated unit. Thus, the outer fullerene cages effectively shield the encapsulated clusters and behave like Faraday cages. The polarizability of endohedral fullerenes is slightly smaller than the polarizability of the corresponding bare carbon fullerenes. The application of the site specific polarizabilities to C60@C240 and C60@C180 onions shows that, compared to the polarizability of isolated C60 fullerene, the encapsulation of the C60 in C240 and C180 fullerenes reduces its polarizability by 75% and 83%, respectively. The differences in the polarizability of C60 in the two onions is a result of differences in the bonding (intershell electron transfer), fullerene shell relaxations, and intershell separations. The site specific analysis further shows that the outer atoms in a fullerene shell contribute most to the fullerene polarizability.

  15. Site specific atomic polarizabilities in endohedral fullerenes and carbon onions

    NASA Astrophysics Data System (ADS)

    Zope, Rajendra R.; Bhusal, Shusil; Basurto, Luis; Baruah, Tunna; Jackson, Koblar

    2015-08-01

    We investigate the polarizability of trimetallic nitride endohedral fullerenes by partitioning the total polarizability into site specific components. This analysis indicates that the polarizability of the endohedral fullerene is essentially due to the outer fullerene cage and has insignificant contribution from the encapsulated unit. Thus, the outer fullerene cages effectively shield the encapsulated clusters and behave like Faraday cages. The polarizability of endohedral fullerenes is slightly smaller than the polarizability of the corresponding bare carbon fullerenes. The application of the site specific polarizabilities to C60@C240 and C60@C180 onions shows that, compared to the polarizability of isolated C60 fullerene, the encapsulation of the C60 in C240 and C180 fullerenes reduces its polarizability by 75% and 83%, respectively. The differences in the polarizability of C60 in the two onions is a result of differences in the bonding (intershell electron transfer), fullerene shell relaxations, and intershell separations. The site specific analysis further shows that the outer atoms in a fullerene shell contribute most to the fullerene polarizability.

  16. Site specific atomic polarizabilities in endohedral fullerenes and carbon onions

    SciTech Connect

    Zope, Rajendra R. Baruah, Tunna; Bhusal, Shusil; Basurto, Luis; Jackson, Koblar

    2015-08-28

    We investigate the polarizability of trimetallic nitride endohedral fullerenes by partitioning the total polarizability into site specific components. This analysis indicates that the polarizability of the endohedral fullerene is essentially due to the outer fullerene cage and has insignificant contribution from the encapsulated unit. Thus, the outer fullerene cages effectively shield the encapsulated clusters and behave like Faraday cages. The polarizability of endohedral fullerenes is slightly smaller than the polarizability of the corresponding bare carbon fullerenes. The application of the site specific polarizabilities to C{sub 60}@C{sub 240} and C{sub 60}@C{sub 180} onions shows that, compared to the polarizability of isolated C{sub 60} fullerene, the encapsulation of the C{sub 60} in C{sub 240} and C{sub 180} fullerenes reduces its polarizability by 75% and 83%, respectively. The differences in the polarizability of C{sub 60} in the two onions is a result of differences in the bonding (intershell electron transfer), fullerene shell relaxations, and intershell separations. The site specific analysis further shows that the outer atoms in a fullerene shell contribute most to the fullerene polarizability.

  17. Reactions of Atomic Carbon with Butene Isomers: Implications for Molecular Growth in Carbon-Rich Environments

    DOE PAGES

    Bourgalais, J.; Spencer, Michael; Osborn, David L.; ...

    2016-10-31

    We carried out the product detection studies of C(3P) atom reactions with butene (C4H8) isomers (but-1-ene, cis-but-2-ene, trans-but-2-ene) in a flow tube reactor at 353 K and 4 Torr under multiple collision conditions. Ground state carbon atoms are generated by 248 nm laser photolysis of tetrabromomethane, CBr4, in a buffer of helium. Thermalized reaction products are detected using synchrotron tunable VUV photoionization and time-of-flight mass spectrometry. The temporal profiles of the detected ions are used to discriminate products from side or secondary reactions. Furthermore, for the C(3P) + trans-but-2-ene and C(3P) + cis-but-2-ene reactions, various isomers of C4H5 and C5H7more » are identified as reaction products formed via CH3 and H elimination. Assuming equal ionization cross sections for all C4H5 and C5H7 isomers, C4H5:C5H7 branching ratios of 0.63:1 and 0.60:1 are derived for the C(3P) + trans-but-2-ene and the C(3P) + cis-but-2-ene reactions, respectively. For the C(3P) + but-1-ene reaction, two reaction channels are observed: the H-elimination channel, leading to the formation of the ethylpropargyl isomer, and the C3H3 + C2H5 channel. Assuming equal ionization cross sections for ethylpropargyl and C3H3 radicals, a branching ratio of 1:0.95 for the C3H3 + C2H5 and H + ethylpropargyl channels is derived. Finally, the experimental results are compared to previous H atom branching ratios and used to propose the most likely mechanisms for the reaction of ground state carbon atoms with butene isomers.« less

  18. Reactions of Atomic Carbon with Butene Isomers: Implications for Molecular Growth in Carbon-Rich Environments

    NASA Astrophysics Data System (ADS)

    Bourgalais, J.; Spencer, Michael; Osborn, David L.; Goulay, F.; Le Picard, S. D.

    2016-10-01

    Product detection studies of C(3P) atom reactions with butene (C4H8) isomers (but-1-ene, cis-but-2-ene, trans-but-2-ene) are carried out in a flow tube reactor at 353 K and 4 Torr under multiple collision conditions. Ground state carbon atoms are generated by 248 nm laser photolysis of tetrabromomethane, CBr4, in a buffer of helium. Thermalized reaction products are detected using synchrotron tunable VUV photoionization and time-of-flight mass spectrometry. The temporal profiles of the detected ions are used to discriminate products from side or secondary reactions. For the C(3P) + trans-but-2-ene and C(3P) + cis-but-2-ene reactions, various isomers of C4H5 and C5H7 are identified as reaction products formed via CH3 and H elimination. Assuming equal ionization cross sections for all C4H5 and C5H7 isomers, C4H5:C5H7 branching ratios of 0.63:1 and 0.60:1 are derived for the C(3P) + trans-but-2-ene and the C(3P) + cis-but-2-ene reactions, respectively. For the C(3P) + but-1ene reaction, two reaction channels are observed: the H-elimination channel, leading to the formation of the ethylpropargyl isomer, and the C3H3 + C2H5 channel. Assuming equal ionization cross sections for ethylpropargyl and C3H3 radicals, a branching ratio of 1:0.95 for the C3H3 + C2H5 and H + ethylpropargyl channels is derived. The experimental results are compared to previous H atom branching ratios and used to propose the most likely mechanisms for the reaction of ground state carbon atoms with butene isomers.

  19. Exchange of carbon-bound hydrogen atoms ortho to the hydroxyl group in tyrosine.

    PubMed

    Martin, R B; Morlino, V J

    1965-10-22

    The carbon-bound hydrogen atoms of tyrosine that exchange with solvent protons in strongly acid solutions at about 100 degrees C are not the methylene hydrogen atoms but a pair on the aromatic ring. Of the two pairs of protons on the aromatic ring, observed in the proton magnetic resonance spectra, the pair at higher field undergoes exchange in 2.4N DCI at 100 degrees C. Other hydrogen atoms, attached either to aliphatic or aromatic carbon atoms, exhibit no noticeable exchange under the same conditions. From a chemicalshift analysis the exchanging protons are assigned as those ortho to the hydroxyl group on the aromatic ring.

  20. Electroanalysis using macro-, micro-, and nanochemical architectures on electrode surfaces. Bulk surface modification of glassy carbon microspheres with gold nanoparticles and their electrical wiring using carbon nanotubes.

    PubMed

    Dai, Xuan; Wildgoose, Gregory G; Salter, Chris; Crossley, Alison; Compton, Richard G

    2006-09-01

    Gold nanoparticles (approximately 30-60 nm in diameter) were deposited onto the surface of glassy carbon microspheres (10-20 microm) through electroless plating to produce bulk (i.e., gram) quantities of nanoparticle surface-modified microspheres. The gold nanoparticle-modified powder was then characterized by means of scanning electron microscopy and cyclic voltammetry. The voltammetric response of a macroelectrode consisting of a film of gold nanoparticle-modified glassy carbon microspheres, bound together and "wired-up" using multiwalled carbon nanotubes (MWCNTs), was investigated. We demonstrate that by intelligently exploiting both nano- and microchemical architectures and wiring up the electroactive centers using MWCNTs in this way, we can obtain macroelectrode voltammetric behavior while only using approximately 1% by mass of the expensive gold material that would be required to construct the equivalent gold film macrodisk electrode. The potential utility of electrodes constructed using chemical architectures such as this was demonstrated by applying them to the analytical determination of arsenic(III) concentration. An optimized limit of detection of 2.5 ppb was obtained.

  1. Carbon Nanotube Atomic Force Microscopy for Proteomics and Biological Forensics

    SciTech Connect

    Noy, A; De Yoreo, J J; Malkin, A J

    2002-01-01

    The Human Genome Project was focused on mapping the complete genome. Yet, understanding the structure and function of the proteins expressed by the genome is the real end game. But there are approximately 100,000 proteins in the human body and the atomic structure has been determined for less than 1% of them. Given the current rate at which structures are being solved, it will take more than one hundred years to complete this task. The rate-limiting step in protein structure determination is the growth of high-quality single crystals for X-ray diffraction. Synthesis of the protein stock solution as well as X-ray diffraction and analysis can now often be done in a matter of weeks, but developing a recipe for crystallization can take years and, especially in the case of membrane proteins, is often completely unsuccessful. Consequently, techniques that can either help to elucidate the factors controlling macromolecular crystallization, increase the amount of structural information obtained from crystallized macromolecules or eliminate the need for crystallization altogether are of enormous importance. In addition, potential applications for those techniques extend well beyond the challenges of proteomics. The global spread of modern technology has brought with it an increasing threat from biological agents such as viruses. As a result, developing techniques for identifying and understanding the operation of such agents is becoming a major area of forensic research for DOE. Previous to this project, we have shown that we can use in situ atomic force microscopy (AFM) to image the surfaces of growing macromolecular crystals with molecular resolution (1-5) In addition to providing unprecedented information about macromolecular nucleation, growth and defect structure, these results allowed us to obtain low-resolution phase information for a number of macromolecules, providing structural information that was not obtainable from X-ray diffraction(3). For some virus systems

  2. Carbon fiber CVD coating by carbon nanostructured for space materials protection against atomic oxygen

    NASA Astrophysics Data System (ADS)

    Pastore, Roberto; Bueno Morles, Ramon; Micheli, Davide

    2016-07-01

    , by the purpose to integrate the carbon nanostructures in the carbon fibers by means of chemical vapor deposition (CVD) method, in order to develop the basic substrate of advanced carbon-based nanocomposite for atomic oxygen protection. The nanostructures grown onto the carbon fibers can be used to create multiscale hybrid carbon nanotube/carbon fiber composites where individual carbon fibers, which are several microns in diameter, are surrounded by nanotubes. The present objective is the setting-up of the CVD parameters for a reliable growth of carbon nanostructures on carbon fiber surface; after that, the results of a preliminary characterization related to atomic oxygen effects testing by means of a ground LEO simulation facility are reported and discussed.

  3. Effect of processing routes in a multi-pass continuous hybrid process on mechanical properties, microstructure, and texture evolutions of low-carbon steel wires

    NASA Astrophysics Data System (ADS)

    Hwang, Sun Kwang; Baek, Hyun Moo; Joo, Ho Seon; Im, Yong-Taek

    2015-03-01

    In this work, a multi-pass continuous hybrid (CH) process was experimentally applied with up to five passes with three processing routes, A, Bc, and C, to check the practicality of the processing routes and investigate their effect on the mechanical properties, microstructure, and texture evolutions of low-carbon steel wires. According to the present investigation, the wires processed by the 5th pass CH process with route A showed the highest ultimate tensile strength value (762 MPa) compared to those for routes Bc (718 MPa) and C (720 MPa), respectively. Based on the compression test results, the CH processed wire showed good workability when the aspect ratio was smaller than 2.4 for all the processing routes. According to the microstructure and texture evolutions, the grain sizes of the 5th pass CH processed wires decreased for all the processing routes than that of the initial specimen, and the wires showed mixed texture distribution of shear and drawing texture components. From the present investigation, it was concluded that the processing routes of the CH process could strongly affect the microstructure and texture evolutions, resulting in changes of the mechanical properties and workability of the low-carbon steel wires.

  4. Detection and quantized conductance of neutral atoms near a charged carbon nanotube.

    PubMed

    Ristroph, Trygve; Goodsell, Anne; Golovchenko, J A; Hau, Lene Vestergaard

    2005-02-18

    We describe a novel single atom detector that uses the high electric field surrounding a charged single-walled carbon nanotube to attract and subsequently field-ionize neutral atoms. A theoretical study of the field-ionization tunneling rates for atomic trajectories in the attractive potential near a nanowire shows that a broadly applicable, high spatial resolution, low-power, neutral-atom detector with nearly 100% efficiency is realizable with present-day technology. Calculations also show that the system can provide the first opportunity to study quantized conductance phenomena when detecting cold neutral atoms with mean velocities less than 15 m/s.

  5. Ab initio study of semiconductor atoms impurities in zigzag edge (10,0) carbon nanotubes

    SciTech Connect

    Muttaqien, Fahdzi Suprijadi

    2015-04-16

    The substitutional impurities in zigzag edge (10,0) carbon nanotubes have been studied by using first principles calculations. Silicon (Si), gallium (Ga), and arsenic (As) atom have been chosen as semiconductor based-atom for replacing carbon atoms in CNT’s surface. The silicon atom changes the energy gap of pristine zigzag (10,0) CNT, it is 0.19 eV more narrow than that of pristine CNT. Geometrically, the silicon atom creates sp{sup 3} bond with three adjacent carbon atoms, where the tetrahedral form of its sp{sup 3} bond is consisted of free unoccupied state. The silicon atom does not induce magnetism to zigzag CNT. Due to gallium (Ga) and arsenic (As) atom substitution, the zigzag CNT becomes metallic and has magnetic moment of 1 µ{sub B}. The valance and conduction band are crossed each other, then the energy gap is vanished. The electronic properties of GaAs-doped CNT are dominantly affected by gallium atom and its magnetic properties are dominantly affected by arsenic atom. These results prove that the CNT with desired properties can be obtained with substitutional impurities without any giving structural defect.

  6. A simple and clean source of low-energy atomic carbon

    SciTech Connect

    Krasnokutski, S. A.; Huisken, F.

    2014-09-15

    A carbon source emitting low-energy carbon atoms from a thin-walled, sealed tantalum tube via thermal evaporation has been constructed. The tube is made from a 0.05 mm thick tantalum foil and filled with {sup 12}C or {sup 13}C carbon powder. After being sealed, it is heated by direct electric current. The solvated carbon atoms diffuse to the outer surface of the tube and, when the temperature rises over 2200 K, the evaporation of atomic carbon from the surface of the tantalum tube is observed. As the evaporated species have low energy they are well-suited for the incorporation into liquid helium droplets by the pick-up technique. Mass analysis of the incorporated species reveals the dominant presence of atomic carbon and very low abundances of C{sub 2} and C{sub 3} molecules (<1%). This is in striking contrast to the thermal evaporation of pure carbon, where C{sub 3} molecules are found to be the dominant species in the gas phase. Due to the thermal evaporation and the absence of high-energy application required for the dissociation of C{sub 2} and C{sub 3} molecules, the present source provides carbon atoms with rather low energy.

  7. Measurement of the thermal conductivity of carbon nanotube--tissue phantom composites with the hot wire probe method.

    PubMed

    Sarkar, Saugata; Zimmermann, Kristen; Leng, Weinan; Vikesland, Peter; Zhang, Jianfei; Dorn, Harry; Diller, Thomas; Rylander, Christopher; Rylander, Marissa Nichole

    2011-06-01

    Developing combinatorial treatments involving laser irradiation and nanoparticles require an understanding of the effect of nanoparticle inclusion on tissue thermal properties, such as thermal conductivity. This information will permit a more accurate prediction of temperature distribution and tumor response following therapy, as well as provide additional information to aid in the selection of the appropriate type and concentration of nanoparticles. This study measured the thermal conductivity of tissue representative phantoms containing varying types and concentrations of carbon nanotubes (CNTs). Multi-walled carbon nanotubes (MWNTs, length of 900-1200 nm and diameter of 40-60 nm), single-walled carbon nanotubes (SWNTs, length of 900-1200 nm and diameter <2 nm), and a novel embodiment of SWNTs referred to as single-walled carbon nanohorns (SWNHs, length of 25-50 nm and diameter of 3-5 nm) of varying concentrations (0.1, 0.5, and 1.0 mg/mL) were uniformly dispersed in sodium alginate tissue representative phantoms. The thermal conductivity of phantoms containing CNTs was measured using a hot wire probe method. Increasing CNT concentration from 0 to 1.0 mg/mL caused the thermal conductivity of phantoms containing SWNTs, SWNHs, and MWNTs to increase by 24, 30, and 66%, respectively. For identical CNT concentrations, phantoms containing MWNTs possessed the highest thermal conductivity.

  8. Strong enhancement of high-field critical current properties and irreversibility field of MgB2 superconducting wires by coronene active carbon source addition via the new B powder carbon-coating method

    NASA Astrophysics Data System (ADS)

    Ye, Shu Jun; Matsumoto, Akiyoshi; Chao Zhang, Yun; Kumakura, Hiroaki

    2014-08-01

    We report an effective carbon-containing additive, coronene (C24H12), for MgB2 superconducting wires. We used B powder coated with C24H12 to fabricate MgB2 wires using the powder-in-tube (PIT) and internal Mg diffusion (IMD) processes. The in-field critical current properties are strongly enhanced for both PIT- and IMD-processed MgB2 wires. For PIT MgB2 wires, a critical current density (Jc) value of 1.8 × 104 A cm-2 is obtained at 4.2 K and 10 T. For IMD MgB2 wires, we obtained a Jc of 1.07 × 105 A cm-2 and an engineering Jc (Je) of 1.12 × 104 A cm-2 at 4.2 K and 10 T. These Jc and Je values are similar to the highest values reported for MgB2 wires thus far. Furthermore, the irreversibility field, Birr, determined with a current density criterion of 100 A cm-2, is strongly enhanced to 25 T at 4.2 K, which is also the highest value reported for MgB2 superconducting wires thus far. Coronene is an active carbon source for MgB2 superconducting wires because (1) coronene has a high carbon content (96 wt%) with a small amount of hydrogen (impurity), (2) the decomposition temperature for coronene is near the reaction temperature between Mg and B, and (3) uniform dispersion of coronene on the B surface can be obtained due to the melting point of coronene being lower than the decomposition temperature. Carbon substitution for B caused by the coronene active carbon source is mainly responsible for the high field critical current properties and the high Birr obtained in this work.

  9. Dynamics of carbon-hydrogen and carbon-methyl exchanges in the collision of 3P atomic carbon with propene

    NASA Astrophysics Data System (ADS)

    Lee, Shih-Huang; Chen, Wei-Kan; Chin, Chih-Hao; Huang, Wen-Jian

    2013-11-01

    We investigated the dynamics of the reaction of 3P atomic carbon with propene (C3H6) at reactant collision energy 3.8 kcal mol-1 in a crossed molecular-beam apparatus using synchrotron vacuum-ultraviolet ionization. Products C4H5, C4H4, C3H3, and CH3 were observed and attributed to exit channels C4H5 + H, C4H4 + 2H, and C3H3 + CH3; their translational-energy distributions and angular distributions were derived from the measurements of product time-of-flight spectra. Following the addition of a 3P carbon atom to the C=C bond of propene, cyclic complex c-H2C(C)CHCH3 undergoes two separate stereoisomerization mechanisms to form intermediates E- and Z-H2CCCHCH3. Both the isomers of H2CCCHCH3 in turns decompose to C4H5 + H and C3H3 + CH3. A portion of C4H5 that has enough internal energy further decomposes to C4H4 + H. The three exit channels C4H5 + H, C4H4 + 2H, and C3H3 + CH3 have average translational energy releases 13.5, 3.2, and 15.2 kcal mol-1, respectively, corresponding to fractions 0.26, 0.41, and 0.26 of available energy deposited to the translational degrees of freedom. The H-loss and 2H-loss channels have nearly isotropic angular distributions with a slight preference at the forward direction particularly for the 2H-loss channel. In contrast, the CH3-loss channel has a forward and backward peaked angular distribution with an enhancement at the forward direction. Comparisons with reactions of 3P carbon atoms with ethene, vinyl fluoride, and vinyl chloride are stated.

  10. Reactions of Atomic Carbon with Butene Isomers: Implications for Molecular Growth in Carbon-Rich Environments

    SciTech Connect

    Bourgalais, J.; Spencer, Michael; Osborn, David L.; Goulay, F.; Le Picard, S. D.

    2016-10-31

    We carried out the product detection studies of C(3P) atom reactions with butene (C4H8) isomers (but-1-ene, cis-but-2-ene, trans-but-2-ene) in a flow tube reactor at 353 K and 4 Torr under multiple collision conditions. Ground state carbon atoms are generated by 248 nm laser photolysis of tetrabromomethane, CBr4, in a buffer of helium. Thermalized reaction products are detected using synchrotron tunable VUV photoionization and time-of-flight mass spectrometry. The temporal profiles of the detected ions are used to discriminate products from side or secondary reactions. Furthermore, for the C(3P) + trans-but-2-ene and C(3P) + cis-but-2-ene reactions, various isomers of C4H5 and C5H7 are identified as reaction products formed via CH3 and H elimination. Assuming equal ionization cross sections for all C4H5 and C5H7 isomers, C4H5:C5H7 branching ratios of 0.63:1 and 0.60:1 are derived for the C(3P) + trans-but-2-ene and the C(3P) + cis-but-2-ene reactions, respectively. For the C(3P) + but-1-ene reaction, two reaction channels are observed: the H-elimination channel, leading to the formation of the ethylpropargyl isomer, and the C3H3 + C2H5 channel. Assuming equal ionization cross sections for ethylpropargyl and C3H3 radicals, a branching ratio of 1:0.95 for the C3H3 + C2H5 and H + ethylpropargyl channels is derived. Finally, the experimental results are compared to previous H atom branching ratios and used to propose the most likely mechanisms for the reaction of ground state carbon atoms with butene isomers.

  11. Plasmon enhanced Raman scattering effect for an atom near a carbon nanotube

    SciTech Connect

    Bondarev, I. V.

    2015-01-01

    Quantum electrodynamics theory of the resonance Raman scattering is developed for an atom in a close proximity to a carbon nanotube. The theory predicts a dramatic enhancement of the Raman intensity in the strong atomic coupling regime to nanotube plasmon near-fields. This resonance scattering is a manifestation of the general electromagnetic surface enhanced Raman scattering effect, and can be used in designing efficient nanotube based optical sensing substrates for single atom detection, precision spontaneous emission control, and manipulation.

  12. Tailoring Thermal Conductivity of Single-stranded Carbon-chain Polymers through Atomic Mass Modification

    NASA Astrophysics Data System (ADS)

    Liao, Quanwen; Zeng, Lingping; Liu, Zhichun; Liu, Wei

    2016-10-01

    Tailoring the thermal conductivity of polymers is central to enlarge their applications in the thermal management of flexible integrated circuits. Progress has been made over the past decade by fabricating materials with various nanostructures, but a clear relationship between various functional groups and thermal properties of polymers remains to be established. Here, we numerically study the thermal conductivity of single-stranded carbon-chain polymers with multiple substituents of hydrogen atoms through atomic mass modification. We find that their thermal conductivity can be tuned by atomic mass modifications as revealed through molecular dynamics simulations. The simulation results suggest that heavy homogeneous substituents do not assist heat transport and trace amounts of heavy substituents can in fact hinder heat transport substantially. Our analysis indicates that carbon chain has the biggest contribution (over 80%) to the thermal conduction in single-stranded carbon-chain polymers. We further demonstrate that atomic mass modifications influence the phonon bands of bonding carbon atoms, and the discrepancies of phonon bands between carbon atoms are responsible for the remarkable drops in thermal conductivity and large thermal resistances in carbon chains. Our study provides fundamental insight into how to tailor the thermal conductivity of polymers through variable substituents.

  13. Tailoring Thermal Conductivity of Single-stranded Carbon-chain Polymers through Atomic Mass Modification.

    PubMed

    Liao, Quanwen; Zeng, Lingping; Liu, Zhichun; Liu, Wei

    2016-10-07

    Tailoring the thermal conductivity of polymers is central to enlarge their applications in the thermal management of flexible integrated circuits. Progress has been made over the past decade by fabricating materials with various nanostructures, but a clear relationship between various functional groups and thermal properties of polymers remains to be established. Here, we numerically study the thermal conductivity of single-stranded carbon-chain polymers with multiple substituents of hydrogen atoms through atomic mass modification. We find that their thermal conductivity can be tuned by atomic mass modifications as revealed through molecular dynamics simulations. The simulation results suggest that heavy homogeneous substituents do not assist heat transport and trace amounts of heavy substituents can in fact hinder heat transport substantially. Our analysis indicates that carbon chain has the biggest contribution (over 80%) to the thermal conduction in single-stranded carbon-chain polymers. We further demonstrate that atomic mass modifications influence the phonon bands of bonding carbon atoms, and the discrepancies of phonon bands between carbon atoms are responsible for the remarkable drops in thermal conductivity and large thermal resistances in carbon chains. Our study provides fundamental insight into how to tailor the thermal conductivity of polymers through variable substituents.

  14. Tailoring Thermal Conductivity of Single-stranded Carbon-chain Polymers through Atomic Mass Modification

    PubMed Central

    Liao, Quanwen; Zeng, Lingping; Liu, Zhichun; Liu, Wei

    2016-01-01

    Tailoring the thermal conductivity of polymers is central to enlarge their applications in the thermal management of flexible integrated circuits. Progress has been made over the past decade by fabricating materials with various nanostructures, but a clear relationship between various functional groups and thermal properties of polymers remains to be established. Here, we numerically study the thermal conductivity of single-stranded carbon-chain polymers with multiple substituents of hydrogen atoms through atomic mass modification. We find that their thermal conductivity can be tuned by atomic mass modifications as revealed through molecular dynamics simulations. The simulation results suggest that heavy homogeneous substituents do not assist heat transport and trace amounts of heavy substituents can in fact hinder heat transport substantially. Our analysis indicates that carbon chain has the biggest contribution (over 80%) to the thermal conduction in single-stranded carbon-chain polymers. We further demonstrate that atomic mass modifications influence the phonon bands of bonding carbon atoms, and the discrepancies of phonon bands between carbon atoms are responsible for the remarkable drops in thermal conductivity and large thermal resistances in carbon chains. Our study provides fundamental insight into how to tailor the thermal conductivity of polymers through variable substituents. PMID:27713563

  15. Structure and stability of a silicon cluster on sequential doping with carbon atoms

    NASA Astrophysics Data System (ADS)

    AzeezullaNazrulla, Mohammed; Joshi, Krati; Israel, S.; Krishnamurty, Sailaja

    2016-02-01

    SiC is a highly stable material in bulk. On the other hand, alloys of silicon and carbon at nanoscale length are interesting from both technological as well fundamental view point and are being currently synthesized by various experimental groups (Truong et. al., 2015 [26]). In the present work, we identify a well-known silicon cluster viz., Si10 and dope it sequentially with carbon atoms. The evolution of electronic structure (spin state and the structural properties) on doping, the charge redistribution and structural properties are analyzed. It is interesting to note that the ground state SiC clusters prefer to be in the lowest spin state. Further, it is seen that carbon atoms are the electron rich centres while silicon atoms are electron deficient in every SiC alloy cluster. The carbon-carbon bond lengths in alloy clusters are equivalent to those seen in fullerene molecules. Interestingly, the carbon atoms tend to aggregate together with silicon atoms surrounding them by donating the charge. As a consequence, very few Si-Si bonds are noted with increasing concentrations of C atoms in a SiC alloy. Physical and chemical stability of doped clusters is studied by carrying out finite temperature behaviour and adsorbing O2 molecule on Si9C and Si8C2 clusters, respectively.

  16. Hot wire production of single-wall and multi-wall carbon nanotubes

    DOEpatents

    Dillon, Anne C.; Mahan, Archie H.; Alleman, Jeffrey L.

    2010-10-26

    Apparatus (210) for producing a multi-wall carbon nanotube (213) may comprise a process chamber (216), a furnace (217) operatively associated with the process chamber (216), and at least one filament (218) positioned within the process chamber (216). At least one power supply (220) operatively associated with the at least one filament (218) heats the at least one filament (218) to a process temperature. A gaseous carbon precursor material (214) operatively associated with the process chamber (216) provides carbon for forming the multi-wall carbon nanotube (213). A metal catalyst material (224) operatively associated with the process (216) catalyzes the formation of the multi-wall carbon nanotube (213).

  17. Effects of Atomic-Scale Structure on the Fracture Properties of Amorphous Carbon - Carbon Nanotube Composites

    NASA Technical Reports Server (NTRS)

    Jensen, Benjamin D.; Wise, Kristopher E.; Odegard, Gregory M.

    2015-01-01

    The fracture of carbon materials is a complex process, the understanding of which is critical to the development of next generation high performance materials. While quantum mechanical (QM) calculations are the most accurate way to model fracture, the fracture behavior of many carbon-based composite engineering materials, such as carbon nanotube (CNT) composites, is a multi-scale process that occurs on time and length scales beyond the practical limitations of QM methods. The Reax Force Field (ReaxFF) is capable of predicting mechanical properties involving strong deformation, bond breaking and bond formation in the classical molecular dynamics framework. This has been achieved by adding to the potential energy function a bond-order term that varies continuously with distance. The use of an empirical bond order potential, such as ReaxFF, enables the simulation of failure in molecular systems that are several orders of magnitude larger than would be possible in QM techniques. In this work, the fracture behavior of an amorphous carbon (AC) matrix reinforced with CNTs was modeled using molecular dynamics with the ReaxFF reactive forcefield. Care was taken to select the appropriate simulation parameters, which can be different from those required when using traditional fixed-bond force fields. The effect of CNT arrangement was investigated with three systems: a single-wall nanotube (SWNT) array, a multi-wall nanotube (MWNT) array, and a SWNT bundle system. For each arrangement, covalent bonds are added between the CNTs and AC, with crosslink fractions ranging from 0-25% of the interfacial CNT atoms. The SWNT and MWNT array systems represent ideal cases with evenly spaced CNTs; the SWNT bundle system represents a more realistic case because, in practice, van der Waals interactions lead to the agglomeration of CNTs into bundles. The simulation results will serve as guidance in setting experimental processing conditions to optimize the mechanical properties of CNT

  18. Atomic carbon emission from photodissociation of CO2. [planetary atmospheric chemistry

    NASA Technical Reports Server (NTRS)

    Wu, C. Y. R.; Phillips, E.; Lee, L. C.; Judge, D. L.

    1978-01-01

    Atomic carbon fluorescence, C I 1561, 1657, and 1931 A, has been observed from photodissociation of CO2, and the production cross sections have been measured. A line emission source provided the primary photons at wavelengths from threshold to 420 A. The present results suggest that the excited carbon atoms are produced by total dissociation of CO2 into three atoms. The cross sections for producing the O I 1304-A fluorescence through photodissociation of CO2 are found to be less than 0.01 Mb in the wavelength region from 420 to 835 A. The present data have implications with respect to photochemical processes in the atmospheres of Mars and Venus.

  19. Diastereospecific nazarov cyclization of fully substituted dienones: generation of vicinal all-carbon-atom quaternary stereocenters.

    PubMed

    Jolit, Anais; Vazquez-Rodriguez, Saleta; Yap, Glenn P A; Tius, Marcus A

    2013-10-11

    No vacancy: Fully substituted dienones that are highly polarized by a vinylogous carbonate group were found to undergo a remarkably rapid and diastereospecific Nazarov cyclization that led to cyclopentenones with vicinal all-carbon-atom quaternary centers (see example; SEM=2-(trimethylsilyl)ethoxymethyl, Tf=trifluoromethanesulfonyl). Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  20. Highly Sensitive Hot-Wire Anemometry Based on Macro-Sized Double-Walled Carbon Nanotube Strands

    PubMed Central

    Wang, Dingqu; Xiong, Wei; Zhou, Zhaoying; Zhu, Rong; Yang, Xing; Li, Weihua; Jiang, Yueyuan; Zhang, Yajun

    2017-01-01

    This paper presents a highly sensitive flow-rate sensor with carbon nanotubes (CNTs) as sensing elements. The sensor uses micro-size centimeters long double-walled CNT (DWCNT) strands as hot-wires to sense fluid velocity. In the theoretical analysis, the sensitivity of the sensor is demonstrated to be positively related to the ratio of its surface. We assemble the flow sensor by suspending the DWCNT strand directly on two tungsten prongs and dripping a small amount of silver glue onto each contact between the DWCNT and the prongs. The DWCNT exhibits a positive TCR of 1980 ppm/K. The self-heating effect on the DWCNT was observed while constant current was applied between the two prongs. This sensor can evidently respond to flow rate, and requires only several milliwatts to operate. We have, thus far, demonstrated that the CNT-based flow sensor has better sensitivity than the Pt-coated DWCNT sensor. PMID:28762998

  1. Unexpected Huge Dimerization Ratio in One-Dimensional Carbon Atomic Chains.

    PubMed

    Lin, Yung-Chang; Morishita, Shigeyuki; Koshino, Masanori; Yeh, Chao-Hui; Teng, Po-Yuan; Chiu, Po-Wen; Sawada, Hidetaka; Suenaga, Kazutomo

    2017-01-11

    Peierls theory predicted atomic distortion in one-dimensional (1D) crystal due to its intrinsic instability in 1930. Free-standing carbon atomic chains created in situ in transmission electron microscope (TEM)1-3 are an ideal example to experimentally observe the dimerization behavior of carbon atomic chain within a finite length. We report here a surprisingly huge distortion found in the free-standing carbon atomic chains at 773 K, which is 10 times larger than the value expected in the system. Such an abnormally distorted phase only dominates at the elevated temperatures, while two distinct phases, distorted and undistorted, coexist at lower or ambient temperatures. Atom-by-atom spectroscopy indeed shows considerable variations in the carbon 1s spectra at each atomic site but commonly observes a slightly downshifted π* peak, which proves its sp(1) bonding feature. These results suggest that the simple model, relaxed and straight, is not fully adequate to describe the realistic 1D structure, which is extremely sensitive to perturbations such as external force or boundary conditions.

  2. "Eyes Open - Eyes Closed" EEG/fMRI data set including dedicated "Carbon Wire Loop" motion detection channels.

    PubMed

    van der Meer, Johan; Pampel, André; van Someren, Eus; Ramautar, Jennifer; van der Werf, Ysbrand; Gomez-Herrero, German; Lepsien, Jöran; Hellrung, Lydia; Hinrichs, Hermann; Möller, Harald; Walter, Martin

    2016-06-01

    This data set contains electroencephalography (EEG) data as well as simultaneous EEG with functional magnetic resonance imaging (EEG/fMRI) data. During EEG/fMRI, the EEG cap was outfitted with a hardware-based add-on consisting of carbon-wire loops (CWL). These yielded six extra׳CWL׳ signals related to Faraday induction of these loops in the main magnetic field "Measurement and reduction of motion and ballistocardiogram artefacts from simultaneous EEG and fMRI recordings" (Masterton et al., 2007) [1]. In this data set, the CWL data make it possible to do a direct regression approach to deal with the BCG and specifically He artifact. The CWL-EEG/fMRI data in this paper has been recorded on two MRI scanners with different Helium pump systems (4 subjects on a 3 T TIM Trio and 4 subjects on a 3T VERIO). Separate EEG/fMRI data sets have been recorded for the helium pump ON as well as the helium pump OFF conditions. The EEG-only data (same subjects) has been recorded for a motion artifact-free reference EEG signal outside of the scanner. This paper also links to an EEGlab "EEGLAB: an open source toolbox for analysis of single-trial EEG dynamics including independent component analysis" (Delorme and Makeig, 2004) [2] plugin to perform a CWL regression approach to deal with the He pump artifact, as published in the main paper "Carbon-wire loop based artifact correction outperforms post-processing EEG/fMRI corrections-A validation of a real-time simultaneous EEG/fMRI correction method" (van der Meer et al., 2016) [3].

  3. Synthetic Strategies toward Natural Products Containing Contiguous Stereogenic Quaternary Carbon Atoms.

    PubMed

    Büschleb, Martin; Dorich, Stéphane; Hanessian, Stephen; Tao, Daniel; Schenthal, Kyle B; Overman, Larry E

    2016-03-18

    Strategies for the total synthesis of complex natural products that contain two or more contiguous stereogenic quaternary carbon atoms in their intricate structures are reviewed with 12 representative examples. Emphasis has been put on methods to create quaternary carbon stereocenters, including syntheses of the same natural product by different groups, thereby showcasing the diversity of thought and individual creativity. A compendium of selected natural products containing two or more contiguous stereogenic quaternary carbon atoms and key reactions in their total or partial syntheses is provided in the Supporting Information. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  4. A nine-atom rhodium–aluminum oxide cluster oxidizes five carbon monoxide molecules

    PubMed Central

    Li, Xiao-Na; Zhang, Hua-Min; Yuan, Zhen; He, Sheng-Gui

    2016-01-01

    Noble metals can promote the direct participation of lattice oxygen of very stable oxide materials such as aluminum oxide, to oxidize reactant molecules, while the fundamental mechanism of noble metal catalysis is elusive. Here we report that a single atom of rhodium, a powerful noble metal catalyst, can promote the transfer of five oxygen atoms to oxidize carbon monoxide from a nine-atom rhodium–aluminum oxide cluster. This is a sharp improvement in the field of cluster science where the transfer of at most two oxygen atoms from a doped cluster is more commonly observed. Rhodium functions not only as the preferred trapping site to anchor and oxidize carbon monoxide by the oxygen atoms in direct connection with rhodium but also the primarily oxidative centre to accumulate the large amounts of electrons and the polarity of rhodium is ultimately transformed from positive to negative. PMID:27094921

  5. Optically promoted bipartite atomic entanglement in hybrid metallic carbon nanotube systems

    SciTech Connect

    Gelin, M. F.; Bondarev, I. V.; Meliksetyan, A. V.

    2014-02-14

    We study theoretically a pair of spatially separated extrinsic atomic type species (extrinsic atoms, ions, molecules, or semiconductor quantum dots) near a metallic carbon nanotube, that are coupled both directly via the inter-atomic dipole-dipole interactions and indirectly by means of the virtual exchange by resonance plasmon excitations on the nanotube surface. We analyze how the optical preparation of the system by using strong laser pulses affects the formation and evolution of the bipartite atomic entanglement. Despite a large number of possible excitation regimes and evolution pathways, we find a few generic scenarios for the bipartite entanglement evolution and formulate practical recommendations on how to optimize and control the robust bipartite atomic entanglement in hybrid carbon nanotube systems.

  6. A molecular quantum wire of linear carbon chains encapsulated within single-walled carbon nanotube (Cn@SWNT )

    NASA Astrophysics Data System (ADS)

    Lim, San Hua; Lin, Jianyi; Widjaja, Effendi; Poh, Chee Kok; Luo, Zhiqiang; Gao, Ping Qi; Shen, Zexiang; Zhang, Qing; Gong, Hao; Feng, Yuanping

    2011-01-01

    Pure s p -hybridized linear carbon chains possess unique physical properties of one-dimensional (1D) system. However, linear carbon chains are highly unstable and require to be stabilized within a matrix for direct experimental studies. Here we report a plasma-enhanced chemical vapor deposition method to encapsulate and stabilize linear carbon chains (Cn ) within vertically aligned SWNTs to form a s p -s p2 hybrid system (Cn@SWNT ) . Intense Raman signals at ˜1760 -1860 cm-1 (L bands) indicate the presence of linear carbon chains within SWNTs. Electron transport of Cn@SWNT bundle exhibits Luttinger-liquid behavior.

  7. Comparison of tungsten films grown by CVD and hot-wire assisted atomic layer deposition in a cold-wall reactor

    SciTech Connect

    Yang, Mengdi Aarnink, Antonius A. I.; Kovalgin, Alexey Y.; Gravesteijn, Dirk J.; Wolters, Rob A. M.; Schmitz, Jurriaan

    2016-01-15

    In this work, the authors developed hot-wire assisted atomic layer deposition (HWALD) to deposit tungsten (W) with a tungsten filament heated up to 1700–2000 °C. Atomic hydrogen (at-H) was generated by dissociation of molecular hydrogen (H{sub 2}), which reacted with WF{sub 6} at the substrate to deposit W. The growth behavior was monitored in real time by an in situ spectroscopic ellipsometer. In this work, the authors compare samples with tungsten grown by either HWALD or chemical vapor deposition (CVD) in terms of growth kinetics and properties. For CVD, the samples were made in a mixture of WF{sub 6} and molecular or atomic hydrogen. Resistivity of the WF{sub 6}-H{sub 2} CVD layers was 20 μΩ·cm, whereas for the WF{sub 6}-at-H-CVD layers, it was 28 μΩ·cm. Interestingly, the resistivity was as high as 100 μΩ·cm for the HWALD films, although the tungsten films were 99% pure according to x-ray photoelectron spectroscopy. X-ray diffraction reveals that the HWALD W was crystallized as β-W, whereas both CVD films were in the α-W phase.

  8. Study on nitrogen doped carbon atom chains with negative differential resistance effect

    NASA Astrophysics Data System (ADS)

    Shen, Ji-Mei; Liu, Jing; Min, Yi; Zhou, Li-Ping

    2016-05-01

    Recent calculations (Mahmoud and Lugli, 2013, [21]) of gold leads sandwiching carbon chains which are separated by diphenyl-dimethyl demonstrated that the negative differential resistance (NDR) effect appears only for ;odd; numbers of carbon atoms. In this paper, according to a first-principles study based on non-equilibrium Green's function combining density functional theory, we find that the NDR effect appears both for ;odd; and for ;even; numbers of carbon atoms when the chains are doped by nitrogen atom. Our calculations remove the restriction of ;odd/even; chains for the NDR effect, which may promise the potential applications of carbon chains in the nano-scale or molecular devices in the future.

  9. Atomic Layer Deposition on Carbon Nanotubes and their Assemblies

    NASA Astrophysics Data System (ADS)

    Stano, Kelly Lynn

    Global issues related to energy and the environment have motivated development of advanced material solutions outside of traditional metals ceramics, and polymers. Taking inspiration from composites, where the combination of two or more materials often yields superior properties, the field of organic-inorganic hybrids has recently emerged. Carbon nanotube (CNT)-inorganic hybrids have drawn widespread and increasing interest in recent years due to their multifunctionality and potential impact across several technologically important application areas. Before the impacts of CNT-inorganic hybrids can be realized however, processing techniques must be developed for their scalable production. Optimization in chemical vapor deposition (CVD) methods for synthesis of CNTs and vertically aligned CNT arrays has created production routes both high throughput and economically feasible. Additionally, control of CVD parameters has allowed for growth of CNT arrays that are able to be drawn into aligned sheets and further processed to form a variety of aligned 1, 2, and 3-dimensional bulk assemblies including ribbons, yarns, and foams. To date, there have only been a few studies on utilizing these bulk assemblies for the production of CNT-inorganic hybrids. Wet chemical methods traditionally used for fabricating CNT-inorganic hybrids are largely incompatible with CNT assemblies, since wetting and drying the delicate structures with solvents can destroy their structure. It is therefore necessary to investigate alternative processing strategies in order to advance the field of CNT-inorganic hybrids. In this dissertation, atomic layer deposition (ALD) is evaluated as a synthetic route for the production of large-scale CNT-metal oxide hybrids as well as pure metal oxide architectures utilizing CNT arrays, ribbons, and ultralow density foams as deposition templates. Nucleation and growth behavior of alumina was evaluated as a function of CNT surface chemistry. While highly graphitic

  10. Effect of microalloying on the strength of high carbon wire steels

    NASA Astrophysics Data System (ADS)

    Miller, Stephanie L.

    Microalloying additions of V, Nb, and N were investigated as means of increasing strength of eutectoid steels for wire applications. In order to examine the effects of microalloying additions during several stages of wire processing, continuous cooling experiments with and without deformation as well as patenting simulations were conducted using a Gleeble® 3500 thermomechanical simulator. Continuous cooling was performed from industrial austenitizing (1093 °C) and laying head (950 °C and 880 °C) temperatures, at rates ranging from 1 50 °C/s. Deformation was induced via hot torsion testing, which was followed by continuous cooling from 950 °C at rates of 5, 10, and 25 °C/s. Industrial wire patenting was simulated by austenitizing at 1093 °C or 950 °C for 30 sec, then rapid cooling to isothermal transformation temperatures of 575, 600, 625, and 650 °C for 15 sec before cooling to room temperature. Metallography, Vickers hardness, pearlite colony size and pearlite interlamellar spacing (ILS) measurements were used to examine the effects of these treatments. Continuous cooling transformation (CCT) curves were constructed for four steels: 1080, V, V+N, and V+Nb. In the V-microalloyed steel, additional N accelerated pearlite transformation and Nb delayed pearlite transformation. Observed N effects are in agreement with the theory of VN nucleating grain boundary ferrite and accelerating pearlite transformation, proposed by Han et al. [1995], and also consistent with observations by Brownrigg and Prior [2002]. Delay of transformation temperatures has been observed due to Nb effects [De Ardo, 2009]. A larger delay observed with higher austenitizing temperatures suggests that Nb precipitates may not be as effective at delaying transformation. V strengthening effects were observed in all microalloyed steels using a model that predicted hardness of eutectoid steels by incorporating colony size and ILS measurements, with maximum strengthening observed

  11. Migration Mechanism for Atomic Hydrogen in Porous Carbon Materials

    SciTech Connect

    Narayanan, B.; Zhao, Y. F.; Ciobanu, C. V.

    2012-05-14

    To explain the fast kinetics of H in porous carbon, we propose that the migration relies on H hopping from a carbon nanotube (CNT) to another. Using density functional theory, we have found that the barrier for H hopping becomes smaller than that for diffusion along a tube for certain CNT separations, decreasting to less than 0.5 eV for separations of -3.1 {angstrom}. Such significant reduction occurs irrespective of radius, chirality, registry, and orientation of the two CNTs: the diffusion is thus facilitated by the porous nature of the material itself. The mechanism proposed is applicable for any porous carbon-based nanomaterials.

  12. Diamond like carbon coatings: Categorization by atomic number density

    NASA Technical Reports Server (NTRS)

    Angus, John C.

    1986-01-01

    Dense diamond-like hydrocarbon films grown at the NASA Lewis Research Center by radio frequency self bias discharge and by direct ion beam deposition were studied. A new method for categorizing hydrocarbons based on their atomic number density and elemental composition was developed and applied to the diamond-like hydrocarbon films. It was shown that the diamond-like hydrocarbon films are an entirely new class of hydrocarbons with atomic number densities lying between those of single crystal diamond and adamantanes. In addition, a major review article on these new materials was completed in cooperation with NASA Lewis Research Center personnel.

  13. Insights into hydrogen atom adsorption on and the electrochemical properties of nitrogen-substituted carbon materials.

    PubMed

    Zhu, Z H; Hatori, H; Wang, S B; Lu, G Q

    2005-09-08

    The nitrogen substitution in carbon materials is investigated theoretically using the density functional theory method. Our calculations show that nitrogen substitution decreases the hydrogen adsorption energy if hydrogen atoms are adsorbed on both nitrogen atoms and the neighboring carbon atoms. On the contrary, the hydrogen adsorption energy can be increased if hydrogen atoms are adsorbed only on the neighboring carbon atoms. The reason can be explained by the electronic structures analysis of N-substituted graphene sheets. Nitrogen substitution reduces the pi electron conjugation and increases the HOMO energy of a graphene sheet, and the nitrogen atom is not stable due to its 3-valent character. This raises an interesting research topic on the optimization of the N-substitution degree, and is important to many applications such as hydrogen storage and the tokamaks device. The electronic structure studies also explain well why nitrogen substitution increases the capacitance but decreases the electron conductivity of carbon electrodes as was experimentally observed in our experiments on the supercapacitor.

  14. Identification of the mechanisms responsible for static strain ageing in heavily drawn pearlitic steel wires

    NASA Astrophysics Data System (ADS)

    Lamontagne, A.; Kleber, X.; Massardier-Jourdan, V.; Mari, D.

    2014-08-01

    The microstructural changes occurring during drawing and ageing in pearlitic steel wires have been studied using the thermoelectric power (TEP) measurements combined with atom probe tomography (APT) and differential scanning calorimetry (DSC). APT analysis confirmed that cementite dissolution occurs during the cold-drawing process. The high sensitivity of TEP to solute atoms allowed two ageing mechanisms to be identified, both related to a redistribution of carbon atoms. The complementary use of tensile tests and DSC confirmed these results.

  15. Growth and Destruction of PAH Molecules in Reactions with Carbon Atoms

    NASA Astrophysics Data System (ADS)

    Krasnokutski, Serge A.; Huisken, Friedrich; Jäger, Cornelia; Henning, Thomas

    2017-02-01

    A very high abundance of atomic carbon in the interstellar medium (ISM), and the high reactivity of these species toward different hydrocarbon molecules including benzene, raise questions regarding the stability of polycyclic aromatic hydrocarbon (PAH) molecules in space. To test the efficiency of destruction of PAH molecules via reactions with atomic carbon, we performed a set of laboratory and computational studies of the reactions of naphthalene, anthracene, and coronene molecules with carbon atoms in the ground state. The reactions were investigated in liquid helium droplets at T = 0.37 K and by quantum chemical computations. Our studies suggest that all small and all large catacondensed PAHs react barrierlessly with atomic carbon, and therefore should be efficiently destroyed by such reactions in a broad temperature range. At the same time, large compact pericondensed PAHs should be more inert toward such a reaction. In addition, taking into account their higher photostability, much higher abundances of pericondensed PAHs should be expected in various astrophysical environments. The barrierless reactions between carbon atoms and small PAHs also suggest that, in the ISM, these reactions could lead to the bottom-up formation of PAH molecules.

  16. Molecular dynamics simulation for arrangement of nickel atoms filled in carbon nanotubes

    SciTech Connect

    Bai, Liu Zhenyu, Zhao; Lirui, Liu

    2014-08-28

    Carbon Nanotubes (CNTs) filled with metals can be used in capacitors, sensors, rechargeable batteries, and so on. Atomic arrangement of the metals has an important role in the function of the composites. The tips of CNTs were opened, and then nickel was filled by means of hydrothermal oxidation/ultrasonic vibration method. The tests of TEM, HREM, and EDX (energy-dispersive X-ray spectroscopy) analysis showed that Ni was filled in CNTs successfully. The atomic arrangement of nickel filled into single wall carbon nanotubes was investigated by molecular dynamics simulation. The radial distribution function and bond orientation order were established to analyze the atomic arrangement of nickel filled in carbon nanotubes during the cooling process. The results show that nickel atoms became in order gradually and preferably crystallized on the inner wall of carbon nanotubes when the temperature decreased from 1600 K. After it cooled to 100 K, the arrangement of nickel atoms in outermost circle was regular and dense, but there were many defects far from the wall of CNTs. According to the calculation of bond orientation order parameters Q{sub 6} and its visualization, the structure of nickel is Face-centered cube (f.c.c). (1,1,1){sub Ni} was close on the inner surface of carbon nanotubes. Radial direction of CNTs was [1,1,1] crystal orientation. Axial direction of CNTs, namely, filling direction, was [1{sup ¯}, 1{sup ¯},2] crystal orientation.

  17. Molecular dynamics simulation for arrangement of nickel atoms filled in carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Bai, Liu; Lirui, Liu; Zhenyu, Zhao

    2014-08-01

    Carbon Nanotubes (CNTs) filled with metals can be used in capacitors, sensors, rechargeable batteries, and so on. Atomic arrangement of the metals has an important role in the function of the composites. The tips of CNTs were opened, and then nickel was filled by means of hydrothermal oxidation/ultrasonic vibration method. The tests of TEM, HREM, and EDX (energy-dispersive X-ray spectroscopy) analysis showed that Ni was filled in CNTs successfully. The atomic arrangement of nickel filled into single wall carbon nanotubes was investigated by molecular dynamics simulation. The radial distribution function and bond orientation order were established to analyze the atomic arrangement of nickel filled in carbon nanotubes during the cooling process. The results show that nickel atoms became in order gradually and preferably crystallized on the inner wall of carbon nanotubes when the temperature decreased from 1600 K. After it cooled to 100 K, the arrangement of nickel atoms in outermost circle was regular and dense, but there were many defects far from the wall of CNTs. According to the calculation of bond orientation order parameters Q6 and its visualization, the structure of nickel is Face-centered cube (f.c.c). (1,1,1)Ni was close on the inner surface of carbon nanotubes. Radial direction of CNTs was [1,1,1] crystal orientation. Axial direction of CNTs, namely, filling direction, was [1¯, 1¯,2] crystal orientation.

  18. Strain-induced metal-semiconductor transition observed in atomic carbon chains

    NASA Astrophysics Data System (ADS)

    La Torre, A.; Botello-Mendez, A.; Baaziz, W.; Charlier, J.-C.; Banhart, F.

    2015-03-01

    Carbyne, the sp1-hybridized phase of carbon, is still a missing link in the family of carbon allotropes. While the bulk phases of carbyne remain elusive, the elementary constituents, that is, linear chains of carbon atoms, have already been observed using the electron microscope. Isolated atomic chains are highly interesting one-dimensional conductors that have stimulated considerable theoretical work. Experimental information, however, is still very limited. Here we show electrical measurements and first-principles transport calculations on monoatomic carbon chains. When the 1D system is under strain, the chains are semiconducting corresponding to the polyyne structure with alternating bond lengths. Conversely, when the chain is unstrained, the ohmic behaviour of metallic cumulene with uniform bond lengths is observed. This confirms the recent prediction of a metal-insulator transition that is induced by strain. The key role of the contacting leads explains the rectifying behaviour measured in monoatomic carbon chains in a nonsymmetric contact configuration.

  19. Strain-induced metal–semiconductor transition observed in atomic carbon chains

    PubMed Central

    La Torre, A.; Botello-Mendez, A.; Baaziz, W.; Charlier, J. -C.; Banhart, F.

    2015-01-01

    Carbyne, the sp1-hybridized phase of carbon, is still a missing link in the family of carbon allotropes. While the bulk phases of carbyne remain elusive, the elementary constituents, that is, linear chains of carbon atoms, have already been observed using the electron microscope. Isolated atomic chains are highly interesting one-dimensional conductors that have stimulated considerable theoretical work. Experimental information, however, is still very limited. Here we show electrical measurements and first-principles transport calculations on monoatomic carbon chains. When the 1D system is under strain, the chains are semiconducting corresponding to the polyyne structure with alternating bond lengths. Conversely, when the chain is unstrained, the ohmic behaviour of metallic cumulene with uniform bond lengths is observed. This confirms the recent prediction of a metal–insulator transition that is induced by strain. The key role of the contacting leads explains the rectifying behaviour measured in monoatomic carbon chains in a nonsymmetric contact configuration. PMID:25818506

  20. Carbon concentration measurements by atom probe tomography in the ferritic phase of high-silicon steels

    SciTech Connect

    Rementeria, Rosalia; Poplawsky, Jonathan D.; Aranda, Maria M.; Guo, Wei; Jimenez, Jose A.; Garcia-Mateo, Carlos; Caballero, Francisca G.

    2016-12-19

    Current studies using atom probe tomography (APT) show that bainitic ferrite formed at low temperature contains more carbon than what is consistent with the paraequilibrium phase diagram. However, nanocrystalline bainitic ferrite exhibits a non-homogeneous distribution of carbon atoms in arrangements with specific compositions, i.e. Cottrell atmospheres, carbon clusters, and carbides, in most cases with a size of a few nanometers. The ferrite volume within a single platelet that is free of these carbon-enriched regions is extremely small. Proximity histograms can be compromised on the ferrite side, and a great deal of care should be taken to estimate the carbon content in regions of bainitic ferrite free from carbon agglomeration. For this purpose, APT measurements were first validated for the ferritic phase in a pearlitic sample and further performed for the bainitic ferrite matrix in high-silicon steels isothermally transformed between 200 °C and 350 °C. Additionally, results were compared with the carbon concentration values derived from X-ray diffraction (XRD) analyses considering a tetragonal lattice and previous APT studies. In conclusion, the present results reveal a strong disagreement between the carbon content values in the bainitic ferrite matrix as obtained by APT and those derived from XRD measurements. Those differences have been attributed to the development of carbon-clustered regions with an increased tetragonality in a carbon-depleted matrix.

  1. Carbon concentration measurements by atom probe tomography in the ferritic phase of high-silicon steels

    DOE PAGES

    Rementeria, Rosalia; Poplawsky, Jonathan D.; Aranda, Maria M.; ...

    2016-12-19

    Current studies using atom probe tomography (APT) show that bainitic ferrite formed at low temperature contains more carbon than what is consistent with the paraequilibrium phase diagram. However, nanocrystalline bainitic ferrite exhibits a non-homogeneous distribution of carbon atoms in arrangements with specific compositions, i.e. Cottrell atmospheres, carbon clusters, and carbides, in most cases with a size of a few nanometers. The ferrite volume within a single platelet that is free of these carbon-enriched regions is extremely small. Proximity histograms can be compromised on the ferrite side, and a great deal of care should be taken to estimate the carbon contentmore » in regions of bainitic ferrite free from carbon agglomeration. For this purpose, APT measurements were first validated for the ferritic phase in a pearlitic sample and further performed for the bainitic ferrite matrix in high-silicon steels isothermally transformed between 200 °C and 350 °C. Additionally, results were compared with the carbon concentration values derived from X-ray diffraction (XRD) analyses considering a tetragonal lattice and previous APT studies. In conclusion, the present results reveal a strong disagreement between the carbon content values in the bainitic ferrite matrix as obtained by APT and those derived from XRD measurements. Those differences have been attributed to the development of carbon-clustered regions with an increased tetragonality in a carbon-depleted matrix.« less

  2. Local Control of Lung Derived Tumors by Diffusing Alpha-Emitting Atoms Released From Intratumoral Wires Loaded With Radium-224

    SciTech Connect

    Cooks, Tomer; Schmidt, Michael; Bittan, Hadas; Lazarov, Elinor; Arazi, Lior; Kelson, Itzhak; Keisari, Yona

    2009-07-01

    Purpose: Diffusing alpha-emitters radiation therapy (DART) is a new form of brachytherapy enabling the treatment of solid tumors with alpha radiation. The present study examines the antitumoral effects resulting from the release of alpha emitting radioisotopes into solid lung carcinoma (LL2, A427, and NCI-H520). Methods and Materials: An in vitro setup tested the dose-dependent killing of tumor cells exposed to alpha particles. In in vivo studies, radioactive wires (0.3 mm diameter, 5 mm long) with {sup 224}Ra activities in the range of 21-38 kBq were inserted into LL/2 tumors in C57BL/6 mice and into human-derived A427 or NCI-H520 tumors in athymic mice. The efficacy of the short-lived daughters of {sup 224}Ra to produce tumor growth retardation and prolong life was assessed, and the spread of radioisotopes inside tumors was measured using autoradiography. Results: The insertion of a single DART wire into the center of 6- to 7-mm tumors had a pronounced retardation effect on tumor growth, leading to a significant inhibition of 49% (LL2) and 93% (A427) in tumor development and prolongations of 48% (LL2) in life expectancy. In the human model, more than 80% of the treated tumors disappeared or shrunk. Autoradiographic analysis of the treated sectioned tissue revealed the intratumoral distribution of the radioisotopes, and histological analysis showed corresponding areas of necrosis. In vitro experiments demonstrated a dose-dependent killing of tumors cells exposed to alpha particles. Conclusions: Short-lived diffusing alpha-emitters produced tumor growth retardation and increased survival in mice bearing lung tumor implants. These results justify further investigations with improved dose distributions.

  3. Carbon nanotubes under electron irradiation: Stability of the tubes and their action as pipes for atom transport

    SciTech Connect

    Banhart, F.; Li, J.X.; Krasheninnikov, A.V.

    2005-06-15

    The production and migration of carbon interstitials in carbon nanotubes under electron irradiation is studied experimentally and theoretically. It is shown that the threshold for displacing carbon atoms and the defect production rate strongly depend on the diameter of the nanotubes. Multiwalled nanotubes shrink by a loss of atoms and by diffusion of interstitials through the inner hollow in the axial direction. Thus, experimental evidence is given that nanotubes can act as nanoscale pipes for the transport of atoms.

  4. Computational studies of gas phase reactions of carbon chain anions with N and O atoms.

    PubMed

    Yang, Zhibo; Snow, Theodore P; Bierbaum, Veronica M

    2010-10-28

    Experimental studies of gas phase reactions of carbanions with N and O atoms have been reported previously to understand ion chemistry relevant to the interstellar medium. In all cases reactions of anions with O atoms exhibit larger reaction rate constants compared to the corresponding N atom reactions. In addition, the open-shell carbon chain anions exhibit higher reactivities than the corresponding closed-shell species in N atom reactions, whereas similar reactivities were observed for both open and closed-shell anions in O atom reactions. These trends are investigated by the current theoretical study of the reactions of HC(n)(-)(n = 2, 4, and 6) and C(n)(-) (n = 2, 4-7) with N and O atoms. Our results indicate that spin-forbidden processes are the probable pathways in reactions of closed-shell anions HC(n)(-) with N atoms, and spin conversion limits the reaction efficiency. In reactions of open-shell anions C(n)(-) with N atoms, about 50% of the collisions may proceed through spin-allowed barrierless pathways, which results in relatively higher reaction efficiencies than for the closed-shell reactions. For reactions of all anions with O atoms, the spin-allowed barrierless pathways are the only channels, such that all reactions occur with very high efficiencies. This work provides a greater understanding of the influence of spin effects on the reactivities of anion reactions involving N and O atoms that may be important in the interstellar medium.

  5. Surface modification of carbon post arrays by atomic layer deposition of ZnO film.

    PubMed

    Lee, Hyun Ae; Byun, Young-Chul; Singh, Umesh; Cho, Hyoung J; Kim, Hyoungsub

    2011-08-01

    The applicability of atomic layer deposition (ALD) process to the carbon microelectromechanical system technology was studied for a surface modification method of the carbon post electrodes. A conformal coating of the ALD-ZnO film was successfully demonstrated on the carbon post arrays which were fabricated by the traditional photolithography and subsequent two-step pyrolysis. A significant Zn diffusion into the underlying carbon posts was observed during the ALD process. The addition of a sputter-deposited ZnO interfacial layer efficiently blocked the Zn diffusion without altering the microstructure and surface morphology of the ALD-ZnO film.

  6. Atomic migration of carbon in hard turned layers of carburized bearing steel

    SciTech Connect

    Bedekar, Vikram; Poplawsky, Jonathan D.; Guo, Wei; Shivpuri, Rajiv; Scott Hyde, R.

    2016-01-01

    In grain finement and non-equilibrium there is carbon segregation within grain boundaries alters the mechanical performance of hard turning layers in carburized bearing steel. Moreover, an atom probe tomography (APT) study on the nanostructured hard turning layers reveals carbon migration to grain boundaries as a result of carbide decomposition during severe plastic deformation. In addition, samples exposed to different cutting speeds show that the carbon migration rate increases with the cutting speed. For these two effects lead to an ultrafine carbon network structure resulting in increased hardness and thermal stability in the severely deformed surface layer.

  7. Atomic migration of carbon in hard turned layers of carburized bearing steel

    DOE PAGES

    Bedekar, Vikram; Poplawsky, Jonathan D.; Guo, Wei; ...

    2016-01-01

    In grain finement and non-equilibrium there is carbon segregation within grain boundaries alters the mechanical performance of hard turning layers in carburized bearing steel. Moreover, an atom probe tomography (APT) study on the nanostructured hard turning layers reveals carbon migration to grain boundaries as a result of carbide decomposition during severe plastic deformation. In addition, samples exposed to different cutting speeds show that the carbon migration rate increases with the cutting speed. For these two effects lead to an ultrafine carbon network structure resulting in increased hardness and thermal stability in the severely deformed surface layer.

  8. Racing Carbon Atoms. Atomic Motion Reaction Coordinates and Structural Effects on Newtonian Kinetic Isotope Effects

    PubMed Central

    Andujar-De Sanctis, Ivonne L.

    2012-01-01

    Intramolecular 13C kinetic isotope effects were determined for the dimerization of methacrolein. Trajectory studies accurately predict the isotope effects and support an origin in Newton’s second law of motion, with no involvement of zero-point energy or transition state recrossing. Atomic motion reaction coordinate diagrams are introduced as a way to qualitatively understand the selectivity. PMID:23025278

  9. Racing carbon atoms. Atomic motion reaction coordinates and structural effects on Newtonian kinetic isotope effects.

    PubMed

    Andujar-De Sanctis, Ivonne L; Singleton, Daniel A

    2012-10-19

    Intramolecular (13)C kinetic isotope effects were determined for the dimerization of methacrolein. Trajectory studies accurately predict the isotope effects and support an origin in Newton's second law of motion, with no involvement of zero-point energy or transition state recrossing. Atomic motion reaction coordinate diagrams are introduced as a way to qualitatively understand the selectivity.

  10. Basic Wiring.

    ERIC Educational Resources Information Center

    Kaltwasser, Stan; And Others

    This module is the first in a series of three wiring publications; it serves as the foundation for students enrolled in a wiring program. It is a prerequisite to either "Residential Wiring" or "Commercial and Industrial Wiring." The module contains 16 instructional units that cover the following topics: occupational…

  11. High performance current and spin diode of atomic carbon chain between transversely symmetric ribbon electrodes

    PubMed Central

    Dong, Yao-Jun; Wang, Xue-Feng; Yang, Shuo-Wang; Wu, Xue-Mei

    2014-01-01

    We demonstrate that giant current and high spin rectification ratios can be achieved in atomic carbon chain devices connected between two symmetric ferromagnetic zigzag-graphene-nanoribbon electrodes. The spin dependent transport simulation is carried out by density functional theory combined with the non-equilibrium Green's function method. It is found that the transverse symmetries of the electronic wave functions in the nanoribbons and the carbon chain are critical to the spin transport modes. In the parallel magnetization configuration of two electrodes, pure spin current is observed in both linear and nonlinear regions. However, in the antiparallel configuration, the spin-up (down) current is prohibited under the positive (negative) voltage bias, which results in a spin rectification ratio of order 104. When edge carbon atoms are substituted with boron atoms to suppress the edge magnetization in one of the electrodes, we obtain a diode with current rectification ratio over 106. PMID:25142376

  12. Synthesis of novel amorphous calcium carbonate by sono atomization for reactive mixing.

    PubMed

    Kojima, Yoshiyuki; Kanai, Makoto; Nishimiya, Nobuyuki

    2012-03-01

    Droplets of several micrometers in size can be formed in aqueous solution by atomization under ultrasonic irradiation at 2 MHz. This phenomenon, known as atomization, is capable of forming fine droplets for use as a reaction field. This synthetic method is called SARM (sono atomization for reactive mixing). This paper reports on the synthesis of a novel amorphous calcium carbonate formed by SARM. The amorphous calcium carbonate, obtained at a solution concentration of 0.8 mol/dm(3), had a specific surface area of 65 m(2)/g and a composition of CaCO(3)•0.5H(2)O as determined using thermogravimetric/differential thermal analysis (TG-DTA). Because the ACC had a lower hydrate composition than conventional amorphous calcium carbonate (ACC), the ACC synthesized in this paper was very stable at room temperature. Crown Copyright © 2011. Published by Elsevier B.V. All rights reserved.

  13. Integrating Carbon Nanotubes For Atomic Force Microscopy Imaging Applications

    NASA Technical Reports Server (NTRS)

    Ye, Qi; Cassell, Alan M.; Liu, Hongbing; Han, Jie; Meyyappan, Meyya

    2004-01-01

    Carbon nanotube (CNT) related nanostructures possess remarkable electrical, mechanical, and thermal properties. To produce these nanostructures for real world applications, a large-scale controlled growth of carbon nanotubes is crucial for the integration and fabrication of nanodevices and nanosensors. We have taken the approach of integrating nanopatterning and nanomaterials synthesis with traditional silicon micro fabrication techniques. This integration requires a catalyst or nanomaterial protection scheme. In this paper, we report our recent work on fabricating wafer-scale carbon nanotube AFM cantilever probe tips. We will address the design and fabrication considerations in detail, and present the preliminary scanning probe test results. This work may serve as an example of rational design, fabrication, and integration of nanomaterials for advanced nanodevice and nanosensor applications.

  14. 4.4.4 R1 and R2: Leading atom other than carbon; R3: Leading atom carbon

    NASA Astrophysics Data System (ADS)

    Beckwith, A. L. J.

    This document is part of Subvolume A1 `Inorganic Radicals, Metal Complexes and Nonconjugated Carbon Centered Radicals' of Volume 26 `Magnetic Properties of Free Radicals' of Landolt-Börnstein Group II `Molecules and Radicals'.

  15. Crossed-Wire Laser Microwelding of Pt-10 Pct Ir to 316 Low-Carbon Vacuum Melted Stainless Steel: Part I. Mechanism of Joint Formation

    NASA Astrophysics Data System (ADS)

    Zou, G. S.; Huang, Y. D.; Pequegnat, A.; Li, X. G.; Khan, M. I.; Zhou, Y.

    2012-04-01

    The excellent biocompatibility and corrosion properties of Pt alloys and 316 low-carbon vacuum melted (LVM) stainless steel (SS) make them attractive for biomedical applications. With the increasing complexity of medical devices and in order to lower costs, the challenge of joining dissimilar materials arises. In this study, laser microwelding (LMW) of crossed Pt-10 pct Ir to 316 LVM SS wires was performed and the weldability of these materials was determined. The joint geometry, joining mechanism, joint breaking force (JBF), and fracture modes were investigated using optical microscopy, scanning electron microscopy (SEM), energy-dispersive X-ray spectroscopy (EDX), and microtensile testing. It was shown that the mechanisms of joint formation transitioned from (1) brazing, (2) a combination of brazing and fusion welding, and (3) fusion welding with increasing pulsed laser energy. The joints demonstrated various tensile failure modes including (1) interfacial failure below a peak power of 0.24 kW, (2) partial interfacial failure that propagated into the Pt-Ir wire, (3) failure in the Pt-Ir wire, and (4) failure in the SS wire due to porosity and severe undercutting caused by overwelding. During this study, the optimal laser peak power range was identified to produce joints with good joint geometry and 90 pct of the tensile strength of the Pt-10 pct Ir wire.

  16. CARBON BLACK DISPERSION PRE-PLATING TECHNOLOGY FOR PRINTED WIRE BOARD MANUFACTURING

    EPA Science Inventory

    This evaluation addresses the product quality, waste reduction, and economic issues involved in replacing electroless copper with a carbon black dispersion technology. McCurdy Circuits of Orange County, California, currently has both processes in operation. McCurdy has found that...

  17. CARBON BLACK DISPERSION PRE-PLATING TECHNOLOGY FOR PRINTED WIRE BOARD MANUFACTURING

    EPA Science Inventory

    This evaluation addresses the product quality, waste reduction, and economic issues involved in replacing electroless copper with a carbon black dispersion technology. McCurdy Circuits of Orange County, California, currently has both processes in operation. McCurdy has found that...

  18. Carbon nanotube synthesis: from large-scale production to atom-by-atom growth

    NASA Astrophysics Data System (ADS)

    Journet, Catherine; Picher, Matthieu; Jourdain, Vincent

    2012-04-01

    The extraordinary electronic, thermal and mechanical properties of carbon nanotubes (CNTs) closely relate to their structure. They can be seen as rolled-up graphene sheets with their electronic properties depending on how this rolling up is achieved. However, this is not the way they actually grow. Various methods are used to produce carbon nanotubes. They all have in common three ingredients: (i) a carbon source, (ii) catalyst nanoparticles and (iii) an energy input. In the case where the carbon source is provided in solid form, one speaks about ‘high temperature methods’ because they involve the sublimation of graphite which does not occur below 3200 °C. The first CNTs were synthesized by these techniques. For liquid or gaseous phases, the generic term of ‘medium or low temperature methods’ is used. CNTs are now commonly produced by these latter techniques at temperatures ranging between 350 and 1000 °C, using metal nanoparticles that catalyze the decomposition of the gaseous carbon precursor and make the growth of nanotubes possible. The aim of this review article is to give a general overview of all these methods and an understanding of the CNT growth process.

  19. Catalytic conversion of alcohols having at least three carbon atoms to hydrocarbon blendstock

    DOEpatents

    Narula, Chaitanya K.; Davison, Brian H.

    2015-11-13

    A method for producing a hydrocarbon blendstock, the method comprising contacting at least one saturated acyclic alcohol having at least three and up to ten carbon atoms with a metal-loaded zeolite catalyst at a temperature of at least 100°C and up to 550°C, wherein the metal is a positively-charged metal ion, and the metal-loaded zeolite catalyst is catalytically active for converting the alcohol to the hydrocarbon blendstock, wherein the method directly produces a hydrocarbon blendstock having less than 1 vol % ethylene and at least 35 vol % of hydrocarbon compounds containing at least eight carbon atoms.

  20. The influence of the atomic structure of basal planes on interplanar distance in pyrolytic carbon materials

    NASA Astrophysics Data System (ADS)

    Borgardt, N. I.; Prihodko, A. S.; Seibt, M.

    2016-12-01

    The atomic structure of carbon materials is studied using the example of pyrocarbon and boronrich pyrocarbon by means of the method of reconstruction of the wave function in transmission electron microscopy. It is shown that the digital processing of the phase distributions of these functions allows us to find the average distance between the basal planes. Using the method of molecular dynamics for the formation of the test structures and obtaining for them the calculated phase distributions, the effect of depletion of the basal planes of the carbon atoms on the interplanar distance in the pyrocarbon materials is quantified.

  1. Coke formation and carbon atom economy of methanol-to-olefins reaction.

    PubMed

    Wei, Yingxu; Yuan, Cuiyu; Li, Jinzhe; Xu, Shutao; Zhou, You; Chen, Jingrun; Wang, Quanyi; Xu, Lei; Qi, Yue; Zhang, Qing; Liu, Zhongmin

    2012-05-01

    The methanol-to-olefins (MTO) process is becoming the most important non-petrochemical route for the production of light olefins from coal or natural gas. Maximizing the generation of the target products, ethene and propene, and minimizing the production of byproducts and coke, are major considerations in the efficient utilization of the carbon resource of methanol. In the present work, the heterogeneous catalytic conversion of methanol was evaluated by performing simultaneous measurements of the volatile products generated in the gas phase and the confined coke deposition in the catalyst phase. Real-time and complete reaction profiles were plotted to allow the comparison of carbon atom economy of methanol conversion over the catalyst SAPO-34 at varied reaction temperatures. The difference in carbon atom economy was closely related with the coke formation in the SAPO-34 catalyst. The confined coke compounds were determined. A new type of confined organics was found, and these accounted for the quick deactivation and low carbon atom economy under low-reaction-temperature conditions. Based on the carbon atom economy evaluation and coke species determination, optimized operating conditions for the MTO process are suggested; these conditions guarantee high conversion efficiency of methanol.

  2. Atomically isolated nickel species anchored on graphitized carbon for efficient hydrogen evolution electrocatalysis

    PubMed Central

    Fan, Lili; Liu, Peng Fei; Yan, Xuecheng; Gu, Lin; Yang, Zhen Zhong; Yang, Hua Gui; Qiu, Shilun; Yao, Xiangdong

    2016-01-01

    Hydrogen production through electrochemical process is at the heart of key renewable energy technologies including water splitting and hydrogen fuel cells. Despite tremendous efforts, exploring cheap, efficient and durable electrocatalysts for hydrogen evolution still remains as a great challenge. Here we synthesize a nickel–carbon-based catalyst, from carbonization of metal-organic frameworks, to replace currently best-known platinum-based materials for electrocatalytic hydrogen evolution. This nickel-carbon-based catalyst can be activated to obtain isolated nickel atoms on the graphitic carbon support when applying electrochemical potential, exhibiting highly efficient hydrogen evolution performance with high exchange current density of 1.2 mA cm−2 and impressive durability. This work may enable new opportunities for designing and tuning properties of electrocatalysts at atomic scale for large-scale water electrolysis. PMID:26861684

  3. Atomically isolated nickel species anchored on graphitized carbon for efficient hydrogen evolution electrocatalysis

    NASA Astrophysics Data System (ADS)

    Fan, Lili; Liu, Peng Fei; Yan, Xuecheng; Gu, Lin; Yang, Zhen Zhong; Yang, Hua Gui; Qiu, Shilun; Yao, Xiangdong

    2016-02-01

    Hydrogen production through electrochemical process is at the heart of key renewable energy technologies including water splitting and hydrogen fuel cells. Despite tremendous efforts, exploring cheap, efficient and durable electrocatalysts for hydrogen evolution still remains as a great challenge. Here we synthesize a nickel-carbon-based catalyst, from carbonization of metal-organic frameworks, to replace currently best-known platinum-based materials for electrocatalytic hydrogen evolution. This nickel-carbon-based catalyst can be activated to obtain isolated nickel atoms on the graphitic carbon support when applying electrochemical potential, exhibiting highly efficient hydrogen evolution performance with high exchange current density of 1.2 mA cm-2 and impressive durability. This work may enable new opportunities for designing and tuning properties of electrocatalysts at atomic scale for large-scale water electrolysis.

  4. Uniaxial magnetic anisotropy energy of Fe wires embedded in carbon nanotubes.

    PubMed

    Muñoz, Francisco; Mejía-López, Jose; Pérez-Acle, Tomas; Romero, Aldo H

    2010-05-25

    In this work, we analyze the magnetic anisotropy energy (MAE) of Fe cylinders embedded within zigzag carbon nanotubes, by means of ab initio calculations. To see the influence of the confinement, we fix the Fe cylinder diameter and we follow the changes of the MAE as a function of the diameter of the nanotube, which contains the Fe cylinder. We find that the easy axis changes from parallel to perpendicular, with respect to the cylinder axis. The orientation change depends quite strongly on the confinement, which indicates a nontrivial dependence of the magnetization direction as function of the nanotube diameter. We also find that the MAE is affected by where the Fe cylinder sits with respect to the carbon nanotube, and the coupling between these two structures could also dominate the magnetic response. We analyze the thermal stability of the magnetization orientation of the Fe cylinder close to room temperature.

  5. Understanding the Mechanisms Enabling an Ultra-high Efficiency Moving Wire Interface for Real-time Carbon 14 Accelerator Mass Spectrometry Quantitation of Samples Suspended in Solvent

    NASA Astrophysics Data System (ADS)

    Thomas, Avraham Thaler

    Carbon 14 (14C) quantitation by accelerator mass spectrometry (AMS) is a powerfully sensitive and uniquely quantitative tool for tracking labeled carbonaceous molecules in biological systems. This is due to 14C's low natural abundance of 1 ppt, the nominal difference in biological activity between an unlabeled and a 14C-labeled molecule, and the ability of AMS to measure isotopic ratios independently of a sample's other characteristics. To make AMS more broadly accessible, a moving wire interface for real-time coupling of high pressure liquid chromatography (HPLC) to AMS and high throughput AMS quantitation of minute single samples has been developed. Prior to this work, samples needed to be converted to solid carbon before measurement. This conversion process has many steps and requires that the sample size be large enough to allow precise handling of the resulting graphite. These factors make the process susceptible to error and time consuming, as well as requiring 0.5 ug of carbon. Samples which do not contain enough carbon, such as HPLC fractions, must be bulked up. This adds background and increases effort. The moving wire interface overcomes these limitations by automating sample processing. Samples placed on the wire are transported through a solvent removal stage followed by a combustion stage after which the combustion products are directed to a gas accepting ion source. The ion source converts the carbon from the CO2 combustion product into C ions, from which an isotopic ratio can be determined by AMS. Although moving wire interfaces have been implemented for various tasks since 1964, the efficiency of these systems at transferring fluid from an HPLC to the wire was only 3%, the efficiency of transferring combustion products from the combustion oven to ion source was only 30%, the flow and composition of the carrier gas from the combustion oven to the ion source needed to be optimized for coupling to an AMS gas accepting ion source and the drying ovens

  6. Single Pd atoms in activated carbon fibers and their contribution to hydrogen storage

    SciTech Connect

    Contescu, Cristian I; van Benthem, Klaus; Li, Sa; Bonifacio, Cecile S; Pennycook, Stephen J; Jena, Puru; Gallego, Nidia C

    2011-01-01

    Palladium-modified activated carbon fibers (Pd-ACF) were synthesized by meltspinning, carbonization and activation of an isotropic pitch carbon precursor premixed with an organometallic Pd compound. The hydrogen uptake at 25 oC and 20 bar on Pd- ACF exceeded the expected capacity based solely on Pd hydride formation and hydrogen physisorption on the microporous carbon support. Aberration-corrected scanning transmission electron microscopy (STEM) with sub- ngstrom spatial resolution provided unambiguous identification of isolated Pd atoms occurring in the carbon matrix that coexist with larger Pd particles. First principles calculations revealed that each single Pd atom can form Kubas-type complexes by binding up to three H2 molecules in the pressure range of adsorption measurements. Based on Pd atom concentration determined from STEM images, the contribution of various mechanisms to the excess hydrogen uptake measured experimentally was evaluated. With consideration of Kubas binding as a viable mechanism (along with hydride formation and physisorption to carbon support) the role of hydrogen spillover in this system may be smaller than previously thought.

  7. Evaluation of a carbon-rod atomizer for routine determination of trace metals by atomic-absorption spectroscopy applications to analysis of lubricating oil and crude oil.

    PubMed

    Hall, G; Bratzel, M P; Chakrabarti, C L

    1973-08-01

    A carbon-rod atomizer (CRA) fitted with a 'mini-Massmann' carbon rod was evaluated for routine analysis of petroleum and petroleum products for trace metal content by atomic-absorption spectroscopy. Aspects investigated included sensitivity, detection limit, effect of solvent type, and interferences. The results of analysis of oil samples with this technique were compared with those obtained by other techniques. Metals studied were silver, copper, iron, nickel, and lead. Sensitivity and detection limit values obtained with the CRA were similar to those obtained with the carbon-filament atomizer. Strong 'solvent effects' were observed as well as interference by cations. On the basis of this study, design changes for the CRA are suggested, with the object of minimizing 'solvent effects' and interferences, increasing the atomization efficiency, and increasing the residence time of the atomic vapour in the optical path of the instrumental system.

  8. A New Method for Carbon Isotopic Analysis of Nanogram Quantities of Carbon from Dissolved Chitin Using A Spooling-wire Microcombustion Interface

    NASA Astrophysics Data System (ADS)

    Zhao, Y.; Nelson, D. M.; Clegg, B. F.; Berry, J.; Hu, F.

    2016-12-01

    δ13C analysis of specific taxa or compounds is commonly used for investigating past environmental change, including methane dynamics in lakes. However, most analytical methods require large sample sizes, prohibiting routine analysis of fossils of individual taxa found in sediment deposits. For example, 10-100 individual head capsules of fossil midges are required for δ13C analysis using an elemental analyzer (EA) interfaced with an isotope-ratio mass spectrometer (IRMS). Here we present a new method that uses a spooling-wire microcombustion (SWiM) device interfaced with an IRMS for measuring δ13C values of carbon dissolved from individual head capsules of chitinous aquatic zooplankton. We extracted chitin (a major biochemical component of insect exoskeleton) from modern midge material obtained from four commercial suppliers. We first assessed the effects of sample treatments on carbon yields and δ13C values of dissolved chitin by varying the concentration of HCl used for dissolution, the duration of reaction in HCl, and the temperature of dissolution. We then investigated potential fractionation of carbon isotopes associated with chitin dissolution, by comparing δ13C values of dissolved chitin obtained via SWiM-IRMS with those from untreated head capsules obtained via a EA-IRMS. The average δ13C values of untreated head capsules varied between -25.1 and -30.1‰. Higher acid concentrations and temperatures, as well as longer reaction times, increased dissolution of carbon from the head capsules and the precision of δ13C values. For example, carbon yields from reaction of head capsules with 6N HCl at 25°C increased from 1 to 3 Vs as reaction times increased from 1 to 24 hours. Acid concentration and reaction time had the greatest influence on carbon yields and isotopic precision. The δ13C values of dissolved chitin mirrored the δ13C values of untreated head capsules with minimal offset of absolute values, which suggests no systematic fractionation

  9. Thermodynamic and kinetic control of the lateral Si wire growth

    SciTech Connect

    Dedyulin, Sergey N. Goncharova, Lyudmila V.

    2014-03-24

    Reproducible lateral Si wire growth has been realized on the Si (100) surface. In this paper, we present experimental evidence showing the unique role that carbon plays in initiating lateral growth of Si wires on a Si (100) substrate. Once initiated in the presence of ≈5 ML of C, lateral growth can be achieved in the range of temperatures, T = 450–650 °C, and further controlled by the interplay of the flux of incoming Si atoms with the size and areal density of Au droplets. Critical thermodynamic and kinetic aspects of the growth are discussed in detail.

  10. Influence of Nb Additions on Microstructural Evolution of a V-Microalloyed High-Carbon Wire Steel During Patenting

    NASA Astrophysics Data System (ADS)

    Miller, Stephanie L.; de Moor, Emmanuel

    2014-08-01

    This study investigated the feasibility of microalloying strategies for improving the strength of high-carbon wire products subjected to industrial patenting heat treatments for two eutectoid steels: a 0.8C-0.5Mn-0.2Cr-0.08 V alloy (wt.%) and the same composition with an additional 100 ppm Nb. A Gleeble 3500 thermomechanical simulator (Dynamic Systems Inc., Poestenkill, NY, USA) was used to perform heat treatments consisting of a 30 s austenitization at 1093 °C, 950 °C, or 880 °C followed by a 15 s isothermal transformation step at 650 °C, 625 °C, 600 °C, or 575 °C. Vickers hardness, field-emission scanning electron microscopy, and pearlite interlamellar spacing measurements were conducted to assess the effects of the heat treatments. Niobium microalloying additions were found to provide no hardness increase, but they extended the pearlitic regime to lower isothermal transformation temperatures.

  11. EBSD analysis of tungsten-filament carburization during the hot-wire CVD of multi-walled carbon nanotubes.

    PubMed

    Oliphant, Clive J; Arendse, Christopher J; Camagu, Sigqibo T; Swart, Hendrik

    2014-02-01

    Filament condition during hot-wire chemical vapor deposition conditions of multi-walled carbon nanotubes is a major concern for a stable deposition process. We report on the novel application of electron backscatter diffraction to characterize the carburization of tungsten filaments. During the synthesis, the W-filaments transform to W2C and WC. W-carbide growth followed a parabolic behavior corresponding to the diffusion of C as the rate-determining step. The grain size of W, W2C, and WC increases with longer exposure time and increasing filament temperature. The grain size of the recrystallizing W-core and W2C phase grows from the perimeter inwardly and this phenomenon is enhanced at filament temperatures in excess of 1,400°C. Cracks appear at filament temperatures >1,600°C, accompanied by a reduction in the filament operational lifetime. The increase of the W2C and recrystallized W-core grain size from the perimeter inwardly is ascribed to a thermal gradient within the filament, which in turn influences the hardness measurements and crack formation.

  12. Generating Carbon Tubes and Films from Lead and Cadmium Wires During Underwater Spark Discharges

    SciTech Connect

    Taka-aki Matsumoto

    2000-11-12

    In general, no nuclear reactions between charged particles would be possible in a low-energy region. However, many experimental data of nuclear transmutation with low energy were recently reported related to so-called cold fusion. This paper describes some kinds of low-energy nuclear reactions (LENRs), which could be induced during an underwater spark discharge (USD) with only {approx}120 V. The mechanisms of the extraordinary nuclear transmutation can be explained by the Nattoh model. The electron bonding of sparks, which was a special state of atomic clusters, was so strong that multibody nuclear reactions such as nuclear collapse [called electro-nuclear collapse (ENC)] could take place in the spark. Because of ENC, completely broken materials could be again regenerated as conventional elements. The film product was considered to be made by a spherical explosion of a small black hole and the tube by a rotational eruption of a small white hole, both of which resulted from ENC.

  13. The Reception of J. H. van't Hoff's Theory of the Asymmetric Carbon Atom

    ERIC Educational Resources Information Center

    Snelders, H. A. M.

    1974-01-01

    Discusses Jacobus Henricus van't Hoff's revolutionary theory of the asymmetric carbon atom and its early reception among his contemporaries in the Netherlands. Indicates that the extension of the new idea to practical problems gives the impetus to the development of stereochemistry. (CC)

  14. Atomic scale observation of oxygen delivery during silver-oxygen nanoparticle catalysed oxidation of carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Yue, Yonghai; Yuchi, Datong; Guan, Pengfei; Xu, Jia; Guo, Lin; Liu, Jingyue

    2016-07-01

    To probe the nature of metal-catalysed processes and to design better metal-based catalysts, atomic scale understanding of catalytic processes is highly desirable. Here we use aberration-corrected environmental transmission electron microscopy to investigate the atomic scale processes of silver-based nanoparticles, which catalyse the oxidation of multi-wall carbon nanotubes. A direct semi-quantitative estimate of the oxidized carbon atoms by silver-based nanoparticles is achieved. A mechanism similar to the Mars-van Krevelen process is invoked to explain the catalytic oxidation process. Theoretical calculations, together with the experimental data, suggest that the oxygen molecules dissociate on the surface of silver nanoparticles and diffuse through the silver nanoparticles to reach the silver/carbon interfaces and subsequently oxidize the carbon. The lattice distortion caused by oxygen concentration gradient within the silver nanoparticles provides the direct evidence for oxygen diffusion. Such direct observation of atomic scale dynamics provides an important general methodology for investigations of catalytic processes.

  15. Atomic scale observation of oxygen delivery during silver–oxygen nanoparticle catalysed oxidation of carbon nanotubes

    PubMed Central

    Yue, Yonghai; Yuchi, Datong; Guan, Pengfei; Xu, Jia; Guo, Lin; Liu, Jingyue

    2016-01-01

    To probe the nature of metal-catalysed processes and to design better metal-based catalysts, atomic scale understanding of catalytic processes is highly desirable. Here we use aberration-corrected environmental transmission electron microscopy to investigate the atomic scale processes of silver-based nanoparticles, which catalyse the oxidation of multi-wall carbon nanotubes. A direct semi-quantitative estimate of the oxidized carbon atoms by silver-based nanoparticles is achieved. A mechanism similar to the Mars–van Krevelen process is invoked to explain the catalytic oxidation process. Theoretical calculations, together with the experimental data, suggest that the oxygen molecules dissociate on the surface of silver nanoparticles and diffuse through the silver nanoparticles to reach the silver/carbon interfaces and subsequently oxidize the carbon. The lattice distortion caused by oxygen concentration gradient within the silver nanoparticles provides the direct evidence for oxygen diffusion. Such direct observation of atomic scale dynamics provides an important general methodology for investigations of catalytic processes. PMID:27406595

  16. The Reception of J. H. van't Hoff's Theory of the Asymmetric Carbon Atom

    ERIC Educational Resources Information Center

    Snelders, H. A. M.

    1974-01-01

    Discusses Jacobus Henricus van't Hoff's revolutionary theory of the asymmetric carbon atom and its early reception among his contemporaries in the Netherlands. Indicates that the extension of the new idea to practical problems gives the impetus to the development of stereochemistry. (CC)

  17. Atom Vacancies on a Carbon Nanotube: To What Extent Can We Simulate their Effects?

    PubMed

    Kroes, Jaap M H; Pietrucci, Fabio; van Duin, Adri C T; Andreoni, Wanda

    2015-07-14

    Atom vacancies are intrinsic defects of carbon nanotubes. Using a zigzag nanotube as reference, this paper focuses on the comparison of calculations performed within density functional theory and a number of classical force fields widely used for carbon systems. The results refer to single and double vacancies and, in particular, to the induced structural changes, the formation energies, and the energy barriers relative to elementary processes such as reconstruction, migration, and coalescence. Characterization of these processes is remarkably different in the different approaches. These findings are meant to contribute to the construction of DFT-based classical schemes for carbon nanostructures.

  18. Phase transitions of adsorbed atoms on the surface of a carbon nanotube.

    PubMed

    Wang, Zenghui; Wei, Jiang; Morse, Peter; Dash, J Gregory; Vilches, Oscar E; Cobden, David H

    2010-01-29

    Phase transitions of adsorbed atoms and molecules on two-dimensional substrates are well explored, but similar transitions in the one-dimensional limit have been more difficult to study experimentally. Suspended carbon nanotubes can act as nanoscale resonators with remarkable electromechanical properties and the ability to detect adsorption at the level of single atoms. We used single-walled carbon nanotube resonators to study the phase behavior of adsorbed argon and krypton atoms as well as their coupling to the substrate electrons. By monitoring the resonance frequency in the presence of gases, we observed the formation of monolayers on the cylindrical surface, phase transitions within them, and simultaneous modification of the electrical conductance.

  19. Interaction of Si atoms and Si-based radicals with carbon nanotubes and graphene monolayers

    NASA Astrophysics Data System (ADS)

    Chang, Kiseok; Berber, Savas; Tománek, David

    2008-03-01

    We use ab initio density functional calculations to study the interaction of Si atoms and Si-based radicals, such as SiH3, with single-wall carbon nanotubes and graphene monolayers. We find that both Si atoms and radicals form a strong chemisorption bond, accompanied by a small relaxation and a locally increased sp^3 bond character of the graphitic nanostructure. We identify the optimum adsorption geometries at different adsorbate coverages and adsorbate-related changes in the electronic structure and vibration spectra of the systems. We propose that successful functionalization of carbon nanotubes or graphene by Si atoms or Si-based radicals can be verified by studying changes in the radial breathing mode of nanotubes and the G-band of graphitic nanocarbons using Raman spectroscopy.

  20. ATOMIC-LEVEL IMAGING OF CO2 DISPOSAL AS A CARBONATE MINERAL: OPTIMIZING REACTION PROCESS DESIGN

    SciTech Connect

    M.J. McKelvy; R. Sharma; A.V.G. Chizmeshya; H. Bearat; R.W. Carpenter

    2000-08-01

    Fossil fuels, especially coal, can support the energy demands of the world for centuries to come, if the environmental problems associated with CO{sub 2} emissions can be overcome. Permanent and safe methods for CO{sub 2} capture and disposal/storage need to be developed. Mineralization of stationary-source CO{sub 2} emissions as carbonates can provide such safe capture and long-term sequestration. Mg-rich lamellar-hydroxide based minerals (e.g., brucite and serpentine) offer a class of widely available, low-cost materials, with intriguing mineral carbonation potential. Carbonation of such materials inherently involves dehydroxylation, which can disrupt the material down to the atomic level. As such, controlled dehydroxylation before and/or during carbonation may provide an important parameter for enhancing carbonation reaction processes. Mg(OH){sub 2} was chosen as the model material for investigating lamellar hydroxide mineral dehydroxylation/carbonation mechanisms due to (i) its structural and chemical simplicity, (ii) interest in Mg(OH){sub 2} gas-solid carbonation as a potentially cost-effective CO{sub 2} mineral sequestration process component, and (iii) its structural and chemical similarity to other lamellar-hydroxide-based minerals (e.g., serpentine-based minerals) whose carbonation reaction processes are being explored due to their low-cost CO{sub 2} sequestration potential. Fundamental understanding of the mechanisms that govern dehydroxylation/carbonation processes is essential for cost optimization of any lamellar-hydroxide-based mineral carbonation sequestration process.

  1. Stress-rupture strength and microstructural stability of tungsten-hafnium-carbon-wire reinforced superalloy composites

    NASA Technical Reports Server (NTRS)

    Petrasek, D. W.; Signorelli, R. A.

    1974-01-01

    Tungsten-hafnium-carbon - superalloy composites were found to be potentially useful for turbine blade applications on the basis of stress-rupture strength. The 100- and 1000-hr rupture strengths calculated for 70 vol. % fiber composites based on test data at 1090C (2000F) were 420 and 280 MN/m2 (61,000 and 41,000 psi, respectively). The investigation indicated that, with better quality fibers, composites having 100- and 1000-hr rupture strengths of 570 and 370 MN/m2 (82,000 and 54,000 psi, respectively), may be obtained. Metallographic studies indicated sufficient fiber-matrix compatibility for 1000 hr or more at 1090C (2000F).

  2. Drawing carbon nanotubes from liquid: a room temperature process for fabrication of CNT probes and wires

    NASA Astrophysics Data System (ADS)

    Tang, Jie; Geng, Huaizhi; Qiu, Qi; Go, Bao; Qin, Lu-Chang; Zhou, Otto

    2003-03-01

    Carbon nanotubes (CNTs) have unique material properties that are promising for a wide range of technological applications. Although advance has been made in synthesis of raw CNT materials, the lack of efficient processes for assembly and integration of the CNTs into functional forms has hindered the development of CNT-based devices. Electrophoresis is a high throughput process for deposition of micro- and nano-meter scale objects [1]. Here we report an efficient electrophoresis process to assemble pre-formed CNTs into probes and fibers. The advantage of this method is that it is a batch process that operates at room temperature and can be automated. The structure and morphology of the CNT structures thus fabricated will be presented and will be compared with those fabricated by other methods. [1] B. Gao et al., Adv. Mater, Vol. 13 (11), 816 (2001).

  3. Spatial Distributions of Metal Atoms During Carbon SWNTs Formation: Measurements and Modelling

    NASA Technical Reports Server (NTRS)

    Cau, M.; Dorval, N.; Attal-Tretout, B.; Cochon, J. L.; Loiseau, A.; Farhat, S.; Hinkov, I.; Scott, C. D.

    2004-01-01

    Experiments and modelling have been undertaken to clarify the role of metal catalysts during single-wall carbon nanotube formation. For instance, we wonder whether the metal catalyst is active as an atom, a cluster, a liquid or solid nanoparticle [1]. A reactor has been developed for synthesis by continuous CO2-laser vaporisation of a carbon-nickel-cobalt target in laminar helium flow. The laser induced fluorescence technique [2] is applied for local probing of gaseous Ni, Co and CZ species throughout the hot carbon flow of the target heated up to 3500 K. A rapid depletion of C2 in contrast to the spatial extent of metal atoms is observed in the plume (Fig. 1). This asserts that C2 condenses earlier than Ni and Co atoms.[3, 4]. The depletion is even faster when catalysts are present. It may indicate that an interaction between metal atoms and carbon dimers takes place in the gas as soon as they are expelled from the target surface. Two methods of modelling are used: a spatially I-D calculation developed originally for the arc process [5], and a zero-D time dependent calculation, solving the chemical kinetics along the streamlines [6]. The latter includes Ni cluster formation. The peak of C2 density is calculated close to the target surface where the temperature is the highest. In the hot region, C; is dominant. As the carbon products move away from the target and mix with the ambient helium, they recombine into larger clusters, as demonstrated by the peak of C5 density around 1 mm. The profile of Ni-atom density compares fairly well with the measured one (Fig. 2). The early increase is due to the drop of temperature, and the final decrease beyond 6 mm results from Ni cluster formation at the eutectic temperature (approx.1600 K).

  4. Spatial Distributions of Metal Atoms During Carbon SWNTs Formation: Measurements and Modelling

    NASA Technical Reports Server (NTRS)

    Cau, M.; Dorval, N.; Attal-Tretout, B.; Cochon, J. L.; Loiseau, A.; Farhat, S.; Hinkov, I.; Scott, C. D.

    2004-01-01

    Experiments and modelling have been undertaken to clarify the role of metal catalysts during single-wall carbon nanotube formation. For instance, we wonder whether the metal catalyst is active as an atom, a cluster, a liquid or solid nanoparticle [1]. A reactor has been developed for synthesis by continuous CO2-laser vaporisation of a carbon-nickel-cobalt target in laminar helium flow. The laser induced fluorescence technique [2] is applied for local probing of gaseous Ni, Co and CZ species throughout the hot carbon flow of the target heated up to 3500 K. A rapid depletion of C2 in contrast to the spatial extent of metal atoms is observed in the plume (Fig. 1). This asserts that C2 condenses earlier than Ni and Co atoms.[3, 4]. The depletion is even faster when catalysts are present. It may indicate that an interaction between metal atoms and carbon dimers takes place in the gas as soon as they are expelled from the target surface. Two methods of modelling are used: a spatially I-D calculation developed originally for the arc process [5], and a zero-D time dependent calculation, solving the chemical kinetics along the streamlines [6]. The latter includes Ni cluster formation. The peak of C2 density is calculated close to the target surface where the temperature is the highest. In the hot region, C; is dominant. As the carbon products move away from the target and mix with the ambient helium, they recombine into larger clusters, as demonstrated by the peak of C5 density around 1 mm. The profile of Ni-atom density compares fairly well with the measured one (Fig. 2). The early increase is due to the drop of temperature, and the final decrease beyond 6 mm results from Ni cluster formation at the eutectic temperature (approx.1600 K).

  5. Multiphoton inner-shell ionization of the carbon atom

    NASA Astrophysics Data System (ADS)

    Rey, H. F.; van der Hart, H. W.

    2015-07-01

    We apply time-dependent R -matrix theory to study inner-shell ionization of C atoms in ultrashort high-frequency light fields with a photon energy between 170 and 245 eV. At an intensity of 1017 W /cm2, ionization is dominated by single-photon emission of a 2 ℓ electron, with two-photon emission of a 1 s electron accounting for about 2-3% of all emission processes, and two-photon emission of 2 ℓ contributing about 0.5-1%. Three-photon emission of a 1 s electron is estimated to contribute about 0.01-0.03%. Around a photon energy of 225 eV, two-photon emission of a 1 s electron, leaving C+ in either 1 s 2 s 2 p3 or 1 s 2 p4 , is resonantly enhanced by intermediate 1 s 2 s22 p3 states. The results demonstrate the capability of time-dependent R -matrix theory to describe inner-shell ionization processes including rearrangement of the outer electrons.

  6. A new material with atomized cobalt-multiwalled carbon nanotubes: a possible substitute for human implants.

    PubMed

    Joshi, Bharat; Gupta, Sachin; Kalra, Nitin; Gudyka, Russell; Santhanam, K S V

    2010-06-01

    A new material composed of atomized cobalt-multiwalled carbon nanotube has been produced and characterized by thermogravimetric analysis and polarization studies to estimate its lifetime. This does not show cobalt thermal oxidation suggesting that it is confined inside the carbon nanotube matrix. The density functional calculations in the literature predict a strong interaction leading to higher hybridization of cobalt atom and carbon nanotubes. A detailed investigation of the corrosion measurements shows that the new material of thickness 0.8 mm, 1 mm, 1.5 mm and 2 mm would last for 31, 39, 60 and 79 years and it would substitute with cobalt-chromium alloy that is used as a load bearing implant for patients with knee pain or partial denture implant.

  7. Bias in bonding behavior among boron, carbon, and nitrogen atoms in ion implanted a-BN, a-BC, and diamond like carbon films

    SciTech Connect

    Genisel, Mustafa Fatih; Uddin, Md. Nizam; Say, Zafer; Bengu, Erman; Kulakci, Mustafa; Turan, Rasit; Gulseren, Oguz

    2011-10-01

    In this study, we implanted N{sup +} and N{sub 2}{sup +} ions into sputter deposited amorphous boron carbide (a-BC) and diamond like carbon (DLC) thin films in an effort to understand the chemical bonding involved and investigate possible phase separation routes in boron carbon nitride (BCN) films. In addition, we investigated the effect of implanted C{sup +} ions in sputter deposited amorphous boron nitride (a-BN) films. Implanted ion energies for all ion species were set at 40 KeV. Implanted films were then analyzed using x-ray photoelectron spectroscopy (XPS). The changes in the chemical composition and bonding chemistry due to ion-implantation were examined at different depths of the films using sequential ion-beam etching and high resolution XPS analysis cycles. A comparative analysis has been made with the results from sputter deposited BCN films suggesting that implanted nitrogen and carbon atoms behaved very similar to nitrogen and carbon atoms in sputter deposited BCN films. We found that implanted nitrogen atoms would prefer bonding to carbon atoms in the films only if there is no boron atom in the vicinity or after all available boron atoms have been saturated with nitrogen. Implanted carbon atoms also preferred to either bond with available boron atoms or, more likely bonded with other implanted carbon atoms. These results were also supported by ab-initio density functional theory calculations which indicated that carbon-carbon bonds were energetically preferable to carbon-boron and carbon-nitrogen bonds.

  8. First principles study of foreign interstitial atom (carbon, nitrogen) interactions with intrinsic defects in tungsten

    NASA Astrophysics Data System (ADS)

    Kong, Xiang-Shan; You, Yu-Wei; Song, Chi; Fang, Q. F.; Chen, Jun-Ling; Luo, G.-N.; Liu, C. S.

    2012-11-01

    We performed a series of first-principles calculations to investigate the foreign interstitial atom (FIA) interactions with intrinsic defects in tungsten. We found the following: (i) The introduction of the FIA reduces the vacancy formation energy, resulting in the increase of the equilibrium concentration of vacancies. (ii) The positive binding energy between two FIAs suggests that the FIA can attract other FIAs. (iii) The FIA is easily trapped by the vacancy, and a single vacancy can accommodate up to 4 and 6 atoms in a stable manner for carbon and nitrogen, respectively. (iv) There is an attraction interaction between the FIA and the self-interstitial atom (SIA), and the FIA can reduce the SIA jump frequency and enhance the formation of SIA clusters in tungsten. Moreover, the difference between carbon and nitrogen are also discussed with respect to the formation of FIA-FIA covalent bond and the accumulation around the saturated -, where d is the ith nearest-neighbor (inn) solute-tungsten distance before relaxation and ▵di=(di-d) is the change in distance due to relaxation. The calculated relaxations are presented in Table 3. The relaxations of 1nn of octahedral interstitial carbon and nitrogen atoms are 23.30% and 22.42%, respectively, which are greatly larger than the relaxations of other nearest-neighbor atoms (0.1-2%). These results indicate that the influence range of FIA is very local. The lattice distortions introduced by the octahedral interstitial carbon or nitrogen atom can be characterized by determining the dipolar tensor from Kanzaki forces. Here, to obtain the dipolar tensor, we adopt a similar calculation procedure as used in Ref. [14], where the dipolar tensor P is calculated from the Kanzaki forces on all the tungsten atoms. The detailed procedure could be found in Ref. [14]. Due to the symmetry of the configuration, the dipolar tensor has two independent values: P11 and P33, which are listed in Table 3. Similarly with Ref. [14], approximate

  9. ATOMIC-LEVEL IMAGING OF CO2 DISPOSAL AS A CARBONATE MINERAL: OPTIMIZING REACTION PROCESS DESIGN

    SciTech Connect

    M.J. McKelvy; R. Sharma; A.V.G. Chizmeshya; H. Bearat; R.W. Carpenter; K. Streib

    1999-09-01

    Fossil fuels, especially coal, can support the energy demands of the world for centuries to come, if the environmental problems associated with CO{sub 2} emissions can be overcome. Permanent and safe methods for CO{sub 2} capture and disposal/storage need to be developed. Mineralization of stationary-source CO{sub 2} emissions as carbonates can provide such safe capture and long-term sequestration. Mg(OH){sub 2} carbonation is a leading process candidate, which generates the stable naturally occurring mineral magnesite (MgCO{sub 3}) and water. Key to process cost and viability are the carbonation reaction rate and its degree of completion. This process, which involves simultaneous dehydroxylation and carbonation is very promising, but far from optimized. In order to optimize the dehydroxylation/carbonation process, an atomic-level understanding of the mechanisms involved is needed. Since Mg(OH){sub 2} dehydroxylation is intimately associated with the carbonation process, its mechanisms are also of direct interest in understanding and optimizing the process. In the first project year, our investigations have focused on developing an atomic-level understanding of the dehydroxylation/carbonation reaction mechanisms that govern the overall carbonation reaction process in well crystallized material. In years two and three, we will also explore the roles of crystalline defects and impurities. Environmental-cell, dynamic high-resolution transmission electron microscopy has been used to directly observe the dehydroxylation process at the atomic-level for the first time. These observations were combined with advanced computational modeling studies to better elucidate the atomic-level process. These studies were combined with direct carbonation studies to better elucidate dehydroxylation/carbonation reaction mechanisms. Dehydroxylation follows a lamellar nucleation and growth process involving oxide layer formation. These layers form lamellar oxyhydroxide regions, which can

  10. Atomic-layer-deposition-assisted formation of carbon nanoflakes on metal oxides and energy storage application.

    PubMed

    Guan, Cao; Zeng, Zhiyuan; Li, Xianglin; Cao, Xiehong; Fan, Yu; Xia, Xinhui; Pan, Guoxiang; Zhang, Hua; Fan, Hong Jin

    2014-01-29

    Nanostructured carbon is widely used in energy storage devices (e.g., Li-ion and Li-air batteries and supercapacitors). A new method is developed for the generation of carbon nanoflakes on various metal oxide nanostructures by combining atomic layer deposition (ALD) and glucose carbonization. Various metal oxide@nanoflake carbon (MO@f-C) core-branch nanostructures are obtained. For the mechanism, it is proposed that the ALD Al2 O3 and glucose form a composite layer. Upon thermal annealing, the composite layer becomes fragmented and moves outward, accompanied by carbon deposition on the alumina skeleton. When tested as electrochemical supercapacitor electrode, the hierarchical MO@f-C nanostructures exhibit better properties compared with the pristine metal oxides or the carbon coating without ALD. The enhancement can be ascribed to increased specific surface areas and electric conductivity due to the carbon flake coating. This peculiar carbon coating method with the unique hierarchical nanostructure may provide a new insight into the preparation of 'oxides + carbon' hybrid electrode materials for energy storage applications.

  11. The use of carbon suspension as an adjunct to wire localisation of impalpable breast lesions.

    PubMed

    Moss, H A; Barter, S J; Nayagam, M; Lawrence, D; Pittam, M

    2002-10-01

    To determine the accuracy and therapeutic success of localisation of impalpable breast lesions by hookwire with additional lesion marking with carbon suspension to mark screen detected abnormalities requiring surgical excision. Retrospective review of all breast localisation procedures performed in our unit on women with a screen detected abnormality requiring excision over a 7 year period. One hundred and thirty eight women underwent breast localisation procedures. All of the mammographic abnormalities were excised at the initial surgical procedure. The benign to malignant ratio was 1:2. Pre-operative cytology was used to guide the extent of surgical excision, with clear margins in 70 of the 92 patients (75 percent) with malignancy. Twenty patients had further surgery: mastectomy in 7 and further local excision in 14. The localisation procedure was a therapeutic success in the local excision of malignancy in 73 of the 92 patients (79 percent) with malignancy. This method of localisation biopsy is an accurate technique for surgical excision of mammographically detected impalpable abnormalities. The surgeon is able to choose the site of surgical incision to give the best cosmetic result, the lesion is easier to identify at operation and the confidence that the abnormality has been excised is improved.

  12. Silicon solar cell performance deposited by diamond like carbon thin film ;Atomic oxygen effects;

    NASA Astrophysics Data System (ADS)

    Aghaei, Abbas Ail; Eshaghi, Akbar; Karami, Esmaeil

    2017-09-01

    In this research, a diamond-like carbon thin film was deposited on p-type polycrystalline silicon solar cell via plasma-enhanced chemical vapor deposition method by using methane and hydrogen gases. The effect of atomic oxygen on the functioning of silicon coated DLC thin film and silicon was investigated. Raman spectroscopy, field emission scanning electron microscopy, atomic force microscopy and attenuated total reflection-Fourier transform infrared spectroscopy were used to characterize the structure and morphology of the DLC thin film. Photocurrent-voltage characteristics of the silicon solar cell were carried out using a solar simulator. The results showed that atomic oxygen exposure induced the including oxidation, structural changes, cross-linking reactions and bond breaking of the DLC film; thus reducing the optical properties. The photocurrent-voltage characteristics showed that although the properties of the fabricated thin film were decreased after being exposed to destructive rays, when compared with solar cell without any coating, it could protect it in atomic oxygen condition enhancing solar cell efficiency up to 12%. Thus, it can be said that diamond-like carbon thin layer protect the solar cell against atomic oxygen exposure.

  13. Theoretical realization of cluster-assembled hydrogen storage materials based on terminated carbon atomic chains.

    PubMed

    Liu, Chun-Sheng; An, Hui; Guo, Ling-Ju; Zeng, Zhi; Ju, Xin

    2011-01-14

    The capacity of carbon atomic chains with different terminations for hydrogen storage is studied using first-principles density functional theory calculations. Unlike the physisorption of H(2) on the H-terminated chain, we show that two Li (Na) atoms each capping one end of the odd- or even-numbered carbon chain can hold ten H(2) molecules with optimal binding energies for room temperature storage. The hybridization of the Li 2p states with the H(2)σ orbitals contributes to the H(2) adsorption. However, the binding mechanism of the H(2) molecules on Na arises only from the polarization interaction between the charged Na atom and the H(2). Interestingly, additional H(2) molecules can be bound to the carbon atoms at the chain ends due to the charge transfer between Li 2s2p (Na 3s) and C 2p states. More importantly, dimerization of these isolated metal-capped chains does not affect the hydrogen binding energy significantly. In addition, a single chain can be stabilized effectively by the C(60) fullerenes termination. With a hydrogen uptake of ∼10 wt.% on Li-coated C(60)-C(n)-C(60) (n = 5, 8), the Li(12)C(60)-C(n)-Li(12)C(60) complex, keeping the number of adsorbed H(2) molecules per Li and stabilizing the dispersion of individual Li atoms, can serve as better building blocks of polymers than the (Li(12)C(60))(2) dimer. These findings suggest a new route to design cluster-assembled hydrogen storage materials based on terminated sp carbon chains.

  14. Recent Advances in Atomic Metal Doping of Carbon-based Nanomaterials for Energy Conversion.

    PubMed

    Bayatsarmadi, Bita; Zheng, Yao; Vasileff, Anthony; Qiao, Shi-Zhang

    2017-04-12

    Nanostructured metal-contained catalysts are one of the most widely used types of catalysts applied to facilitate some of sluggish electrochemical reactions. However, the high activity of these catalysts cannot be sustained over a variety of pH ranges. In an effort to develop highly active and stable metal-contained catalysts, various approaches have been pursued with an emphasis on metal particle size reduction and doping on carbon-based supports. These techniques enhances the metal-support interactions, originating from the chemical bonding effect between the metal dopants and carbon support and the associated interface, as well as the charge transfer between the atomic metal species and carbon framework. This provides an opportunity to tune the well-defined metal active centers and optimize their activity, selectivity and stability of this type of (electro)catalyst. Herein, recent advances in synthesis strategies, characterization and catalytic performance of single atom metal dopants on carbon-based nanomaterials are highlighted with attempts to understand the electronic structure and spatial arrangement of individual atoms as well as their interaction with the supports. Applications of these new materials in a wide range of potential electrocatalytic processes in renewable energy conversion systems are also discussed with emphasis on future directions in this active field of research.

  15. Reactions of atomic carbon with oxygenated compounds and the investigation of fullerene chemistry

    SciTech Connect

    Chang, Tsongming.

    1993-01-01

    The reaction of atomic carbon with oxygenated organics produces CO and an energetic fragment. Reactions involving deoxygenation of carbonyl compounds to carbenes, epoxides to alkenes, and ethers to a pair of radicals have been investigated. Carbon atom deoxygenation of cyclopentanone and cylcopentene oxide give the cleavage products, ethylene and allene, along with cyclopentene. The use of 2,2,5,5-d[sub 4]-cyclopentanone as the substrate reveals the direct cleavage of cyclopentanylidene carbene is occurring. A calculation of the energetics of this reaction at the MP4/6-31G[sup *]//6-31G[sup *] level suggests a nonconcerted cleavage via a biradical intermediate. Carbon atoms deoxygenate cyclohexene. Inert gas deactivated energetic cyclohexene. The deoxygenation of other oxygenated compounds by atomic carbon, such as 7-oxabicyclo[2.2.1]heptane to cyclohexane-1,4-diyl biradical, 1,2-epoxy-5-hexane to energetic 1,S-hexadiene, allyl ether to allyl radicals, and [gamma]-butyrolactone to trimethylene-1,3-diyl biradical have also been carried out. Methylketene was deoxygenated to vinylidene carbene which rearranges to propyne via a 1,2-H shift. Dimethylketene was deoxygenated to dimethylethylidene carbene which gives 2-butyne via a 1,2-methyl shift and 1,3-butadiene via a vicinal C-H bond insertion. The addition of hydrogen donors to systems in which C[sub 60] is generated results in the formation of polycyclic aromatic hydrocarbons whose carbon skeleton might represent intermediates in fullerene formation. Based on this result, the author proposed a mechanism of fullerene formation. The use of various amounts of propene as a trap showed that the yield of fullerenes decreases as the amount of the trapped product increases. Attempts to trap intermediates in fullerene formation using halides and metals have been studied. The author has attempted metal encapsulation reactions and investigated some possible chemical reactions of fullerenes.

  16. Wire stripper

    NASA Technical Reports Server (NTRS)

    Economu, M. A. (Inventor)

    1978-01-01

    An insulation stripper is described which is especially useful for shielded wire, the stripper including a first pair of jaws with blades extending substantially perpendicular to the axis of the wire, and a second pair of jaws with blades extending substantially parallel to the axis of the wire. The first pair of jaws is pressed against the wire so the blades cut into the insulation, and the device is turned to form circumferential cuts in the insulation. Then the second pair of jaws is pressed against the wire so the blades cut into the insulation, and the wire is moved through the device to form longitudinal cuts that permit easy removal of the insulation. Each of the blades is located within the concave face of a V-block, to center the blades on the wire and to limit the depth of blade penetration.

  17. Confinement induced binding in noble gas atoms within a BN-doped carbon nanotube

    NASA Astrophysics Data System (ADS)

    Chakraborty, Debdutta; Chattaraj, Pratim Kumar

    2015-02-01

    Confinement induced binding interaction patterns for noble gas atoms (Hen/m, Arn, Krn; n = 2, m = 3) atoms inside pristine and -BN doped (3, 3) single walled carbon nanotube (SWCNT) have been studied through density functional theory calculations. The kinetic stability for He dimer and trimer has been investigated at 100 K and 300 K through an ab initio molecular dynamics simulation. The positive role of doping in SWCNT in enhancing the nature of interaction as well as the kinetic stability of the said systems has been found.

  18. Designing potentials by sculpturing wires

    SciTech Connect

    Della Pietra, Leonardo; Aigner, Simon; Groth, Soenke; Hagen, Christoph von; Schmiedmayer, Joerg; Bar-Joseph, Israel; Lezec, Henri J.

    2007-06-15

    Magnetic trapping potentials for atoms on atom chips are determined by the current flow in the chip wires. By modifying the shape of the conductor we can realize specialized current flow patterns and therefore microdesign the trapping potentials. We have demonstrated this by nano-machining an atom chip using the focused ion beam technique. We built a trap, a barrier, and using a Bose-Einstein Condensate as a probe we showed that by polishing the conductor edge the potential roughness on the selected wire can be reduced. Furthermore, we give different other designs and discuss the creation of a one-dimensional magnetic lattice on an atom chip.

  19. Octagraphene as a versatile carbon atomic sheet for novel nanotubes, unconventional fullerenes, and hydrogen storage

    NASA Astrophysics Data System (ADS)

    Sheng, Xian-Lei; Cui, Hui-Juan; Ye, Fei; Yan, Qing-Bo; Zheng, Qing-Rong; Su, Gang

    2012-10-01

    We study a versatile structurally favorable periodic sp2-bonded carbon atomic planar sheet with C4v symmetry by means of the first-principles calculations. This carbon allotrope is composed of carbon octagons and squares with two bond lengths and is thus dubbed as octagraphene. It is a semimetal with the Fermi surface consisting of one hole and one electron pocket, whose low-energy physics can be well described by a tight-binding model of π-electrons. Its Young's modulus, breaking strength, and Poisson's ratio are obtained to be 306 N/m, 34.4 N/m, and 0.13, respectively, which are close to those of graphene. The novel sawtooth and armchair carbon nanotubes as well as unconventional fullerenes can also be constructed from octagraphene. It is found that the Ti-absorbed octagraphene can be allowed for hydrogen storage with capacity around 7.76 wt. %.

  20. Anode wire aging tests with selected gases

    SciTech Connect

    Kadyk, J.; Wise, J.; Hess, D.; Williams, M. )

    1990-04-01

    As a continuation of earlier wire aging investigations, additional candidates for wire chamber gas and wire have been tested. These include the gases: argon/ethane, HRS gas, dimethyl ether, carbon dioxide/ethane, and carbon tetrafluoride/isobutane. Wires used were: gold- plated tungsten, Stablohm, Nicotin, and Stainless Steel. Measurements were made of the effects upon wire aging of impurities from plumbing materials or contamination from various types of oil. Attempts were made to induce wire aging by adding measured amounts of oxygen and halogen (methyl chloride) with negative results. In this paper, the possible role of electronegativity in the wire aging process is discussed, and measurements of electronegativity are made with several single carbon Freons, using both an electron capture detector and a wire chamber operating with dimethyl ether.

  1. Microwave absorption properties of carbon nanocoils coated with highly controlled magnetic materials by atomic layer deposition.

    PubMed

    Wang, Guizhen; Gao, Zhe; Tang, Shiwei; Chen, Chaoqiu; Duan, Feifei; Zhao, Shichao; Lin, Shiwei; Feng, Yuhong; Zhou, Lei; Qin, Yong

    2012-12-21

    In this work, atomic layer deposition is applied to coat carbon nanocoils with magnetic Fe(3)O(4) or Ni. The coatings have a uniform and highly controlled thickness. The coated nanocoils with coaxial multilayer nanostructures exhibit remarkably improved microwave absorption properties compared to the pristine carbon nanocoils. The enhanced absorption ability arises from the efficient complementarity between complex permittivity and permeability, chiral morphology, and multilayer structure of the products. This method can be extended to exploit other composite materials benefiting from its convenient control of the impedance matching and combination of dielectric-magnetic multiple loss mechanisms for microwave absorption applications.

  2. Angular distribution of photoelectrons from atomic oxygen, nitrogen and carbon. [in upper atmosphere

    NASA Technical Reports Server (NTRS)

    Manson, S. J.; Kennedy, D. J.; Starace, A. F.; Dill, D.

    1974-01-01

    The angular distributions of photoelectrons from atomic oxygen, nitrogen, and carbon are calculated. Both Hartree-Fock and Hartree-Slater (Herman-Skillman) wave functions are used for oxygen, and the agreement is excellent; thus only Hartree-Slater functions are used for carbon and nitrogen. The pitch-angle distribution of photoelectrons is discussed, and it is shown that previous approximations of energy-independent isotropic or sin squared theta distributions are at odds with the authors' results, which vary with energy. This variation with energy is discussed, as is the reliability of these calculations.

  3. A Molecular Dynamics of Cold Neutral Atoms Captured by Carbon Nanotube Under Electric Field and Thermal Effect as a Selective Atoms Sensor.

    PubMed

    Santos, Elson C; Neto, Abel F G; Maneschy, Carlos E; Chen, James; Ramalho, Teodorico C; Neto, A M J C

    2015-05-01

    Here we analyzed several physical behaviors through computational simulation of systems consisting of a zig-zag type carbon nanotube and relaxed cold atoms (Rb, Au, Si and Ar). These atoms were chosen due to their different chemical properties. The atoms individually were relaxed on the outside of the nanotube during the simulations. Each system was found under the influence of a uniform electric field parallel to the carbon nanotube and under the thermal effect of the initial temperature at the simulations. Because of the electric field, the cold atoms orbited the carbon nanotube while increasing the initial temperature allowed the variation of the radius of the orbiting atoms. We calculated the following quantities: kinetic energy, potential energy and total energy and in situ temperature, molar entropy variation and average radius of the orbit of the atoms. Our data suggest that only the action of electric field is enough to generate the attractive potential and this system could be used as a selected atoms sensor.

  4. An upper limit to the atomic carbon abundance in the Orion plateau

    NASA Technical Reports Server (NTRS)

    Beichman, C. A.; Phillips, T. G.; Wootten, H. A.; Frerking, M.

    1982-01-01

    Observations made of the atomic carbon line at 492 GHz toward OMC-1 show no evidence for the high velocity dispersion wings observed for many molecular rotational lines. The 3sigma upper limit to the CI column density, NCI, is 6.9 x 10 to the 17th per sq cm for velocities greater than or equal to 4 km per sec from the line center. This upper limit corresponds to a ratio of CI to CO abundances as low as less than 0.13, depending on the assumed CO column density. Atomic carbon is apparently depleted by a factor as large as five in the hot plateau gas, relative to its abundance in other molecular clouds. The lack of CI in the plateau source may mean that the shocks thought to be present in the region are not dissociative in nature and thus do not produce the UV radiation required to convert CO into CI.

  5. The abundance of atomic carbon near the ionization fronts in M17 and S140

    NASA Technical Reports Server (NTRS)

    Keene, J.; Blake, G. A.; Phillips, T. G.; Huggins, P. J.; Beichman, C. A.

    1985-01-01

    The 492 GHz ground-state line of atomic carbon in the edge-on ionization fronts in M17 and S140 were observed. It was found that, contrary to expectation, the C I emission peaks farther into the molecular cloud from the ionization front than does the CO. In fact the peak C I abundance in M17 occurs more than 60 mag of visual extinction into the cloud from the ionization front. Calculations of the ratio of C I to CO column densities yield values of 0.1-0.2. These observations do not support chemical models which predict that neutral atomic carbon should be found only near the edges of molelcular clouds. Other models are discussed which may explain the observations.

  6. Small angle neutron and X-ray studies of carbon structures with metal atoms

    NASA Astrophysics Data System (ADS)

    Lebedev, V. T.; Szhogina, A. A.; Bairamukov, V. Yu

    2017-05-01

    Encapsulation of metal atoms inside carbon single-wall cages or within multi-layer cells has been realized using molecular precursors and high temperature processes transforming them into desirable structures. Endohedral fullerenols Fe@C60(OH)X with 3d-metal (iron) have been studied by SANS in aqueous solutions where they form stable globular clusters with radii R C ∼ 10-12 nm and aggregation numbers N C ∼ 104. This self-assembly is a crucial feature of paramagnetic fullerenols as perspective contrast agents for Magneto-Resonance Imaging in medicine. Cellular carbon-metal structures have been created by the pyrolysis of diphthalocyanines of lanthanides and actinides. It was established that these ultra porous matrices consist of globular cells of molecular precursor size (∼ 1 nm) which are aggregated into superstructures. This provides retain of metal atoms inside matrices which may serve for safety storage of spent fuel of nuclear power plants.

  7. Capture and ionization detection of laser-cooled rubidium atoms with a charged suspended carbon nanotube

    NASA Astrophysics Data System (ADS)

    Ristroph, Trygve Gibbens

    The capture and ionization of neutral rubidium atoms with a positively charged suspended carbon nanotube is realized. The electric field surrounding the nanotube polarizes and pulls atoms into the highly singular attractive inverse square potential. Atoms are ionized by the nanotube, and Rb+ ions are ejected radially and subsequently detected individually. The entire process of capture, ionization, and ion-detection reveals a rich set of behavior, probing the dynamics of laser-cooled atoms as well as nanotube and ionization physics. When the device is used as an atom detector, the cold-atom ionization signal replicates time-dependent features in the instantaneous atom beam density on sub-millisecond time scales. This time resolution allows a time-of-flight measurement of atom velocity, corroborated with a laser absorption measurement. Position sensitivity on the 200 micron scale is demonstrated, as the detector is scanned to map out the atom beam transverse mode profile, a capability otherwise forbidden by the system's optical access. A measurement of the nanotube ionization cross-section as a function of atomic velocity and charging voltage shows the capture process is dominated by an inverse square potential energy. The cross-section reveals an inverse velocity scaling, consistent with the prediction. The analogous charging voltage measurement shows a linear scaling in voltage with measured and predicted slopes in agreement. Sending current through the nanotube changes the voltage offset of the cross-section versus voltage curve. This suggests that the ionization occurs in close proximity to the nanotube surface and is therefore sensitive to its electronic and mechanical properties. Theoretical foundations are developed to describe the capture and ionization physics involved in observing the quantization of atomic orbital angular momentum with the detector. For experimentally accessible parameters, the observation of the quantized conductance of neutral atoms is

  8. Doping of carbon nanotubes with aluminum atom to improve Pt adsorption

    NASA Astrophysics Data System (ADS)

    Ganji, M. D.; Ahangari, M. Ghorbanzadeh; Khosravi, A.

    2014-01-01

    We implement the ab initio van der Waals (vdW) calculations at the density functional level of theory (vdW-DF) for the investigation of Pt adsorption ability of Al-doped carbon nanotubes (Al-CNTs). We present and discuss the energetically favorable sites for a single Pt atom adsorbed on the surface of Al-CNTs. Our results show significantly increment in the binding energy of Pt on the Al-CNT compared with pristine CNTs. We also find that Pt adsorption ability of Al-CNTs is more stronger than that of B- and N-doped CNTs. This is explained by the negative charges introduced in the neighboring C atoms by dopant atom. Our results verify that Al-doped CNTs seems to be more suitable materials for Pt adsorption than pure and also B- and N-doped CNTs.

  9. Reactive pathways of hydrogen and carbon removal from organosilicate glass low- κ films by F atoms

    NASA Astrophysics Data System (ADS)

    Voronina, Ekaterina N.; Mankelevich, Yuri A.; Rakhimova, Tatyana V.

    2017-07-01

    Direct molecular dynamic simulation on the base of the density functional theory (DFT) method is used to study some critical reactions of F atoms with organosilicate glass (OSG) low-κ films. Here static and dynamic DFT-based approaches are applied for a variety of reactive pathways of hydrogen and carbon removal in the form of volatile products (HF, CF2 and CF3 molecules) from initial SiCH3 surface groups. These reactions constitute an important part of the proposed multi-step mechanism of OSG films damage and etching by thermal F atoms. Two models (POSS and TMCTS macromolecules and their modifications) are used to illustrate the peculiarities and dynamics of the successive reactions of F atoms with the initial SiCH3 and appeared SiCHxFy (x + y ≤ 3) surface groups. Contribution to the Topical Issue "Dynamics of Molecular Systems (MOLEC 2016)", edited by Alberto Garcia-Vela, Luis Banares and Maria Luisa Senent.

  10. Detection of the 610 micron /492 GHz/ line of interstellar atomic carbon

    NASA Technical Reports Server (NTRS)

    Phillips, T. G.; Huggins, P. J.; Kuiper, T. B. H.; Miller, R. E.

    1980-01-01

    The ground-state transition of neutral atomic carbon, 3P1-3P0, has been detected in the interstellar medium at the frequency of 492.162 GHz determined in the laboratory by Saykally and Evenson (1980). The observations were made from the NASA Kuiper Airborne Observatory using an InSb heterodyne bolometer receiver. The line was detected as strong emission from eight molecular clouds and apparently provides a widely useful probe of the interstellar medium.

  11. Evidence for sp3 carbon atoms in the RbC60 dimer phase

    NASA Astrophysics Data System (ADS)

    Thier, K.-F.; Mehring, M.; Rachdi, F.

    1997-01-01

    High resolution 13C NMR experiments prove the existence of sp3 carbon atoms which are assigned to the dimer bonds in the quenched phase of RbC60. The relative intensities of the sp3 lines support a model where the C60 monomers are connected via a single bond. Spin-lattice relaxation measurements and 13C spectral changes reveal the transition to the polymer phase above 200 K.

  12. Catalytic enantioselective Nazarov cyclization: construction of vicinal all-carbon-atom quaternary stereocenters.

    PubMed

    Jolit, Anais; Walleser, Patrick M; Yap, Glenn P A; Tius, Marcus A

    2014-06-10

    The diastereoselective asymmetric synthesis of vicinal all-carbon-atom quaternary stereocenters is a challenging problem in organic synthesis for which only few solutions have been described. A catalytic asymmetric Nazarov cyclization of fully substituted dienones that provides cyclopentenone derivatives with vicinal quaternary stereocenters in high optical purity and as single diastereoisomers is now reported. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  13. Controlled fabrication of theophylline imprinted polymers on multiwalled carbon nanotubes via atom transfer radical polymerization.

    PubMed

    Xu, Jianxiong; Gao, Yong; Li, Huaming

    2011-02-01

    Theophylline imprinted polymers were synthesized on the surface of multiwalled carbon nanotubes via atom transfer radical polymerization using brominated multiwalled carbon nanotubes as an initiator. The nanotube-based initiator was prepared by directly reacting acyl chloride-modified multiwalled carbon nanotubes with 2-hydroxylethyl-2'-bromoisobutyrate. The grafting copolymerization of 2-hydroxyethyl-2-methyl-2-propenoate and ethylene glycol dimethacrylate in the presence of template theophylline led to thin molecularly imprinted polymer films coating multiwalled carbon nanotubes. The thickness of molecularly imprinted polymer films prepared in this study was about 5 nm as determined by transmission electron microscopy. Fourier-transform infrared spectroscopy was utilized to follow the introduction of initiator groups as well as polymers on the carbon nanotube surfaces. Thermogravimetric analysis indicated that the molecularly imprinted polymers were successfully grown from the carbon nanotube surfaces, with the final products having a polymer weight percentage of ca. 50 wt%. The adsorption properties, such as adsorption dynamics, special binding and selective recognition capacity, of the as-prepared molecularly imprinted polymer films were evaluated. The results demonstrated that the composite of molecularly imprinted polymers and multiwalled carbon nanotubes not only possessed a rapid dynamics but also exhibited a good selectivity toward theophylline, compared to caffeine.

  14. ATOMIC-LEVEL IMAGING OF CO2 DISPOSAL AS A CARBONATE MINERAL: OPTIMIZING REACTION PROCESS DESIGN

    SciTech Connect

    M.J. McKelvy; R. Sharma; A.V.G. Chizmeshya; H. Bearat; R.W. Carpenter

    2001-10-01

    Fossil fuels, especially coal, can support the energy demands of the world for centuries to come, if the environmental problems associated with CO{sub 2} emissions can be overcome. Permanent and safe methods for CO{sub 2} capture and disposal/storage need to be developed. Mineralization of stationary-source CO{sub 2} emissions as carbonates can provide such safe capture and long-term sequestration. Mg-rich lamellar-hydroxide based minerals (e.g., brucite and serpentine) offer a class of widely available, low-cost materials, with intriguing mineral carbonation potential. Carbonation of such materials inherently involves dehydroxylation, which can disrupt the material down to the atomic level. As such, controlled dehydroxylation, before and/or during carbonation, may provide an important parameter for enhancing carbonation reaction processes. Mg(OH){sub 2} was chosen as the model material for investigating lamellar hydroxide mineral dehydroxylation/carbonation mechanisms due to (i) its structural and chemical simplicity, (ii) interest in Mg(OH){sub 2} gas-solid carbonation as a potentially cost-effective CO{sub 2} mineral sequestration process component, and (iii) its structural and chemical similarity to other lamellar-hydroxide-based minerals (e.g., serpentine-based minerals) whose carbonation reaction processes are being explored due to their low-cost CO{sub 2} sequestration potential. Fundamental understanding of the mechanisms that govern dehydroxylation/carbonation processes is essential for minimizing the cost of any lamellar-hydroxide-based mineral carbonation sequestration process. This report covers the third year progress of this grant, as well as providing an integrated overview of the progress in years 1-3, as we have been granted a one-year no-cost extension to wrap up a few studies and publications to optimize project impact.

  15. ATOMIC-LEVEL IMAGING OF CO2 DISPOSAL AS A CARBONATE MINERAL: OPTIMIZING REACTION PROCESS DESIGN

    SciTech Connect

    M.J. McKelvy; R. Sharma; A.V.G. Chizmeshya; H. Bearat; R.W. Carpenter

    2002-11-01

    Fossil fuels, especially coal, can support the energy demands of the world for centuries to come, if the environmental problems associated with CO{sub 2} emissions can be overcome. Permanent and safe methods for CO{sub 2} capture and disposal/storage need to be developed. Mineralization of stationary-source CO{sub 2} emissions as carbonates can provide such safe capture and long-term sequestration. Mg-rich lamellar-hydroxide based minerals (e.g., brucite and serpentine) offer a class of widely available, low-cost materials, with intriguing mineral carbonation potential. Carbonation of such materials inherently involves dehydroxylation, which can disrupt the material down to the atomic level. As such, controlled dehydroxylation, before and/or during carbonation, may provide an important parameter for enhancing carbonation reaction processes. Mg(OH){sub 2} was chosen as the model material for investigating lamellar hydroxide mineral dehydroxylation/carbonation mechanisms due to (1) its structural and chemical simplicity, (2) interest in Mg(OH){sub 2} gas-solid carbonation as a potentially cost-effective CO{sub 2} mineral sequestration process component, and (3) its structural and chemical similarity to other lamellar-hydroxide-based minerals (e.g., serpentine-based minerals) whose carbonation reaction processes are being explored due to their low-cost CO{sub 2} sequestration potential. Fundamental understanding of the mechanisms that govern dehydroxylation/carbonation processes is essential for minimizing the cost of any lamellar-hydroxide-based mineral carbonation sequestration process. This final report covers the overall progress of this grant.

  16. Development of carbon electrodes for electrochemistry, solid-state electronics and multimodal atomic force microscopy imaging

    NASA Astrophysics Data System (ADS)

    Morton, Kirstin Claire

    Carbon is one of the most remarkable elements due to its wide abundance on Earth and its many allotropes, which include diamond and graphite. Many carbon allotropes are conductive and in recent decades scientists have discovered and synthesized many new forms of carbon, including graphene and carbon nanotubes. The work in this thesis specifically focuses on the fabrication and characterization of pyrolyzed parylene C (PPC), a conductive pyrocarbon, as an electrode material for diodes, as a conductive coating for atomic force microscopy (AFM) probes and as an ultramicroelectrode (UME) for the electrochemical interrogation of cellular systems in vitro. Herein, planar and three-dimensional (3D) PPC electrodes were microscopically, spectroscopically and electrochemically characterized. First, planar PPC films and PPC-coated nanopipettes were utilized to detect a model redox species, Ru(NH3) 6Cl3. Then, free-standing PPC thin films were chemically doped, with hydrazine and concentrated nitric acid, to yield p- and n-type carbon films. Doped PPC thin films were positioned in conjunction with doped silicon to create Schottky and p-n junction diodes for use in an alternating current half-wave rectifier circuit. Pyrolyzed parylene C has found particular merit as a 3D electrode coating of AFM probes. Current sensing-atomic force microscopy imaging in air of nanoscale metallic features was undertaken to demonstrate the electronic imaging applicability of PPC AFM probes. Upon further insulation with parylene C and modification with a focused ion beam, a PPC UME was microfabricated near the AFM probe apex and utilized for electrochemical imaging. Subsequently, scanning electrochemical microscopy-atomic force microscopy imaging was undertaken to electrochemically quantify and image the spatial location of dopamine exocytotic release, elicited mechanically via the AFM probe itself, from differentiated pheochromocytoma 12 cells in vitro.

  17. Investigation of the Interactions and Bonding between Carbon and Group VIII Metals at the Atomic Scale.

    PubMed

    Zoberbier, Thilo; Chamberlain, Thomas W; Biskupek, Johannes; Suyetin, Mikhail; Majouga, Alexander G; Besley, Elena; Kaiser, Ute; Khlobystov, Andrei N

    2016-03-23

    The nature and dynamics of bonding between Fe, Ru, Os, and single-walled carbon nanotubes (SWNTs) is studied by aberration-corrected high-resolution transmission electron microscopy (AC-HRTEM). The metals catalyze a wide variety of different transformations ranging from ejection of carbon atoms from the nanotube sidewall to the formation of hollow carbon shells or metal carbide within the SWNT, depending on the nature of the metal. The electron beam of AC-HRTEM serves the dual purpose of providing energy to the specimen and simultaneously enabling imaging of chemical transformations. Careful control of the electron beam parameters, energy, flux, and dose allowed direct comparison between the metals, demonstrating that their chemical reactions with SWNTs are determined by a balance between the cohesive energy of the metal particles and the strength of the metal-carbon σ- or π-bonds. The pathways of transformations of a given metal can be drastically changed by applying different electron energies (80, 40, or 20 keV), thus demonstrating AC-HRTEM as a new tool to direct and study chemical reactions. The understanding of interactions and bonding between SWNT and metals revealed by AC-HRTEM at the atomic level has important implications for nanotube-based electronic devices and catalysis.

  18. Practical use of a carbon nanotube attached to a blunt apex in an atomic force microscope

    SciTech Connect

    Kuwahara, Masashi; Abe, Hidekazu; Tokumoto, Hiroshi; Shima, Takayuki; Tominaga, Junji; Fukuda, Hajime

    2004-03-15

    A carbon nanotube (CNT) was successfully attached to a base probe with a blunt apex and subsequently used as a probe for an atomic force microscope (AFM). This setup demonstrates high spatial resolution properties, plus an advantage: we were able to readily identify the loss of the CNT from the end of the probe by the resultant sudden drop in resolution. This design of probe is expected to feature yet another advantage: that of relative immunity to accidental collision compared to a CNT attached to a commercially available sharp tip. We also discuss the problems specific to CNT-attached probes, which are carbon contamination of the sample surface and artifact images formed at the edge of pit structures. We demonstrate that carbon contamination can be suppressed by a rubbing procedure before the scanning use, and that pit artifacts can be eliminated by optimizing the CNT length.

  19. Cross section database for carbon atoms and ions: Electron-impact ionization, excitation, and charge exchange in collisions with hydrogen atoms

    SciTech Connect

    Suno, Hiroya . E-mail: suno@jamstec.go.jp; Kato, Takako

    2006-07-15

    A database has been constructed consisting of the recommended cross sections for electron-impact excitation and ionization of carbon atoms and ions C, C{sup +}-C{sup 5+}, asl as for charge exchange processes between carbon ions C{sup +}-C{sup 6+} and hydrogen atoms. We have collected a large amount of theoretical and experimental cross section data from the literature, and have critically assessed their accuracy. The recommended cross sections, the best values for use, are expressed in the form of simple analytical functions. These are also presented in graphical form.

  20. Atom Probe Tomography Examination of Carbon Redistribution in Quenched and Tempered 4340 Steel

    SciTech Connect

    Clarke, Amy J.; Miller, Michael K.; Alexander, David J.; Field, Robert D.; Clarke, Kester D.

    2012-08-07

    Quenching and tempering produces a wide range of mechanical properties in medium carbon, low alloyed steels - Study fragmentation behavior as a function of heat-treatment. Subtle microstructural changes accompany the mechanical property changes that result from quenching and tempering - Characterize the location and distribution of carbon and alloying elements in the microstructure using atom probe tomography (APT). Perform complementary transmission electron microscopy (TEM). Tempering influences the mechanical properties and fragmentation of quenched 4340 (hemi-shaped samples). APT revealed carbon-enriched features that contain a maximum of {approx}12-14 at.% carbon after quenching to RT (the level of carbon is perhaps associated with the extent of autotempering). TEM confirmed the presence of twinned martensite and indicates {var_epsilon} ({eta}) transition carbides after oil quenching to RT. Tempering at 325 C resulted in carbon-enriched plates (> 25 at.% C) with no significant element partitioning (transition carbides?). Tempering at 450 C and 575 C resulted in cementite ({approx} 25 at.% C) during late stage tempering; Cr, Mn, Mo partitioned to cementite and Si partitioned to ferrite. Tempering at 575 C resulted in P segregation at cementite interfaces and the formation of Cottrell atmospheres.

  1. Carbon Isotopic Analysis of Individual Pollen Grains From C3 and C4 Grasses Using a Moving-Wire Combustion Interface

    NASA Astrophysics Data System (ADS)

    Nelson, D. M.; Hu, F.; Pearson, A.

    2006-12-01

    Pollen grains from grasses using the C3 and C4 photosynthetic pathways possess distinct δ13C compositions that may be used to estimate the relative abundance of C3 and C4 grasses in paleorecords [Nelson et al., in press]. However, a minimum of 600 grass pollen grains are required for δ13C analysis using conventional EA-IRMS, which equates to long preparation times (~12 hours/sample) and may prevent detection of C4 grasses at low (<~30%) abundance. We evaluated a recently developed moving-wire (mw) IRMS system [Sessions et al., 2005] for δ13C analysis of individual grass pollen grains. Individual grains from three C3 and three C4 grass species were isolated through micromanipulation and applied to the moving wire with a syringe. To distinguish samples containing pollen ("pollen present") from those not containing pollen ("pollen absent," likely because pollen fell of the wire before reaching the combustion oven), we set the criterion for "pollen present" as an amount of carbon greater than the 2σ range of the amount of carbon in blanks containing only water. This criterion resulted in the exclusion of 39% (range= 28-58%) of the 680 samples applied to the wire. The average δ13C composition (±1σ) of the remaining samples was -25.4 ± 3.0 and -18.0 ± 3.9‰ for C3 grasses and C4 grasses, respectively. Such high δ13C variability may partially reflect natural variation within the δ13C ranges of C3 and C4 grasses. However, it likely also reflects poor accuracy and precision caused by small sample sizes and the non-quantifiable nature of both the size and δ13C value of the blank. Nonetheless, application of a δ13C threshold at which the greatest numbers of grains were correctly classified as either C3 or C4 (-21.7‰) suggests that the moving-wire system can be used to distinguish C3 from C4 grasses. For example, on average 90% (range= 70-96%) of pollen grains from C3 grasses had δ13C values more negative than -21.7‰, while ~87% (range=84-90%) of pollen

  2. Detection of nickel atom by laser induced fluorescence during carbon nanotube formation in a laser produced plume

    NASA Astrophysics Data System (ADS)

    De Boer, G.; Arepalli, S.; Holmes, W.; Nikolaev, P.; Range, C.; Scott, C.

    2001-05-01

    In situ monitoring of catalyst nickel atoms by laser induced fluorescence during carbon nanotube formation in a laser-produced plume was performed at the Johnson Space Center nanotube production laboratory. The results indicate that ablation of nickel and plume dynamics are strongly related to the oven temperature. Nickel atoms have a long lifetime of several milliseconds and have an electronic temperature of at least 1500 K during carbon nanotube formation.

  3. Bridged single-walled carbon nanotube-based atomic-scale mass sensors

    NASA Astrophysics Data System (ADS)

    Ali-Akbari, H. R.; Shaat, M.; Abdelkefi, A.

    2016-08-01

    The potentials of carbon nanotubes (CNTs) as mechanical resonators for atomic-scale mass sensing are presented. To this aim, a nonlocal continuum-based model is proposed to study the dynamic behavior of bridged single-walled carbon nanotube-based mass nanosensors. The carbon nanotube (CNT) is considered as an elastic Euler-Bernoulli beam with von Kármán type geometric nonlinearity. Eringen's nonlocal elastic field theory is utilized to model the interatomic long-range interactions within the structure of the CNT. This developed model accounts for the arbitrary position of the deposited atomic-mass. The natural frequencies and associated mode shapes are determined based on an eigenvalue problem analysis. An atom of xenon (Xe) is first considered as a specific case where the results show that the natural frequencies and mode shapes of the CNT are strongly dependent on the location of the deposited Xe and the nonlocal parameter of the CNT. It is also indicated that the first vibrational mode is the most sensitive when the mass is deposited at the middle of a single-walled carbon nanotube. However, when deposited in other locations, it is demonstrated that the second or third vibrational modes may be more sensitive. To investigate the sensitivity of bridged single-walled CNTs as mass sensors, different noble gases are considered, namely Xe, argon (Ar), and helium (He). It is shown that the sensitivity of the single-walled CNT to the Ar and He gases is much lower than the Xe gas due to the significant decrease in their masses. The derived model and performed analysis are so needed for mass sensing applications and particularly when the detected mass is randomly deposited.

  4. Wire chamber

    DOEpatents

    Atac, Muzaffer

    1989-01-01

    A wire chamber or proportional counter device, such as Geiger-Mueller tube or drift chamber, improved with a gas mixture providing a stable drift velocity while eliminating wire aging caused by prior art gas mixtures. The new gas mixture is comprised of equal parts argon and ethane gas and having approximately 0.25% isopropyl alcohol vapor.

  5. Residential Wiring.

    ERIC Educational Resources Information Center

    Taylor, Mark

    The second in a series of three curriculum packages on wiring, these materials for a five-unit course were developed to prepare postsecondary students for entry-level employment in the residential wiring trade. The five units are: (1) blueprint reading and load calculations; (2) rough-in; (3) service; (4) trim out and troubleshooting; and (5) load…

  6. Energy of the Isolated Metastable Iron-Nickel FCC Nanocluster with a Carbon Atom in the Tetragonal Interstice

    NASA Astrophysics Data System (ADS)

    Bondarenko, Natalya V.; Nedolya, Anatoliy V.

    2017-02-01

    The energy of the isolated iron-nickel nanocluster was calculated by molecular mechanics method using Lennard-Jones potential. The cluster included a carbon atom that drifted from an inside octahedral interstice to a tetrahedral interstice in direction and after that in <222> direction to the surface. In addition, one of 14 iron atoms was replaced by a nickel atom, the position of which was changing during simulation.

  7. Substrate patterning with NiOx nanoparticles and hot-wire chemical vapour deposition of WO3x and carbon nanostructures

    NASA Astrophysics Data System (ADS)

    Houweling, Z. S.

    2011-10-01

    The first part of the thesis treats the formation of nickel catalyst nanoparticles. First, a patterning technique using colloids is employed to create ordered distributions of monodisperse nanoparticles. Second, nickel films are thermally dewetted, which produces mobile species that self-arrange in non-ordered distributions of polydisperse particles. Third, the mobility of the nickel species is successfully reduced by the addition of air during the dewetting and the use of a special anchoring layer. Thus, non-ordered distributions of self-arranged monodisperse nickel oxide nanoparticles (82±10 nm x 16±2 nm) are made. Studies on nickel thickness, dewetting time and dewetting temperature are conducted. With these particle templates, graphitic carbon nanotubes are synthesised using catalytic hot-wire chemical vapour deposition (HWCVD), demonstrating the high-temperature processability of the nanoparticles. The second part of this thesis treats the non-catalytic HWCVD of tungsten oxides (WO3-x). Resistively heated tungsten filaments exposed to an air flow at subatmospheric pressures, produce tungsten oxide vapour species, which are collected on substrates and are subsequently characterised. First, a complete study on the process conditions is conducted, whereby the effects of filament radiation, filament temperature, process gas pressure and substrate temperature, are investigated. The thus controlled growth of nanogranular smooth amorphous and crystalline WO3-x thin films is presented for the first time. Partially crystalline smooth hydrous WO3-x thin films consisting of 20 nm grains can be deposited at very high rates. The synthesis of ultrafine powders with particle sizes of about 7 nm and very high specific surface areas of 121.7±0.4 m2·g-1 at ultrahigh deposition rates of 36 µm·min-1, is presented. Using substrate heating to 600°C or more, while using air pressures of 3·10-5 mbar to 0.1 mbar, leads to pronounced crystal structures, from nanowires, to

  8. Influence of atomic vacancies on the dynamic characteristics of nanoresonators based on double walled carbon nanotube

    NASA Astrophysics Data System (ADS)

    Patel, Ajay M.; Joshi, Anand Y.

    2015-06-01

    The dynamic analysis of double walled carbon nanotubes (DWCNTs) with different boundary conditions has been performed using atomistic finite element method. The double walled carbon nanotube is modeled considering it as a space frame structure similar to a three dimensional beam. The elastic properties of beam element are calculated by considering mechanical characteristics of covalent bonds between the carbon atoms in the hexagonal lattice. Spring elements are used to describe the interlayer interactions between the inner and outer tubes caused due to the van der Waals forces. The mass of each beam element is assumed as point mass at nodes coinciding with carbon atoms at inner and outer wall of DWCNT. It has been reported that atomic vacancies are formed during the manufacturing process in DWCNT which tend to migrate leading to a change in the mechanical characteristics of the same. Simulations have been carried out to visualize the behavior of such defective DWCNTs subjected to different boundary conditions and when used as mass sensing devices. The variation of such atomic vacancies in outer wall of Zigzag and Armchair DWCNT is performed along the length and the change in response is noted. Moreover, as CNTs have been used as mass sensors extensively, the present approach is focused to explore the use of zigzag and armchair DWCNT as sensing device with a mono-atomic vacancy in it. The results clearly state that the dynamic characteristics are greatly influenced by defects like vacancies in it. A higher frequency shift is observed when the vacancy is located away from the fixed end for both Armchair as well as zigzag type of CNTs. A higher frequency shift is reported for armchair CNT for a mass of 10-22 g which remains constant for 10-21 g and then decreases gradually. Comparison with the other experimental and theoretical studies exhibits good association which suggests that defective DWCNTs can further be explored for mass sensing. This investigation is helpful

  9. An atomistic study of growth mode and microstructure evolution of amorphous carbon films by different incident carbon atoms

    NASA Astrophysics Data System (ADS)

    Xue, Chen; Zhou, Jianqiu

    2014-09-01

    In this paper, molecular dynamics (MD) simulation has been performed to describe the growth and interfacial microstructure of amorphous carbon films. We focus on the film growth mode and surface morphology for diverse deposition process parameters mainly including incident energy and incident angle. To explore the relationship between the motion of deposition atoms and amorphous films growth, a series of snapshots for each deposition process has been taken for comparison. The snapshots show that the films growth modes are diverse at different incident parameters. In the next step, surface morphology, atom distribution along film growth direction and internal structure including vacancy defects evolution during deposition process are analyzed. The results reveal that incident energy on the horizontal plane dominates the surface roughness, and incident energy on the vertical plane dominates the compactness of the film. We conclude that a suitable incident parameter is not only beneficial to prepare amorphous films with compact and smooth or bump-like surface which will meet different needs, but also can avoid formation of defects during deposition. The simulation results are expected to provide useful guidance for improving amorphous carbon films quality.

  10. A first principle study for the adsorption and absorption of carbon atom and the CO dissociation on Ir(100) surface

    SciTech Connect

    Erikat, I. A.; Hamad, B. A.

    2013-11-07

    We employ density functional theory to examine the adsorption and absorption of carbon atom as well as the dissociation of carbon monoxide on Ir(100) surface. We find that carbon atoms bind strongly with Ir(100) surface and prefer the high coordination hollow site for all coverages. In the case of 0.75 ML coverage of carbon, we obtain a bridging metal structure due to the balance between Ir–C and Ir–Ir interactions. In the subsurface region, the carbon atom prefers the octahedral site of Ir(100) surface. We find large diffusion barrier for carbon atom into Ir(100) surface (2.70 eV) due to the strong bonding between carbon atom and Ir(100) surface, whereas we find a very small segregation barrier (0.22 eV) from subsurface to the surface. The minimum energy path and energy barrier for the dissociation of CO on Ir(100) surface are obtained by using climbing image nudge elastic band. The energy barrier of CO dissociation on Ir(100) surface is found to be 3.01 eV, which is appreciably larger than the association energy (1.61 eV) of this molecule.

  11. Tetragonality and the distribution of carbon atoms in the Fe-C martensite: Molecular-dynamics simulation

    NASA Astrophysics Data System (ADS)

    Chirkov, P. V.; Mirzoev, A. A.; Mirzaev, D. A.

    2016-01-01

    In the statistical theory of the ordering of carbon atoms in the z sublattice of martensite, the most important role is played by the parameter of the strain interaction of carbon atoms λ0, which determines the critical temperature of the bcc-bct transition. The values of this parameter (6-11 eV/atom) obtained in recent years by the methods of computer simulation differ significantly from the value λ0 = 2.73 eV/atom obtained by A. G. Khachaturyan. In this article, we calculated the value of λ0 by two methods based on the molecular-dynamics simulation of the ordering of carbon atoms in the lattice of martensite at temperatures of 500, 750, 900, and 1000 K in a wide range of carbon concentrations, which includes c crit. No tails of ordering below c crit have been revealed. It has been shown analytically that there is an inaccuracy in the Khachaturyan theory of ordering for the crystal in an elastic environment. After eliminating this inaccuracy, no tails of the order parameter appear; the tetragonality changes jumpwise from η = 0 to ηcrit = 0.75 at c crit = 2.9 kT/λ0 instead of ηcrit = 0.5 and c crit= 2.77 kT/λ0 for an isolated crystal. Upon the simulation, clustering of carbon atoms was revealed in the form of platelike pileups along {102} planes separated by flat regions where no carbon atoms were present. The influence of short-range order in the arrangement of neighboring carbon atoms on the thermodynamics of ordering is discussed.

  12. Atomic-scaled cobalt encapsulated in P,N-doped carbon sheaths over carbon nanotubes for enhanced oxygen reduction electrocatalysis under acidic and alkaline media.

    PubMed

    Guo, Shiyu; Yuan, Pengfei; Zhang, Jianan; Jin, Pengbo; Sun, Hongming; Lei, Kaixiang; Pang, Xinchang; Xu, Qun; Cheng, Fangyi

    2017-08-31

    A one-step in situ nanoconfined pyrolysis strategy was developed to anchor highly active single Co atoms on the P,N-doped porous carbon@carbon nanotube coaxial nanocables (Co-P,N-CNT), which exhibit remarkable enhanced ORR electrocatalytic activity in both acidic and alkaline media.

  13. Conductance oscillations of a metallic quantum wire

    NASA Astrophysics Data System (ADS)

    Kwapinski, T.

    2005-09-01

    The electron transport through a monatomic metallic wire connected to leads is investigated using the tight-binding Hamiltonian and the Green function technique. Analytical formulae for the transmittance are derived and M-atom oscillations of the conductance versus the length of the wire are found. Maxima of the transmittance function versus the energy, for a wire consisting of N atoms, determine the (N+1) period of the conductance. The periods of conductance oscillations are discussed and the local and average quantum wire charges are presented. The average charge of the wire is linked with the period of the conductance oscillations and for M-atom periodicity there are possible (M-1) average occupations of the wire states.

  14. Atomic scale enhancement of the adhesion of beryllium films to carbon substrates

    SciTech Connect

    Musket, R.G.; Wirtenson, G.R.

    1995-12-01

    We have used 200 keV carbon ions to enhance the adhesion of 240-nm thick Be films to polished, vitreous carbon substrates. Adhesion of the as-deposited films was below that necessary to pass the scotch-tape test. Carbon ion fluences less than 1.6x10{sup 14} C/cm{sup 2} were sufficient to ensure the passage of the tape test without affecting the optical properties of the films. Adhesion failure of the as-deposited film was attributed to an inner oxide layer between the Be and the carbon. Because this oxide ({approximately}5 nm of BeO) was not measurably changed by the irradiation process, these results are consistent with adhesion enhancement occurring on the atomic scale at the interface between the inner oxide and the carbon substrate. This conclusion was supported by Rutherford backscattering (RBS) data, and potential adhesion mechanisms are discussed with consideration of relative contributions from electronic and nuclear stopping.

  15. Carbon-hydrogen defects with a neighboring oxygen atom in n-type Si

    NASA Astrophysics Data System (ADS)

    Gwozdz, K.; Stübner, R.; Kolkovsky, Vl.; Weber, J.

    2017-07-01

    We report on the electrical activation of neutral carbon-oxygen complexes in Si by wet-chemical etching at room temperature. Two deep levels, E65 and E75, are observed by deep level transient spectroscopy in n-type Czochralski Si. The activation enthalpies of E65 and E75 are obtained as EC-0.11 eV (E65) and EC-0.13 eV (E75). The electric field dependence of their emission rates relates both levels to single acceptor states. From the analysis of the depth profiles, we conclude that the levels belong to two different defects, which contain only one hydrogen atom. A configuration is proposed, where the CH1BC defect, with hydrogen in the bond-centered position between neighboring C and Si atoms, is disturbed by interstitial oxygen in the second nearest neighbor position to substitutional carbon. The significant reduction of the CH1BC concentration in samples with high oxygen concentrations limits the use of this defect for the determination of low concentrations of substitutional carbon in Si samples.

  16. Dual catalytic purpose of the tungsten filament during the synthesis of single-helix carbon microcoils by hot-wire CVD.

    PubMed

    Oliphant, C J; Arendse, C J; Malgas, G F; Motaung, D E; Muller, T F G; Knoesen, D

    2009-10-01

    We report on the deposition of crystalline single-helix carbon microcoils, in the as-deposited state, by the hot-wire chemical vapor deposition process without any special preparation of nano-sized transition metal catalysts and subsequent post-deposition annealing. Tungsten, originating from the heated tungsten filament, is identified as the catalyst material responsible for the growth of the microcoils. High-resolution transmission spectroscopy, combined with Raman spectroscopy, confirm that the as-deposited microcoils are crystalline, which is induced by the high deposition temperature in the vicinity of the heated filament. These results suggest a simplified, less tedious deposition process for the growth of carbon microcoils, once the process has been optimized.

  17. Study of the influence of filler wire carbon and residual element content on the mechanical properties of mechanized gas-metal-arc-welds: Final report

    SciTech Connect

    Not Available

    1988-06-01

    The individual and interactive roles of carbon, oxygen, and nitrogen and residual or tramp elements such as titanium, chromium, copper, sulfur, phosphorus, aluminum, arsenic, tin, and antimony on weld metal mechanical properties in pipeline steels are poorly documented. Further, most of the research has been done with the submerged-arc process. Systematic studies of the microstructures and toughnesses of GMAW welds are limited. A better understanding of the effects of carbon and the residual elements on weld metal toughnesses is needed so that appropriate filler wires can be produced. Accordingly, the objective of this research program was to attempt to determine the reason for the variable toughness of mechanized gas-metal-arc (GMA) girth welds and to identify means of improving toughness levels, particularly CTOD test values. This report is available from the American Gas Association Order Processing Department, 1515 Wilson Boulevard, Arlington, VA 2209-2470 (703/841-8558). 5 refs., 36 figs., 9 tabs.

  18. Inelastic and reactive scattering of hyperthermal atomic oxygen from amorphous carbon

    NASA Technical Reports Server (NTRS)

    Minton, Timothy K.; Nelson, Christine M.; Brinza, David E.; Liang, Ranty H.

    1991-01-01

    The reaction of hyperthermal oxygen atoms with an amorphous carbon-13 surface was studied using a modified universal crossed molecular beams apparatus. Time-of-flight distributions of inelastically scattered O-atoms and reactively scattered CO-13 and CO2-13 were measured with a rotatable mass spectrometer detector. Two inelastic scattering channels were observed, corresponding to a direct inelastic process in which the scattered O-atoms retain 20 to 30 percent of their initial kinetic energy and to a trapping desorption process whereby O-atoms emerge from the surface at thermal velocities. Reactive scattering data imply the formation of two kinds of CO products, slow products whose translational energies are determined by the surface temperature and hyperthermal (Approx. 3 eV) products with translational energies comprising roughly 30 percent of the total available energy (E sub avl), where E sub avl is the sum of the collision energy and the reaction exothermicity. Angular data show that the hyperthermal CO is scattered preferentially in the specular direction. CO2 product was also observed, but at much lower intensities than CO and with only thermal velocities.

  19. Characterization of carbon nanotube yarn after exposure to hyperthermal atomic oxygen and thermal fatigue

    NASA Astrophysics Data System (ADS)

    Misak, H. E.; Mall, S.

    2016-12-01

    Carbon nanotube (CNT)-yarn was evaluated for the survivability under hazardous space environmental conditions which were thermal fatigue, atomic oxygen and additive effect of these two exposures. Its tensile strength, tenacity, stiffness, strain to failure and electrical conductivity were characterized at the two extreme space temperatures of -150 and 120 °C before and after exposure to these environmental conditions. Tensile strength, stiffness and electrical conductivity of unexposed CNT yarn increased at the cryogenic temperature relative to at the elevated temperature. There was no change in the tensile properties after exposure to the space environmental conditions when measured at the elevated and cryogenic temperatures. Electrical conductivity decreased after exposure to three hazardous environments involving thermal fatigue, but it had no or small decrease when exposed to atomic oxygen only. No additive effect of thermal fatigue followed by atomic oxygen or by atomic oxygen followed by thermal fatigue environments on the CNTs' tensile properties and electrical conductivity was observed. Considering the low density 0.59 g/cc and good resistant to the extreme hazardous space environment, CNT-yarns have potential for applications in spacecraft and satellites.

  20. Interaction between a single Pt atom and a carbon nanotube studied by density functional theory

    NASA Astrophysics Data System (ADS)

    Chen, G.; Kawazoe, Y.

    2006-03-01

    Using density functional theory with the generalized gradient approximation, we have studied the interaction between a single Pt atom and a carbon nanotube. The bridge adsorption site on the outer wall of nanotube is favorable. The curvature affects the binding strength. Compared to the larger nanotube, Pt could bind stronger to the outer wall of a small radius nanotube. For zigzag nanotube, the most stable site on the outer wall is the bridge site with the underlying C-C bond being parallel to the axis of the nanotube, while for the armchair nanotube it is the bridge site with the underlying C-C bond being tilted to the axis of the nanotube. The energy in average differs by ˜1.5eV for adsorbing on both sidewalls of small radius nanotube, while it decreases much for the larger nanotube. Either by penetrating the wall or by substituting one C atom on the wall, the Pt atom is found to be hard to diffuse from the outside to the inside. The studied charge density suggests the weak covalentlike bonding between Pt and C atoms.

  1. Probing spin-orbit-interaction-induced electron dynamics in the carbon atom by multiphoton ionization

    NASA Astrophysics Data System (ADS)

    Rey, H. F.; van der Hart, H. W.

    2014-09-01

    We use R-matrix theory with time dependence (RMT) to investigate multiphoton ionization of ground-state atomic carbon with initial orbital magnetic quantum number ML=0 and ML=1 at a laser wavelength of 390 nm and peak intensity of 1014W/cm2. Significant differences in ionization yield and ejected-electron momentum distribution are observed between the two values for ML. We use our theoretical results to model how the spin-orbit interaction affects electron emission along the laser polarization axis. Under the assumption that an initial C atom is prepared at zero time delay with ML=0, the dynamics with respect to time delay of an ionizing probe pulse modeled by using RMT theory is found to be in good agreement with available experimental data.

  2. Reconstruction of carbon atoms around a point defect of a graphene: a hybrid quantum/classical molecular-dynamics simulation.

    PubMed

    Kowaki, Y; Harada, A; Shimojo, F; Hoshino, K

    2009-02-11

    We have investigated the rearrangement of carbon atoms around a point defect of a graphene using a hybrid ab initio/classical molecular-dynamics (MD) simulation method, in which 36 carbon atoms surrounding a point defect are treated by the ab initio MD method and the other 475 carbon atoms relatively far from the point defect are treated by the classical MD method. We have confirmed a formation of a 5-1DB defect (a pentagon and a dangling bond) from the time dependence of atomic configurations and electron density distributions obtained by our simulation. We have found that the pentagon is formed in two different positions around the point defect, and that the two positions appear alternately during the simulation, the frequency of which increases with increasing temperature.

  3. Synthesis and characterization of carbon fibers functionalized with poly (glycidyl methacrylate) via atom transfer radical polymerization

    NASA Astrophysics Data System (ADS)

    Wu, Yongwei; Xiong, Lei; Qin, Xiaokang; Wang, Zhengyue; Ding, Bei; Ren, Huan; Pi, Xiaolong

    2015-07-01

    In this work, polyacrylonitrile (PAN)-based carbon fibers (CF) were chemically modified with poly (glycidyl methacrylate) (PGMA) via atom transfer radical polymerization (ATRP) to improve the interaction between the CF and polymer matrix. The FT-IR, TGA, and XPS were used to determine the chemical structure of the resulting products and the quantities of PGMA chains grafted from the CF surface. The experimental results confirm that the CF surface was functionalized and glycidyl methacrylate was graft-polymerized onto the CF, and the grafting content of polymer could reach 10.2%.

  4. STM Images of Atomic-Scale Carbon Nanotube Defects Produced by Ar+ Irradiation

    NASA Astrophysics Data System (ADS)

    Osváth, Z.; Vértesy, G.; Tapasztó, L.; Wéber, F.; Horváth, Z. E.; Gyulai, J.; Biró, L. P.

    2005-09-01

    Multi-wall carbon nanotubes (MWCNTs) dispersed on graphite (HOPG) substrate were irradiated with Ar+ ions of 30 keV, using a low-dose of D = 5×1011 ions/cm2. The irradiated samples were investigated by scanning tunneling microscopy (STM) under ambient conditions. Atomic resolution STM images reveal individual nanotube defects, which appear as hillocks of 1-2 angstroms in height, due to the locally changed electronic structure. After annealing at 450 °C in nitrogen atmosphere, the irradiated MWCNTs were investigated again by STM. The effect of the heat treatment on the irradiation-induced nanotube defects is also discussed.

  5. Carbon nanotubes as solid-phase extraction sorbents prior to atomic spectrometric determination of metal species: a review.

    PubMed

    Herrero Latorre, C; Álvarez Méndez, J; Barciela García, J; García Martín, S; Peña Crecente, R M

    2012-10-24

    New materials have significant impact on the development of new methods and instrumentation for chemical analysis. From the discovery of carbon nanotubes in 1991, single and multi-walled carbon nanotubes--due to their high adsorption and desorption capacities--have been employed as sorption substrates in solid-phase extraction for the preconcentration of metal species from diverse matrices. Looking for successive improvements in sensitivity and selectivity, in the past few years, carbon nanotubes have been utilized as sorbents for solid phase extraction in three different ways: like as-grown, oxidized and functionalized nanotubes. In the present paper, an overview of the recent trends in the use of carbon nanotubes for solid phase extraction of metal species in environmental, biological and food samples is presented. The determination procedures involved the adsorption of metals on the nanotube surface, their quantitative desorption and subsequent measurement by means of atomic spectrometric techniques such as flame atomic absorption spectrometry, electrothermal atomic absorption spectrometry or inductively coupled plasma atomic emission spectrometry/mass spectrometry, among others. Synthesis, purification and types of carbon nanotubes, as well as the diverse chemical and physical strategies for their functionalization are described. Based on 140 references, the performance and general properties of the applications of solid phase extraction based on carbon nanotubes for metal species atomic spectrometric determination are discussed.

  6. Effect of atomic interconnects on percolation in single-walled carbon nanotube thin film networks.

    PubMed

    Tian, Xiaojuan; Moser, Matthew L; Pekker, Aron; Sarkar, Santanu; Ramirez, Jason; Bekyarova, Elena; Itkis, Mikhail E; Haddon, Robert C

    2014-07-09

    The formation of covalent bonds to single-walled carbon nanotube (SWNT) or graphene surfaces usually leads to a decrease in the electrical conductivity and mobility as a result of the structural rehybridization of the functionalized carbon atoms from sp(2) to sp(3). In the present study, we explore the effect of metal deposition on semiconducting (SC-) and metallic (MT-) SWNT thin films in the vicinity of the percolation threshold and we are able to clearly delineate the effects of weak physisorption, ionic chemisorption with charge transfer, and covalent hexahapto (η(6)) chemisorption on these percolating networks. The results support the idea that for those metals capable of forming bis-hexahapto-bonds, the generation of covalent (η(6)-SWNT)M(η(6)-SWNT) interconnects provides a conducting pathway in the SWNT films and establishes the transition metal bis-hexahapto organometallic bond as an electronically conjugating linkage between graphene surfaces.

  7. Branched aliphatic alkanes with quaternary substituted carbon atoms in modern and ancient geologic samples.

    SciTech Connect

    Kenig, F.; Simons, D.-J. H.; Crich, D.; Cowen, J. P.; Ventura, G. T.; Rehbein-Khalily, T.; Brown, T. C.; Anderson, K. B.; Chemistry; Univ. of Illinois at Chicago; Univ. of Hawaii

    2003-01-01

    A pseudohomologous series of branched aliphatic alkanes with a quaternary substituted carbon atom (BAQCs, specifically 2,2-di-methylalkanes and 3,3- and 5,5-diethylalkanes) were identified in warm (65{sup o}C) deep-sea hydrothermal waters and Late Cretaceous black shales. 5,5-Diethylalkanes were also observed in modern and Holocene marine shelf sediments and in shales spanning the last 800 million years of the geological record. The carbon number distribution of BAQCs indicates a biological origin. These compounds were observed but not identified in previous studies of 2.0 billion- to 2.2 billion-year-old metasediments and were commonly misidentified in other sediment samples, indicating that BAQCs are widespread in the geological record. The source organisms of BAQCs are unknown, but their paleobiogeographic distribution suggests that they have an affinity for sulfides and might be nonphotosynthetic sulfide oxidizers.

  8. Determination of mercury in carbon black by cold vapor atomic absorption spectrometry.

    PubMed

    Hepp, Nancy M

    2006-01-01

    Recently, a new color additive, D&C Black No. 2, a high-purity furnace black in the general category of carbon blacks, was listed as a color subject to batch certification by the U.S. Food and Drug Administration. A simple procedure was developed to determine mercury (Hg) in D&C Black No. 2, which is limited by specification to not more than 1 ppm Hg. The method uses partial acid digestion followed by cold vapor atomic absorption and was developed by modifying a method used for other color additives. The carbon black samples are treated with a mixture of nitric and hydrochloric acids and heated by microwave in sealed Teflon vessels. The resulting solutions, which are stable to Hg loss for at least 1 week, are diluted and analyzed for Hg using cold vapor atomic absorption spectrometry. Validation was performed by spiking carbon black samples with inorganic Hg (HgNO3) at levels from 0.1 to 1.5 microg/g, and by analyzing 2 standard reference materials. At the specification level of 1 ppm Hg (1 microg Hg/g), the 95% confidence interval was +/-0.01 ppm Hg (0.01 microg Hg/g). The method developed in this study gave good results for very difficult-to-analyze materials, such as coal standard reference materials and carbon black. By eliminating volatility and adsorption factors through the formation of HgCl4(-2) complexes, one can avoid using extremely hazardous acids such as HF and HClO4.

  9. Wire Wise.

    ERIC Educational Resources Information Center

    Swanquist, Barry

    1998-01-01

    Discusses how today's technology is encouraging schools to invest in furnishings that are adaptable to computer use and telecommunications access. Explores issues concerning modularity, wiring management, ergonomics, durability, price, and aesthetics. (GR)

  10. Wire Wise.

    ERIC Educational Resources Information Center

    Swanquist, Barry

    1998-01-01

    Discusses how today's technology is encouraging schools to invest in furnishings that are adaptable to computer use and telecommunications access. Explores issues concerning modularity, wiring management, ergonomics, durability, price, and aesthetics. (GR)

  11. Transfer impedance measurements of the space shuttle Solid Rocket Motor (SRM) joints, wire meshes and a carbon graphite motor case

    NASA Technical Reports Server (NTRS)

    Papazian, Peter B.; Perala, Rodney A.; Curry, John D.; Lankford, Alan B.; Keller, J. David

    1988-01-01

    Using three different current injection methods and a simple voltage probe, transfer impedances for Solid Rocket Motor (SRM) joints, wire meshes, aluminum foil, Thorstrand and a graphite composite motor case were measured. In all cases, the surface current distribution for the particular current injection device was calculated analytically or by finite difference methods. The results of these calculations were used to generate a geometric factor which was the ratio of total injected current to surface current density. The results were validated in several ways. For wire mesh measurements, results showed good agreement with calculated results for a 14 by 18 Al screen. SRM joint impedances were independently verified. The filiment wound case measurement results were validated only to the extent that their curve shape agrees with the expected form of transfer impedance for a homogeneous slab excited by a plane wave source.

  12. Effect of carbon and alloying solute atoms on helium behaviors in α-Fe

    NASA Astrophysics Data System (ADS)

    Zhang, Yange; You, Yu-Wei; Xu, Yichun; Liu, C. S.; Chen, J. L.; Luo, G.-N.

    2017-02-01

    Helium bubbles could strongly degrade the mechanical properties of ferritic steels in fission and fusion systems. The formation of helium bubble is directly affected by the interactions between helium and the compositions in steels, such as solute atoms, carbon and irradiation defects. We thereby performed systematical first-principles calculations to investigate the interactions of solute-helium and carbon-solute-helium. It is found that substitutional helium is more attractive than interstitial helium to all the considered 3p, 4p, 5p and 6p solutes. The attraction between carbon and substitutional helium suggests the carbon-solute-helium complex can be formed stably. By examining the charge density difference and thermal stability, it is found that the ternary complex shows stronger attraction with He than that of solute-helium pair for some solutes (S, Se, In, Te, Pb and Bi) and the complex could existed in iron stably at 700 K. The present theoretical results may be helpful for exploring alloy additions to mitigate the formation of large helium bubbles.

  13. Effect of elliptical deformation on molecular polarizabilities of model carbon nanotubes from atomic increments.

    PubMed

    Torrens, Francisco

    2003-08-01

    The interacting induced dipole polarization model implemented in our program POLAR is used for the calculation of the dipole-dipole polarizability alpha. The method is tested with single-wall carbon nanotube models as a function of nanotube radius and elliptical deformation. The results for polarizability follow the same trend as reference calculations performed with our version of the program PAPID. For the zigzag tubes, the polarizability is found to follow a remarkably simple law, that is, it varies as the inverse of the radius. A dramatic effect is also found with elliptical deformation. It is found that the polarizability and related properties can be modified continuously and reversibly by the external radial deformation. These results suggest an interesting technology in which mechanical deformation can control chemical properties of the carbon nanotubes. POLAR calculations differentiate more effectively than PAPID computations among single-wall nanotube models with increasing radial deformation. Different effective polarizabilities are calculated for the atoms at the highest and lowest curvature sites. POLAR calculations discriminate more efficiently than PAPID computations between the effective polarizabilities of the highest and lowest curvature sites. This remarkable and significant tunable polarizability can have important implications for metal coverage of metals on nanotubes and selective adsorption and desorption of foreign atoms and molecules on nanotubes and can lead to a wide variety of technological applications, such as catalysts, hydrogen storage, magnetic tubes, etc.

  14. Cluster protein structures using recurrence quantification analysis on coordinates of alpha-carbon atoms of proteins

    NASA Astrophysics Data System (ADS)

    Zhou, Yu; Yu, Zu-Guo; Anh, Vo

    2007-08-01

    The 3-dimensional coordinates of alpha-carbon atoms of proteins are used to distinguish the protein structural classes based on recurrence quantification analysis (RQA). We consider two independent variables from RQA of coordinates of alpha-carbon atoms, %determ1 and %determ2, which were defined by Webber et al. [C.L. Webber Jr., A. Giuliani, J.P. Zbilut, A. Colosimo, Proteins Struct. Funct. Genet. 44 (2001) 292]. The variable %determ2 is used to define two new variables, %determ21 and %determ22. Then three variables %determ1, %determ21 and %determ22 are used to construct a 3-dimensional variable space. Each protein is represented by a point in this variable space. The points corresponding to proteins from the α, β, α+β and α/β structural classes position into different areas in this variable space. In order to give a quantitative assessment of our clustering on the selected proteins, Fisher's discriminant algorithm is used. Numerical results indicate that the discriminant accuracies are very high and satisfactory.

  15. Carbon-, sulfur-, and phosphorus-based charge transfer reactions in inductively coupled plasma-atomic emission spectrometry

    NASA Astrophysics Data System (ADS)

    Grindlay, Guillermo; Gras, Luis; Mora, Juan; de Loos-Vollebregt, Margaretha T. C.

    2016-01-01

    In this work, the influence of carbon-, sulfur-, and phosphorus-based charge transfer reactions on the emission signal of 34 elements (Ag, Al, As, Au, B, Ba, Be, Ca, Cd, Co, Cr, Cu, Fe, Ga, Hg, I, In, Ir, K, Li, Mg, Mn, Na, Ni, P, Pb, Pd, Pt, S, Sb, Se, Sr, Te, and Zn) in axially viewed inductively coupled plasma-atomic emission spectrometry has been investigated. To this end, atomic and ionic emission signals for diluted glycerol, sulfuric acid, and phosphoric acid solutions were registered and results were compared to those obtained for a 1% w w- 1 nitric acid solution. Experimental results show that the emission intensities of As, Se, and Te atomic lines are enhanced by charge transfer from carbon, sulfur, and phosphorus ions. Iodine and P atomic emission is enhanced by carbon- and sulfur-based charge transfer whereas the Hg atomic emission signal is enhanced only by carbon. Though signal enhancement due to charge transfer reactions is also expected for ionic emission lines of the above-mentioned elements, no experimental evidence has been found with the exception of Hg ionic lines operating carbon solutions. The effect of carbon, sulfur, and phosphorus charge transfer reactions on atomic emission depends on (i) wavelength characteristics. In general, signal enhancement is more pronounced for electronic transitions involving the highest upper energy levels; (ii) plasma experimental conditions. The use of robust conditions (i.e. high r.f. power and lower nebulizer gas flow rates) improves carbon, sulfur, and phosphorus ionization in the plasma and, hence, signal enhancement; and (iii) the presence of other concomitants (e.g. K or Ca). Easily ionizable elements reduce ionization in the plasma and consequently reduce signal enhancement due to charge transfer reactions.

  16. Hierarchical MoS2 tubular structures internally wired by carbon nanotubes as a highly stable anode material for lithium-ion batteries.

    PubMed

    Chen, Yu Ming; Yu, Xin Yao; Li, Zhen; Paik, Ungyu; Lou, Xiong Wen David

    2016-07-01

    Molybdenum disulfide (MoS2), a typical two-dimensional material, is a promising anode material for lithium-ion batteries because it has three times the theoretical capacity of graphite. The main challenges associated with MoS2 anodes are the structural degradation and the low rate capability caused by the low intrinsic electric conductivity and large strain upon cycling. Here, we design hierarchical MoS2 tubular structures internally wired by carbon nanotubes (CNTs) to tackle these problems. These porous MoS2 tubular structures are constructed from building blocks of ultrathin nanosheets, which are believed to benefit the electrochemical reactions. Benefiting from the unique structural and compositional characteristics, these CNT-wired MoS2 tubular structures deliver a very high specific capacity of ~1320 mAh g(-1) at a current density of 0.1 A g(-1), exceptional rate capability, and an ultralong cycle life of up to 1000 cycles. This work may inspire new ideas for constructing high-performance electrodes for electrochemical energy storage.

  17. Hierarchical MoS2 tubular structures internally wired by carbon nanotubes as a highly stable anode material for lithium-ion batteries

    PubMed Central

    Chen, Yu Ming; Yu, Xin Yao; Li, Zhen; Paik, Ungyu; Lou, Xiong Wen (David)

    2016-01-01

    Molybdenum disulfide (MoS2), a typical two-dimensional material, is a promising anode material for lithium-ion batteries because it has three times the theoretical capacity of graphite. The main challenges associated with MoS2 anodes are the structural degradation and the low rate capability caused by the low intrinsic electric conductivity and large strain upon cycling. Here, we design hierarchical MoS2 tubular structures internally wired by carbon nanotubes (CNTs) to tackle these problems. These porous MoS2 tubular structures are constructed from building blocks of ultrathin nanosheets, which are believed to benefit the electrochemical reactions. Benefiting from the unique structural and compositional characteristics, these CNT-wired MoS2 tubular structures deliver a very high specific capacity of ~1320 mAh g−1 at a current density of 0.1 A g−1, exceptional rate capability, and an ultralong cycle life of up to 1000 cycles. This work may inspire new ideas for constructing high-performance electrodes for electrochemical energy storage. PMID:27453938

  18. Effect of cooling rate after hot rolling and of multistage strain aging on the drawability of low-carbon-steel wire rod

    NASA Astrophysics Data System (ADS)

    Taheri, A. Karimi; Maccagno, T. M.; Jonas, J. J.

    1995-05-01

    Tensile testing was used to simulate the multistage strain aging occurring in low-C steel during the relatively short intervals between dies in a multiple-die wire-drawing machine. The effects were examined of three simulated post-hot-rolling cooling rates and three thermal treatments on the strain-aging susceptibility of a high- and a low-N steel. This was measured by applying a 6 pct tensile strain, followed by aging at either 65° or 100 °C for 20 seconds, and then pulling the specimen to failure at room temperature. Increases in flow stress and decreases in the elongation to fracture both indicated high susceptibility to strain aging. It was found that the nitrogen content, the cooling rate from the hot-rolling temperature to about 300 °C, as well as the cooling rate below 300 °C, all have dramatic effects on the strain-aging behavior. Moreover, multistage strain aging is more severe than single-stage strain aging. The implications of these observations on increasing the drawability of low-carbon-steel wire are discussed.

  19. New bonding modes of carbon and heavier group 14 atoms Si-Pb.

    PubMed

    Frenking, Gernot; Tonner, Ralf; Klein, Susanne; Takagi, Nozomi; Shimizu, Takayazu; Krapp, Andreas; Pandey, Krishna K; Parameswaran, Pattiyil

    2014-07-21

    Recent theoretical studies are reviewed which show that the naked group 14 atoms E = C-Pb in the singlet (1)D state behave as bidentate Lewis acids that strongly bind two σ donor ligands L in the donor-acceptor complexes L→E←L. Tetrylones EL2 are divalent E(0) compounds which possess two lone pairs at E. The unique electronic structure of tetrylones (carbones, silylones, germylones, stannylones, plumbylones) clearly distinguishes them from tetrylenes ER2 (carbenes, silylenes, germylenes, stannylenes, plumbylenes) which have electron-sharing bonds R-E-R and only one lone pair at atom E. The different electronic structures of tetrylones and tetrylenes are revealed by charge- and energy decomposition analyses and they become obvious experimentally by a distinctively different chemical reactivity. The unusual structures and chemical behaviour of tetrylones EL2 can be understood in terms of the donor-acceptor interactions L→E←L. Tetrylones are potential donor ligands in main group compounds and transition metal complexes which are experimentally not yet known. The review also introduces theoretical studies of transition metal complexes [TM]-E which carry naked tetrele atoms E = C-Sn as ligands. The bonding analyses suggest that the group-14 atoms bind in the (3)P reference state to the transition metal in a combination of σ and π∥ electron-sharing bonds TM-E and π⊥ backdonation TM→E. The unique bonding situation of the tetrele complexes [TM]-E makes them suitable ligands in adducts with Lewis acids. Theoretical studies of [TM]-E→W(CO)5 predict that such species may becomes synthesized.

  20. Simple-Cubic Carbon Frameworks with Atomically Dispersed Iron Dopants toward High-Efficiency Oxygen Reduction.

    PubMed

    Wang, Biwei; Wang, Xinxia; Zou, Jinxiang; Yan, Yancui; Xie, Songhai; Hu, Guangzhi; Li, Yanguang; Dong, Angang

    2017-03-08

    Iron and nitrogen codoped carbons (Fe-N-C) have attracted increasingly greater attention as electrocatalysts for oxygen reduction reaction (ORR). Although challenging, the synthesis of Fe-N-C catalysts with highly dispersed and fully exposed active sites is of critical importance for improving the ORR activity. Here, we report a new type of graphitic Fe-N-C catalysts featuring numerous Fe single atoms anchored on a three-dimensional simple-cubic carbon framework. The Fe-N-C catalyst, derived from self-assembled Fe3O4 nanocube superlattices, was prepared by in situ ligand carbonization followed by acid etching and ammonia activation. Benefiting from its homogeneously dispersed and fully accessible active sites, highly graphitic nature, and enhanced mass transport, our Fe-N-C catalyst outperformed Pt/C and many previously reported Fe-N-C catalysts for ORR. Furthermore, when used for constructing the cathode for zinc-air batteries, our Fe-N-C catalyst exhibited current and power densities comparable to those of the state-of-the-art Pt/C catalyst.

  1. Conformal atomic layer deposition of alumina on millimeter tall, vertically-aligned carbon nanotube arrays.

    PubMed

    Stano, Kelly L; Carroll, Murphy; Padbury, Richard; McCord, Marian; Jur, Jesse S; Bradford, Philip D

    2014-11-12

    Atomic layer deposition (ALD) can be used to coat high aspect ratio and high surface area substrates with conformal and precisely controlled thin films. Vertically aligned arrays of multiwalled carbon nanotubes (MWCNTs) with lengths up to 1.5 mm were conformally coated with alumina from base to tip. The nucleation and growth behaviors of Al2O3 ALD precursors on the MWCNTs were studied as a function of CNT surface chemistry. CNT surfaces were modified through a series of post-treatments including pyrolytic carbon deposition, high temperature thermal annealing, and oxygen plasma functionalization. Conformal coatings were achieved where post-treatments resulted in increased defect density as well as the extent of functionalization, as characterized by X-ray photoelectron spectroscopy and Raman spectroscopy. Using thermogravimetric analysis, it was determined that MWCNTs treated with pyrolytic carbon and plasma functionalization prior to ALD coating were more stable to thermal oxidation than pristine ALD coated samples. Functionalized and ALD coated arrays had a compressive modulus more than two times higher than a pristine array coated for the same number of cycles. Cross-sectional energy dispersive X-ray spectroscopy confirmed that Al2O3 could be uniformly deposited through the entire thickness of the vertically aligned MWCNT array by manipulating sample orientation and mounting techniques. Following the ALD coating, the MWCNT arrays demonstrated hydrophilic wetting behavior and also exhibited foam-like recovery following compressive strain.

  2. Atomic-Layer-Deposition Functionalized Carbonized Mesoporous Wood Fiber for High Sulfur Loading Lithium Sulfur Batteries.

    PubMed

    Luo, Chao; Zhu, Hongli; Luo, Wei; Shen, Fei; Fan, Xiulin; Dai, Jiaqi; Liang, Yujia; Wang, Chunsheng; Hu, Liangbing

    2017-04-14

    Lithium-sulfur battery (LSB) as one of the most promising energy storage devices suffers from poor conductivity of sulfur and fast capacity decay triggered by the dissolution of polysulfides. In this work, functionalized carbonized mesoporous wood fiber (f-CMWF) is employed as a host to accommodate sulfur for the first time. Natural wood microfiber has unique hierarchical and mesoporous structure, which is well maintained after carbonization. With such a hierarchical mesoporous structure, a high sulfur loading of 76 wt% is achieved in CMWF electrodes. The pore size of CMWF is tunable by atomic layer deposition (ALD) of 5 nm Al2O3 coating to form the f-CMWF. Such a thin layer coating slightly decreases the sulfur loading to 70%, but remarkably promotes the cyclic stability of sulfur cathode, which delivers an initial capacity of 1115 mAh g-1, and maintains a reversible capacity of 859 mAh g-1 for 450 cycles, corresponding to a slow capacity decay rate of 0.046% per cycle. More importantly, natural wood microfiber is firstly used as a raw material for sulfur encapsulating. This work is also critical for using low cost and mesoporous biomass carbon as bi-functional scaffold for LSB.

  3. DFT study of Fe-Ni core-shell nanoparticles: Stability, catalytic activity, and interaction with carbon atom for single-walled carbon nanotube growth

    SciTech Connect

    Yang, Zhimin; Wang, Qiang Shan, Xiaoye; Zhu, Hongjun; Li, Wei-qi; Chen, Guang-hui

    2015-02-21

    Metal catalysts play an important role in the nucleation and growth of single-walled carbon nanotubes (SWCNTs). It is essential for probing the nucleation and growth mechanism of SWCNTs to fundamentally understand the properties of the metal catalysts and their interaction with carbon species. In this study, we systematically studied the stability of 13- and 55-atom Fe and Fe-Ni core-shell particles as well as these particles interaction with the carbon atoms using the density functional theory calculations. Icosahedral 13- and 55-atom Fe-Ni core-shell bimetallic particles have higher stability than the corresponding monometallic Fe and Ni particles. Opposite charge transfer (or distribution) in these particles leads to the Fe surface-shell displays a positive charge, while the Ni surface-shell exhibits a negative charge. The opposite charge transfer would induce different chemical activities. Compared with the monometallic Fe and Ni particles, the core-shell bimetallic particles have weaker interaction with C atoms. More importantly, C atoms only prefer staying on the surface of the bimetallic particles. In contrast, C atoms prefer locating into the subsurface of the monometallic particles, which is more likely to form stable metal carbides. The difference of the mono- and bimetallic particles on this issue may result in different nucleation and growth mechanism of SWCNTs. Our findings provide useful insights for the design of bimetallic catalysts and a better understanding nucleation and growth mechanism of SWCNTs.

  4. DFT study of Fe-Ni core-shell nanoparticles: Stability, catalytic activity, and interaction with carbon atom for single-walled carbon nanotube growth

    NASA Astrophysics Data System (ADS)

    Yang, Zhimin; Wang, Qiang; Shan, Xiaoye; Li, Wei-qi; Chen, Guang-hui; Zhu, Hongjun

    2015-02-01

    Metal catalysts play an important role in the nucleation and growth of single-walled carbon nanotubes (SWCNTs). It is essential for probing the nucleation and growth mechanism of SWCNTs to fundamentally understand the properties of the metal catalysts and their interaction with carbon species. In this study, we systematically studied the stability of 13- and 55-atom Fe and Fe-Ni core-shell particles as well as these particles interaction with the carbon atoms using the density functional theory calculations. Icosahedral 13- and 55-atom Fe-Ni core-shell bimetallic particles have higher stability than the corresponding monometallic Fe and Ni particles. Opposite charge transfer (or distribution) in these particles leads to the Fe surface-shell displays a positive charge, while the Ni surface-shell exhibits a negative charge. The opposite charge transfer would induce different chemical activities. Compared with the monometallic Fe and Ni particles, the core-shell bimetallic particles have weaker interaction with C atoms. More importantly, C atoms only prefer staying on the surface of the bimetallic particles. In contrast, C atoms prefer locating into the subsurface of the monometallic particles, which is more likely to form stable metal carbides. The difference of the mono- and bimetallic particles on this issue may result in different nucleation and growth mechanism of SWCNTs. Our findings provide useful insights for the design of bimetallic catalysts and a better understanding nucleation and growth mechanism of SWCNTs.

  5. Energy of the Isolated Metastable Iron-Nickel FCC Nanocluster with a Carbon Atom in the Tetragonal Interstice.

    PubMed

    Bondarenko, Natalya V; Nedolya, Anatoliy V

    2017-12-01

    The energy of the isolated iron-nickel nanocluster was calculated by molecular mechanics method using Lennard-Jones potential. The cluster included a carbon atom that drifted from an inside octahedral interstice to a tetrahedral interstice in [Formula: see text] direction and after that in <222> direction to the surface. In addition, one of 14 iron atoms was replaced by a nickel atom, the position of which was changing during simulation.The energy of the nanocluster was estimated at the different interatomic distances. As a result of simulation, the optimal interatomic distances of Fe-Ni-C nanocluster was chosen for the simulation, in which height of the potential barrier was maximal and face-centered cubic (FCC) nanocluster was the most stable.It is shown that there were three main positions of a nickel atom that significantly affected nanocluster's energy.The calculation results indicated that position of the carbon atom in the octahedral interstice was more energetically favorable than tetrahedral interstice in the case of FCC nanocluster. On the other side, the potential barrier was smaller in the direction [Formula: see text] than in the direction <022>.This indicates that there are two ways for carbon atom to drift to the surface of the nanocluster.

  6. Modeling and optimization of atomic layer deposition processes on vertically aligned carbon nanotubes.

    PubMed

    Yazdani, Nuri; Chawla, Vipin; Edwards, Eve; Wood, Vanessa; Park, Hyung Gyu; Utke, Ivo

    2014-01-01

    Many energy conversion and storage devices exploit structured ceramics with large interfacial surface areas. Vertically aligned carbon nanotube (VACNT) arrays have emerged as possible scaffolds to support large surface area ceramic layers. However, obtaining conformal and uniform coatings of ceramics on structures with high aspect ratio morphologies is non-trivial, even with atomic layer deposition (ALD). Here we implement a diffusion model to investigate the effect of the ALD parameters on coating kinetics and use it to develop a guideline for achieving conformal and uniform thickness coatings throughout the depth of ultra-high aspect ratio structures. We validate the model predictions with experimental data from ALD coatings of VACNT arrays. However, the approach can be applied to predict film conformality as a function of depth for any porous topology, including nanopores and nanowire arrays.

  7. Single-walled carbon nanotubes coated with ZnO by atomic layer deposition

    NASA Astrophysics Data System (ADS)

    Pal, Partha P.; Gilshteyn, Evgenia; Jiang, Hua; Timmermans, Marina; Kaskela, Antti; Tolochko, Oleg V.; Kurochkin, Alexey V.; Karppinen, Maarit; Nisula, Mikko; Kauppinen, Esko I.; Nasibulin, Albert G.

    2016-12-01

    The possibility of ZnO deposition on the surface of single-walled carbon nanotubes (SWCNTs) with the help of an atomic layer deposition (ALD) technique was successfully demonstrated. The utilization of pristine SWCNTs as a support resulted in a non-uniform deposition of ZnO in the form of nanoparticles. To achieve uniform ZnO coating, the SWCNTs first needed to be functionalized by treating the samples in a controlled ozone atmosphere. The uniformly ZnO coated SWCNTs were used to fabricate UV sensing devices. An UV irradiation of the ZnO coated samples turned them from hydrophobic to hydrophilic behaviour. Furthermore, thin films of the ZnO coated SWCNTs allowed us switch p-type field effect transistors made of pristine SWCNTs to have ambipolar characteristics.

  8. Ultra-low loading Pt nanocatalysts prepared by atomic layer deposition on carbon aerogels

    SciTech Connect

    King, J S; Wittstock, A; Biener, J; Kucheyev, S O; Wang, Y M; Baumann, T F; Giri, S; Hamza, A V; Baeumer, M; Bent, S F

    2008-04-21

    Using atomic layer deposition (ALD), we show that Pt nanoparticles can be deposited on the inner surfaces of carbon aerogels (CA). The resultant Pt-loaded materials exhibit high catalytic activity for the oxidation of CO even at loading levels as low as {approx}0.05 mg Pt/cm{sup 2}. We observe a conversion efficiency of nearly 100% in the temperatures range 150-250 C, and the total conversion rate seems to be only limited by the thermal stability of our CA support in ambient oxygen. Our ALD approach described here is universal in nature, and can be applied to the design of new catalytic materials for a variety of applications, including fuel cells, hydrogen storage, pollution control, green chemistry, and liquid fuel production.

  9. Atomic force microscopy of silica nanoparticles and carbon nanohorns in macrophages and red blood cells.

    PubMed

    Tetard, L; Passian, A; Farahi, R H; Thundat, T

    2010-05-01

    The emerging interest in understanding the interactions of nanomaterial with biological systems necessitates imaging tools that capture the spatial and temporal distributions and attributes of the resulting nano-bio amalgam. Studies targeting organ specific response and/or nanoparticle-specific system toxicity would be profoundly benefited from tools that would allow imaging and tracking of in-vivo or in-vitro processes and particle-fate studies. Recently we demonstrated that mode synthesizing atomic force microscopy (MSAFM) can provide subsurface nanoscale information on the mechanical properties of materials at the nanoscale. However, the underlying mechanism of this imaging methodology is currently subject to theoretical and experimental investigation. In this paper we present further analysis by investigating tip-sample excitation forces associated with nanomechanical image formation. Images and force curves acquired under various operational frequencies and amplitudes are presented. We examine samples of mouse cells, where buried distributions of single-walled carbon nanohorns and silica nanoparticles are visualized.

  10. Carbon nanotube modified probes for stable and high sensitivity conductive atomic force microscopy

    NASA Astrophysics Data System (ADS)

    Slattery, Ashley D.; Shearer, Cameron J.; Gibson, Christopher T.; Shapter, Joseph G.; Lewis, David A.; Stapleton, Andrew J.

    2016-11-01

    Conductive atomic force microscopy (C-AFM) is used to characterise the nanoscale electrical properties of many conducting and semiconducting materials. We investigate the effect of single walled carbon nanotube (SWCNT) modification of commercial Pt/Ir cantilevers on the sensitivity and image stability during C-AFM imaging. Pt/Ir cantilevers were modified with small bundles of SWCNTs via a manual attachment procedure and secured with a conductive platinum pad. AFM images of topography and current were collected from heterogeneous polymer and nanomaterial samples using both standard and SWCNT modified cantilevers. Typically, achieving a good current image comes at the cost of reduced feedback stability. In part, this is due to electrostatic interaction and increased tip wear upon applying a bias between the tip and the sample. The SWCNT modified tips displayed superior current sensitivity and feedback stability which, combined with superior wear resistance of SWCNTs, is a significant advancement for C-AFM.

  11. Modeling and optimization of atomic layer deposition processes on vertically aligned carbon nanotubes

    PubMed Central

    Yazdani, Nuri; Chawla, Vipin; Edwards, Eve; Wood, Vanessa

    2014-01-01

    Summary Many energy conversion and storage devices exploit structured ceramics with large interfacial surface areas. Vertically aligned carbon nanotube (VACNT) arrays have emerged as possible scaffolds to support large surface area ceramic layers. However, obtaining conformal and uniform coatings of ceramics on structures with high aspect ratio morphologies is non-trivial, even with atomic layer deposition (ALD). Here we implement a diffusion model to investigate the effect of the ALD parameters on coating kinetics and use it to develop a guideline for achieving conformal and uniform thickness coatings throughout the depth of ultra-high aspect ratio structures. We validate the model predictions with experimental data from ALD coatings of VACNT arrays. However, the approach can be applied to predict film conformality as a function of depth for any porous topology, including nanopores and nanowire arrays. PMID:24778944

  12. Cyanide Ligand Assembly by Carbon Atom Transfer to an Iron Nitride

    DOE PAGES

    Martinez, Jorge L.; Lin, Hsiu-Jung; Lee, Wei-Tsung; ...

    2017-09-21

    The new iron(IV) nitride complex PhB(iPr2Im)3Fe≡N reacts with two equivalents of bis(diisopropylamino)cyclopropenylidene (BAC) to provide PhB(iPr2Im)3Fe(CN)(N2)(BAC). This unusual example of a four-electron reaction involves carbon atom transfer from BAC to create a cyanide ligand along with the alkyne iPr2N-C≡C-NiPr2. The iron complex is in equilibrium with an N2- free species. Further reaction with CO leads to formation of a CO analogue, which can be independently prepared using NaCN as the cyanide source, while reaction with B(C6F5)3 provides the cyanoborane derivative.

  13. FORMATION OF FORMALDEHYDE AND CARBON DIOXIDE ON AN ICY GRAIN ANALOG USING FAST HYDROGEN ATOMS

    SciTech Connect

    Madzunkov, S. M.; MacAskill, J. A.; Chutjian, A.; Darrach, M. R.; Vidali, G.; Shortt, B. J.

    2009-05-20

    Formaldehyde (H{sub 2}CO) and carbon dioxide (CO{sub 2}) were produced in collisions of a superthermal, 3 eV beam of H({sup 2}S) atoms with CO molecules adsorbed on a gold surface at 4.8 K. The reaction-generated products were detected and analyzed using the techniques of temperature programmed desorption (TPD), quadrupole mass spectrometry, and a novel application of the Metropolis algorithm, random-walk procedure to identify the unique fractionation patterns of H{sub 2}CO and CO{sub 2} from the patterns of other species such as N{sub 2}, CO, and H{sub 2}O embedded in the CO blanket and devolved in the TPD/mass spectrometry process. Reaction sequences are given to account for the formation of H{sub 2}CO and CO{sub 2}.

  14. Cyanide Ligand Assembly by Carbon Atom Transfer to an Iron Nitride.

    PubMed

    Martinez, Jorge L; Lin, Hsiu-Jung; Lee, Wei-Tsung; Pink, Maren; Chen, Chun-Hsing; Gao, Xinfeng; Dickie, Diane A; Smith, Jeremy M

    2017-10-11

    The new iron(IV) nitride complex PhB((i)Pr2Im)3Fe≡N reacts with 2 equiv of bis(diisopropylamino)cyclopropenylidene (BAC) to provide PhB((i)Pr2Im)3Fe(CN)(N2)(BAC). This unusual example of a four-electron reaction involves carbon atom transfer from BAC to create a cyanide ligand along with the alkyne (i)Pr2N-C≡C-N(i)Pr2. The iron complex is in equilibrium with an N2-free species. Further reaction with CO leads to formation of a CO analogue, which can be independently prepared using NaCN as the cyanide source, while reaction with B(C6F5)3 provides the cyanoborane derivative.

  15. First analysis of radiative properties of moderate-atomic-number planar wire arrays on Zebra at UNR at higher current of 1.7 MA.

    SciTech Connect

    Keim, S. F.; Chuvatin, Alexander S.; Osborne, Glenn C.; Esaulov, Andrey A.; Presura, R.; Shrestha, I.; Kantsyrev, Victor Leonidovich; Shlyaptseva, V.; Coverdale, Christine Anne; Williamson, K. M.; Ouart, Nicholas D.; Astanovitsky, A. L.; Weller, M. E.; Safronova, Alla S.; LeGalloudec, B.

    2010-11-01

    The analysis of implosions of Cu and Ag planar wire array (PWA) loads recently performed at the enhanced 1.7 MA Zebra generator at UNR is presented. Experiments were performed with a Load Current Multiplier with a 1cm anode-cathode gap (twice shorter than in a standard 1 MA mode). A full diagnostic set included more than ten different beam-lines with the major focus on time-gated and time-integrated x-ray imaging and spectra, total radiation yields, and fast, filtered x-ray detector data. In particular, the experimental results for a double PWA load consisting of twelve 10 {micro}m Cu wires in each row (total mass M {approx} 175 {micro}g) and a much heavier single PWA load consisting of ten 30 {micro}m Ag wires (M {approx} 750 {micro}g) were analyzed using a set of theoretical codes. The effects of both a decreased a-c gap and an increased current on radiative properties of these loads are discussed.

  16. First Analysis of Radiative Properties of Moderate-atomic-number Planar Wire Arrays on Zebra at UNR at Higher Current of 1.7 MA*

    NASA Astrophysics Data System (ADS)

    Safronova, A. S.; Kantsyrev, V. L.; Esaulov, A. A.; Astanovitskiy, A.; Legalloudec, B.; Presura, R.; Shrestha, I.; Williamson, K. M.; Shlyaptseva, V.; Weller, M. E.; Ouart, N. D.; Keim, S. F.; Osborne, G. C.; Chuvatin, A. S.; Coverdale, C. A.

    2010-11-01

    The analysis of implosions of Cu and Ag planar wire array (PWA) loads recently performed at the enhanced 1.7 MA Zebra generator at UNR is presented. Experiments were performed with a Load Current Multiplier with a 1cm anode-cathode gap (twice shorter than in a standard 1 MA mode). A full diagnostic set included more than ten different beam-lines with the major focus on time-gated and time-integrated x-ray imaging and spectra, total radiation yields, and fast, filtered x-ray detector data. In particular, the experimental results for a double PWA load consisting of twelve 10μm Cu wires in each row (total mass M ˜ 175 μg) and a much heavier single PWA load consisting of ten 30μm Ag wires (M ˜ 750 μg) were analyzed using a set of theoretical codes. The effects of both a decreased a-c gap and an increased current on radiative properties of these loads are discussed. * This work was supported by NNSA/DOE Coop. Agr. DE-FC52-06NA27588, 27586, and 27616. Sandia is a multi-program laboratory operated by Sandia Co., a LMC, for the US DOE under Contract DE-AC04-94AL85000.

  17. No Wires.

    ERIC Educational Resources Information Center

    DeLoughry, Thomas J.

    1995-01-01

    The University of California at Santa Cruz has completed a successful test of a wireless computer network that would enable students and professors to get on line from anywhere on campus. The network, linked by radio waves, could save millions of dollars in campus wiring costs and would better meet student and faculty information needs. (MSE)

  18. No Wires.

    ERIC Educational Resources Information Center

    DeLoughry, Thomas J.

    1995-01-01

    The University of California at Santa Cruz has completed a successful test of a wireless computer network that would enable students and professors to get on line from anywhere on campus. The network, linked by radio waves, could save millions of dollars in campus wiring costs and would better meet student and faculty information needs. (MSE)

  19. New thermoplastic poly(carbonate-urethane)s based on chain extenders with sulfur atoms.

    PubMed

    Rogulska, Magdalena; Kultys, Anna; Puszka, Andrzej

    2017-01-01

    New thermoplastic segmented polyurethanes were obtained by a one-step melt polyaddition using 40, 50 and 60 mol% poly(hexane-1,6-diyl carbonate) diol of [Formula: see text] g mol(-1), 1,1'-methanediylbis(4-isocyanatobenzene) and 2,2'-[sulfanediylbis(benzene-1,4-diyloxy)]diethanol, 2,2'-[oxybis(benzene-1,4-diylsulfanediyl)]diethanol or 2,2'-[sulfanediylbis(benzene-1,4-diylsulfanediyl)]diethanol as a chain extender. FTIR, atomic force microscopy, differential scanning calorimetry and thermogravimetry were used to examine the polyurethanes' structure and thermal properties. Moreover, their Shore A/D hardness, tensile, adhesive and optical attributes were determined. They were transparent high-molar-mass materials showing good tensile strength (up to 51.9 MPa). The polyurethanes exhibited improved adhesion to copper taking into consideration that of conventional ones, and middle or high refractive index values (1.57-1.60), and both these parameters increased with an increase of the content of sulfur atoms in the polyurethane chain. The newly obtained polyurethanes can be considered as materials for numerous medical and optical appliances.

  20. Some lessons learned on the simulation of atomic-scale stochastic processes in carbon systems

    NASA Astrophysics Data System (ADS)

    Meunier, Vincent; Daniels, Colin; Bullard, Zachary; ICMP Team

    2014-03-01

    The behaviors of many materials are rooted in stochastic processes due to spatial and temporal fluctuations in their nano- and micro- structures. This talk will be the opportunity to present preliminary results on attempts to shed light on the role played by disorder on the dynamical appearance of atomic-scale defects and how these build their way up to mesoscopic length scales and over macroscopic time scales. I will present a simple algorithm that allows translating atomic level properties into scales relevant to devices and materials systems. The algorithm enables the random introduction of elementary mutations in low-dimensional systems and leads to the investigation of the emergence of structures with new functionality and to novel nanostructures resulting from the coalescence of elementary building blocks. The mutations are introduced by local modifications to the connectivity table and are accepted based on a Metropolis algorithm. Externally imposed constraints can be introduced as needed, depending on the actual conditions to be simulated. In addition, the fast prototyping of the effect of mutations on electronic properties is made possible by the ability to enact mutations as perturbation potentials using Dyson equation to update Green functions as mutations are accepted. Results applied to the coalescence, annealing, and phase separation in a number of carbon nanostructures will be shown and compared to experiments when available.

  1. Quantifying the Hierarchical Order in Self-Aligned Carbon Nanotubes from Atomic to Micrometer Scale.

    PubMed

    Meshot, Eric R; Zwissler, Darwin W; Bui, Ngoc; Kuykendall, Tevye R; Wang, Cheng; Hexemer, Alexander; Wu, Kuang Jen J; Fornasiero, Francesco

    2017-06-27

    Fundamental understanding of structure-property relationships in hierarchically organized nanostructures is crucial for the development of new functionality, yet quantifying structure across multiple length scales is challenging. In this work, we used nondestructive X-ray scattering to quantitatively map the multiscale structure of hierarchically self-organized carbon nanotube (CNT) "forests" across 4 orders of magnitude in length scale, from 2.0 Å to 1.5 μm. Fully resolved structural features include the graphitic honeycomb lattice and interlayer walls (atomic), CNT diameter (nano), as well as the greater CNT ensemble (meso) and large corrugations (micro). Correlating orientational order across hierarchical levels revealed a cascading decrease as we probed finer structural feature sizes with enhanced sensitivity to small-scale disorder. Furthermore, we established qualitative relationships for single-, few-, and multiwall CNT forest characteristics, showing that multiscale orientational order is directly correlated with number density spanning 10(9)-10(12) cm(-2), yet order is inversely proportional to CNT diameter, number of walls, and atomic defects. Lastly, we captured and quantified ultralow-q meridional scattering features and built a phenomenological model of the large-scale CNT forest morphology, which predicted and confirmed that these features arise due to microscale corrugations along the vertical forest direction. Providing detailed structural information at multiple length scales is important for design and synthesis of CNT materials as well as other hierarchically organized nanostructures.

  2. Boosting the local anodic oxidation of silicon through carbon nanofiber atomic force microscopy probes.

    PubMed

    Rius, Gemma; Lorenzoni, Matteo; Matsui, Soichiro; Tanemura, Masaki; Perez-Murano, Francesc

    2015-01-01

    Many nanofabrication methods based on scanning probe microscopy have been developed during the last decades. Local anodic oxidation (LAO) is one of such methods: Upon application of an electric field between tip and surface under ambient conditions, oxide patterning with nanometer-scale resolution can be performed with good control of dimensions and placement. LAO through the non-contact mode of atomic force microscopy (AFM) has proven to yield a better resolution and tip preservation than the contact mode and it can be effectively performed in the dynamic mode of AFM. The tip plays a crucial role for the LAO-AFM, because it regulates the minimum feature size and the electric field. For instance, the feasibility of carbon nanotube (CNT)-functionalized tips showed great promise for LAO-AFM, yet, the fabrication of CNT tips presents difficulties. Here, we explore the use of a carbon nanofiber (CNF) as the tip apex of AFM probes for the application of LAO on silicon substrates in the AFM amplitude modulation dynamic mode of operation. We show the good performance of CNF-AFM probes in terms of resolution and reproducibility, as well as demonstration that the CNF apex provides enhanced conditions in terms of field-induced, chemical process efficiency.

  3. Influence of Helium Atoms Absorption on the Emission Properties of Carbon Nanotubes

    NASA Astrophysics Data System (ADS)

    Umaev, S. M.; Levchenko, A. A.; Kolesnikov, N. N.; Filatov, S. V.

    2017-04-01

    We investigated the emission properties of charge sources based on carbon nanotubes prepared by arc discharge deposition of nanotubes onto a flat copper substrate (Borisenko et al. in Instrum Exp Tech 57(6):755, 2014; Low Temp Phys 41(7):567, 2015). The charge sources were submerged into superfluid helium at temperature T=1.3 K. The collector fixed above the charge source at a distance of 0.3 mm was connected to an electrometer. The current of charges was measured by the electrometer when a high voltage was applied to the charge source. In the originally prepared source, the emission of charges (electrons) on the level of 10^{-10}A is observed at a negative voltage above U=80 V and increases with increasing voltage. If the source of charge was kept in liquid helium for 15 h, the current-voltage characteristic changed significantly. The current of charges on the same level of 10^{-10} A was registered at a voltage of U=150 V. Extraction of gases from the source placed in a vacuum chamber at room temperature for 48 h leads to the complete recovery of the emission properties. One can assume that the degradation of the emission properties of the sources is associated with the adsorption of helium atoms by carbon nanotubes at low temperatures. We did not observe any degradation of the emission properties of the charge sources in the case of positive charges injection into superfluid helium.

  4. Boosting the local anodic oxidation of silicon through carbon nanofiber atomic force microscopy probes

    PubMed Central

    Lorenzoni, Matteo; Matsui, Soichiro; Tanemura, Masaki; Perez-Murano, Francesc

    2015-01-01

    Summary Many nanofabrication methods based on scanning probe microscopy have been developed during the last decades. Local anodic oxidation (LAO) is one of such methods: Upon application of an electric field between tip and surface under ambient conditions, oxide patterning with nanometer-scale resolution can be performed with good control of dimensions and placement. LAO through the non-contact mode of atomic force microscopy (AFM) has proven to yield a better resolution and tip preservation than the contact mode and it can be effectively performed in the dynamic mode of AFM. The tip plays a crucial role for the LAO-AFM, because it regulates the minimum feature size and the electric field. For instance, the feasibility of carbon nanotube (CNT)-functionalized tips showed great promise for LAO-AFM, yet, the fabrication of CNT tips presents difficulties. Here, we explore the use of a carbon nanofiber (CNF) as the tip apex of AFM probes for the application of LAO on silicon substrates in the AFM amplitude modulation dynamic mode of operation. We show the good performance of CNF-AFM probes in terms of resolution and reproducibility, as well as demonstration that the CNF apex provides enhanced conditions in terms of field-induced, chemical process efficiency. PMID:25671165

  5. In vitro comparison of the hemocompatibility of diamond-like carbon and carbon nitride coatings with different atomic percentages of N.

    PubMed

    Zhao, Mengli; Li, Dejun; Zhang, Yiteng; Guo, Meixian; Deng, Xiangyun; Gu, Hanqing; Wan, Rongxin

    2012-04-01

    Carbon nitride (CN( x )) and diamond-like carbon (DLC) coatings were prepared by dc magnetron sputtering at room temperature. Different partial pressures of N(2) were used to synthesize CN( x ) to evaluate the relationship between the atomic percentage of nitrogen and hemocompatibility. Auger electron spectroscopy and atomic force microscopy indicated atomic percentages of N of 0.12 and 0.22 and that the CN( x ) coatings were smooth. An in vitro study of the hemocompatibility of the coatings revealed that both CN( x ) coatings had better anticoagulant properties and lower platelet adhesion than DLC. Compared with CN(0.12), the CN(0.22) coating showed longer dynamic clotting time (about 42 min), static clotting time (23.6 min) and recalcification time (45.6 s), as well as lower platelet adhesion (102 cells μm(-2)), aggregation, and activation. The presence of nitrogen in the CN( x ) coatings induced their enhanced hemocompatibility compared with DLC.

  6. Phosphorus in antique iron music wire.

    PubMed

    Goodway, M

    1987-05-22

    Harpsichords and other wire-strung musical instruments were made with longer strings about the beginning of the 17th century. This change required stronger music wire. Although these changes coincided with the introduction of the first mass-produced steel (iron alloyed with carbon), carbon was not found in samples of antique iron harpsichord wire. The wire contained an amount of phosphorus sufficient to have impeded its conversion to steel, and may have been drawn from iron rejected for this purpose. The method used to select pig iron for wire drawing ensured the highest possible phosphorus content at a time when its presence in iron was unsuspected. Phosphorus as an alloying element has had the reputation for making steel brittle when worked cold. Nevertheless, in replicating the antique wire, it was found that lowcarbon iron that contained 0.16 percent phosphorus was easily drawn to appropriate gauges and strengths for restringing antique harpsichords.

  7. Studies of single walled carbon nanotubes for biomedical, mechanical and electrical applications using atomic force microscopy

    NASA Astrophysics Data System (ADS)

    Lahiji, Roya Roientan

    The promise of carbon nanotubes to provide high-strength composites implies that carbon nanotubes might find widespread use throughout the world, implying that humans everywhere will be exposed to carbon nanotube-containing materials. In order to study what effects if any carbon nanotubes might have on the function of living cells, we have studied the association of single stranded DNA (ssDNA) with single wall carbon nanotubes (SWCNTs) as a first step toward understanding the interaction of SWCNTs with living matter. Studies have been performed on both as-received and chemically oxidized SWCNTs to better understand the preferential association of ssDNA with SWCNTs. Samples of T30 ssDNA:SWCNT were examined under ambient conditions using non-contact Atomic Force Microscopy (AFM)) techniques. AFM images of well-dispersed, as-received SWCNTs revealed isolated features on the SWCNT that are 1.4 to 2.8 nm higher than the bare SWCNT itself. X-ray Photoemission Spectroscopy (XPS) confirmed these features to be T30 ssDNA in nature. Chemically oxidizing SWCNTs before dispersion by sonication is found to be an effective way to increase the number of T30 ssDNA features. A series of experiments showed that free radical scavengers such as ascorbic acid and trolox can effectively prevent the conjugation of ssDNA to SWCNTs, suggesting a significant role of free radicals in this association. Also hybridization of the complimentary ssDNA sequences showed the covalent nature of this association. These results are important to understanding the precise mechanism of ssDNA:SWCNT association and provide valuable information for future use in electronics, biosensors and as a possible drug carrier into individual cells. If SWCNTs are used in biosensor or circuit design applications then it is important to note how much energy can be stored in a SWCNT based on its shape and configuration before a permanent damage is introduced to it. Therefore a study has been done on bending SWCNTs into

  8. Carbon-isotopic analysis of individual pollen grains from C 3 and C 4 grasses using a spooling-wire microcombustion interface

    NASA Astrophysics Data System (ADS)

    Nelson, David M.; Hu, Feng Sheng; Mikucki, Jill A.; Tian, Jian; Pearson, Ann

    2007-08-01

    Pollen grains from grasses using the C 3 and C 4 photosynthetic pathways have distinct ranges of δ 13C values that may be used to estimate their relative abundance in paleorecords. We evaluated a spooling-wire microcombustion device interfaced with an isotope-ratio mass spectrometer (SWiM-IRMS) for δ 13C analysis of individual grass-pollen grains. Pollen from four C 3 and four C 4 grass species was isolated through micromanipulation and analyzed as single grains suspended in water. A carbon yield greater than the 2 σ range of the carbon content of blanks containing only water was used to distinguish samples containing pollen ("pollen present") from those not containing pollen. This criterion resulted in the exclusion of ˜45% of the 946 samples applied to the wire. The average δ 13C values (±1 σ) of the remaining samples were -26.9‰ (±6.3‰) and -11.5‰ (±9.6‰) for C 3 grasses and C 4 grasses, respectively, after blank-correcting the δ 13C data. These results suggest that the SWiM-IRMS system can be used to distinguish C 3 from C 4 grass pollen. The high variability in measured δ 13C values is likely caused by a combination of factors. These include natural isotopic variability among individual pollen grains; the relatively poor precision that can be obtained when determining δ 13C values of such small samples; and the uncertainty in the magnitude, isotopic composition, and stability of the analytical blank. Nonetheless, high percentages of individual pollen grains were correctly classified as being of either C 3 or C 4 origin. On average, 90% (range = 78-100%) of pollen grains from C 3 grasses had δ 13C values more negative than the cutoff threshold of -19.2‰; while 84% (range = 77-90%) of pollen grains from C 4 grasses had δ 13C values more positive than -19.2‰. Compared with analysis using an elemental analyzer interfaced with an IRMS (EA-IRMS), the number of pollen grains required for δ 13C-based evaluation of C 3/C 4 grass composition

  9. Surface modification of nitrogen-doped carbon nanotubes by ozone via atomic layer deposition

    SciTech Connect

    Lushington, Andrew; Liu, Jian; Tang, Yongji; Li, Ruying; Sun, Xueliang

    2014-01-15

    The use of ozone as an oxidizing agent for atomic layer deposition (ALD) processes is rapidly growing due to its strong oxidizing capabilities. However, the effect of ozone on nanostructured substrates such as nitrogen-doped multiwalled carbon nanotubes (NCNTs) and pristine multiwalled carbon nanotubes (PCNTs) are not very well understood and may provide an avenue toward functionalizing the carbon nanotube surface prior to deposition. The effects of ALD ozone treatment on NCNTs and PCNTs using 10 wt. % ozone at temperatures of 150, 250, and 300 °C are studied. The effect of ozone pulse time and ALD cycle number on NCNTs and PCNTs was also investigated. Morphological changes to the substrate were observed by scanning electron microscopy and high resolution transmission electron microscopy. Brunauer-Emmett-Teller measurements were also conducted to determine surface area, pore size, and pore size distribution following ozone treatment. The graphitic nature of both NCNTs and PCNTs was determined using Raman analysis while x-ray photoelectron spectroscopy (XPS) was employed to probe the chemical nature of NCNTs. It was found that O{sub 3} attack occurs preferentially to the outermost geometric surface of NCNTs. Our research also revealed that the deleterious effects of ozone are found only on NCNTs while little or no damage occurs on PCNTs. Furthermore, XPS analysis indicated that ALD ozone treatment on NCNTs, at elevated temperatures, results in loss of nitrogen content. Our studies demonstrate that ALD ozone treatment is an effective avenue toward creating low nitrogen content, defect rich substrates for use in electrochemical applications and ALD of various metal/metal oxides.

  10. Efficient ArF laser production and detection of carbon atoms from simple hydrocarbons

    SciTech Connect

    Sausa, R.C.; Alfano, A.J.; Miziolek, A.W.

    1987-09-01

    Excimer lasers are currently being utilized as a means of photofragmentation and fragment excitation for chemical detection purposes. In the case of small hydrocarbons, this phenomenon is generally not well characterized and is poorly understood. Experiments aimed at a better understanding of the interaction of simple carbon-containing molecules with the ArF (193-nm) excimer laser and at exploring the potential analytical applications of this process are described. Specifically, carbon atoms were generated by multiphoton photolysis of CO, CH/sub 4/, C/sub 2/H/sub 2/, C/sub 3/H/sub 8/, CH/sub 3/OH, and CH/sub 3/COCH/sub 3/ using the ArF laser. Their presence was detected by two sensitive methods, laser-induced fluorescence (LIF) and resonance ionization emission spectroscopy (RIES), both of which take advantage of the coincident overlap between the ArF laser and the /sup 1/D/sub 2/..-->../sup 1/P/sup 0//sub 1/ transition at 193.1 nm with emission detection at 247.9 nm. The RIES method detects single photons resulting from the photolytically produced carbon ion recombination and relaxation processes. An enhancement in the RIES signal was observed when a second tunable laser pulse operating at 247.9 nm followed the ArF laser pulse. Both methods not only offer sensitive detection of the photolytic precursor molecules but also require only relatively simple experimental apparatus. Detection levels for the precursor molecule considerably lower than 10/sup 11//cc for LIF and 10/sup 12//cc for RIES can be estimated based on the observed rates of signal production.

  11. Dynamics of carbon-hydrogen and carbon-methyl exchanges in the collision of {sup 3}P atomic carbon with propene

    SciTech Connect

    Lee, Shih-Huang Chen, Wei-Kan; Chin, Chih-Hao; Huang, Wen-Jian

    2013-11-07

    We investigated the dynamics of the reaction of {sup 3}P atomic carbon with propene (C{sub 3}H{sub 6}) at reactant collision energy 3.8 kcal mol{sup −1} in a crossed molecular-beam apparatus using synchrotron vacuum-ultraviolet ionization. Products C{sub 4}H{sub 5}, C{sub 4}H{sub 4}, C{sub 3}H{sub 3}, and CH{sub 3} were observed and attributed to exit channels C{sub 4}H{sub 5} + H, C{sub 4}H{sub 4} + 2H, and C{sub 3}H{sub 3} + CH{sub 3}; their translational-energy distributions and angular distributions were derived from the measurements of product time-of-flight spectra. Following the addition of a {sup 3}P carbon atom to the C=C bond of propene, cyclic complex c-H{sub 2}C(C)CHCH{sub 3} undergoes two separate stereoisomerization mechanisms to form intermediates E- and Z-H{sub 2}CCCHCH{sub 3}. Both the isomers of H{sub 2}CCCHCH{sub 3} in turns decompose to C{sub 4}H{sub 5} + H and C{sub 3}H{sub 3} + CH{sub 3}. A portion of C{sub 4}H{sub 5} that has enough internal energy further decomposes to C{sub 4}H{sub 4} + H. The three exit channels C{sub 4}H{sub 5} + H, C{sub 4}H{sub 4} + 2H, and C{sub 3}H{sub 3} + CH{sub 3} have average translational energy releases 13.5, 3.2, and 15.2 kcal mol{sup −1}, respectively, corresponding to fractions 0.26, 0.41, and 0.26 of available energy deposited to the translational degrees of freedom. The H-loss and 2H-loss channels have nearly isotropic angular distributions with a slight preference at the forward direction particularly for the 2H-loss channel. In contrast, the CH{sub 3}-loss channel has a forward and backward peaked angular distribution with an enhancement at the forward direction. Comparisons with reactions of {sup 3}P carbon atoms with ethene, vinyl fluoride, and vinyl chloride are stated.

  12. Activation of extended red emission photoluminescence in carbon solids by exposure to atomic hydrogen and UV radiation

    NASA Technical Reports Server (NTRS)

    Furton, Douglas G.; Witt, Adolf N.

    1993-01-01

    We report on new laboratory results which relate directly to the observation of strongly enhanced extended red emission (ERE) by interstellar dust in H2 photodissociation zones. The ERE has been attributed to photoluminescence by hydrogenated amorphous carbon (HAC). We are demonstrating that exposure to thermally dissociated atomic hydrogen will restore the photoluminescence efficiency of previously annealed HAC. Also, pure amorphous carbon (AC), not previously photoluminescent, can be induced to photoluminesce by exposure to atomic hydrogen. This conversion of AC into HAC is greatly enhanced by the presence of UV irradiation. The presence of dense, warm atomic hydrogen and a strong UV radiation field are characteristic environmental properties of H2 dissociation zones. Our results lend strong support to the HAC photoluminescence explanation for ERE.

  13. Activation of extended red emission photoluminescence in carbon solids by exposure to atomic hydrogen and UV radiation

    NASA Technical Reports Server (NTRS)

    Furton, Douglas G.; Witt, Adolf N.

    1993-01-01

    We report on new laboratory results which relate directly to the observation of strongly enhanced extended red emission (ERE) by interstellar dust in H2 photodissociation zones. The ERE has been attributed to photoluminescence by hydrogenated amorphous carbon (HAC). We are demonstrating that exposure to thermally dissociated atomic hydrogen will restore the photoluminescence efficiency of previously annealed HAC. Also, pure amorphous carbon (AC), not previously photoluminescent, can be induced to photoluminesce by exposure to atomic hydrogen. This conversion of AC into HAC is greatly enhanced by the presence of UV irradiation. The presence of dense, warm atomic hydrogen and a strong UV radiation field are characteristic environmental properties of H2 dissociation zones. Our results lend strong support to the HAC photoluminescence explanation for ERE.

  14. In situ observation of atomic hydrogen etching on diamond-like carbon films produced by pulsed laser deposition

    NASA Astrophysics Data System (ADS)

    Cheng, C.-L.; Chia, C.-T.; Chiu, C.-C.; Wu, C.-C.; Cheng, H.-F.; Lin, I.-N.

    2001-04-01

    Atomic hydrogen etching on the pulsed laser deposited (PLD) diamond-like carbon (DLC) films were examined in situ by using Raman spectroscopy. Thermal annealing of the as-prepared DLC films was found to alter the D-band (˜1355 cm -1) and G-band (˜1582 cm -1) from unresolved features at room temperature to clearly separated bands at above 500°C, indicating graphitization of the films. The presence of atomic hydrogen retards graphitization at temperatures lower than 500°C, presumably because reactive atomic hydrogen formed sp 3-bonding carbons which prevented graphitization at below 500°C, while at above 500°C, the hydrogen etches away disordered structure of the DLC film as the intensity changes of the D-bands demonstrate.

  15. The atomic scale structure of CXV carbon: wide-angle x-ray scattering and modeling studies

    NASA Astrophysics Data System (ADS)

    Hawelek, L.; Brodka, A.; Dore, J. C.; Honkimaki, V.; Burian, A.

    2013-11-01

    The disordered structure of commercially available CXV activated carbon produced from finely powdered wood-based carbon has been studied using the wide-angle x-ray scattering technique, molecular dynamics and density functional theory simulations. The x-ray scattering data has been converted to the real space representation in the form of the pair correlation function via the Fourier transform. Geometry optimizations using classical molecular dynamics based on the reactive empirical bond order potential and density functional theory at the B3LYP/6-31g* level have been performed to generate nanoscale models of CXV carbon consistent with the experimental data. The final model of the structure comprises four chain-like and buckled graphitic layers containing a small percentage of four-fold coordinated atoms (sp3 defects) in each layer. The presence of non-hexagonal rings in the atomic arrangement has been also considered.

  16. Prismatic modifications of single-walled carbon nanotubes and their electronic properties: Regular adsorption of fluorine atoms on graphene surfaces of nanotubes

    NASA Astrophysics Data System (ADS)

    Tomilin, O. B.; Stankevich, I. V.; Muryumin, E. E.; Lesin, S. A.; Syrkina, N. P.

    2011-01-01

    The regular adsorption of fluorine atoms on surfaces of single-walled carbon nanotubes along their axes can lead to a modification of cylindrical carbon cores of these single-walled carbon nanotubes to carbon cores that have a nearly prismatic shape (prismatic modification). In faces of these modified single-walled carbon nanotubes, there can arise quasi-one-dimensional isolated carbon conjugated subsystems (tracks) with different structures. It has been established that the main characteristics of the single-walled carbon nanotubes thus modified are rather close to the corresponding characteristics of the related isostructural polymer conjugated systems (such as cis-polyenes, polyphenylenes, poly(periacenes), or polyphenantrenes). Fragments of model nanotubes of the ( n, n) and ( n, 0) types that contain up to 360 carbon atoms and their derivatives doped with fluorine atoms have been calculated using the semiempirical parametric method 3.

  17. Ultrastrong Carbon Thin Films from Diamond to Graphene under Extreme Conditions: Probing Atomic Scale Interfacial Mechanisms to Achieve Ultralow Friction and Wear

    DTIC Science & Technology

    2016-12-08

    AFRL-AFOSR-JP-TR-2016-0101 Ultrastrong Carbon Thin Films from Diamond to Graphene under Extreme Conditions: Probing Atomic -Scale Interfacial...to 21 Sep 2016 4. TITLE AND SUBTITLE Ultrastrong Carbon Thin Films from Diamond to Graphene under Extreme Conditions: Probing Atomic -Scale...nanotribometry that enables nanoscale visualization and quantification of atomic -level processes of sliding contacts inside the transmission electron

  18. Stretchable Wire-Shaped Asymmetric Supercapacitors Based on Pristine and MnO2 Coated Carbon Nanotube Fibers.

    PubMed

    Xu, Ping; Wei, Bingqing; Cao, Zeyuan; Zheng, Jie; Gong, Ke; Li, Faxue; Yu, Jianyong; Li, Qingwen; Lu, Weibang; Byun, Joon-Hyung; Kim, Byung-Sun; Yan, Yushan; Chou, Tsu-Wei

    2015-06-23

    While the emerging wire-shaped supercapacitors (WSS) have been demonstrated as promising energy storage devices to be implemented in smart textiles, challenges in achieving the combination of both high mechanical stretchability and excellent electrochemical performance still exist. Here, an asymmetric configuration is applied to the WSS, extending the potential window from 0.8 to 1.5 V, achieving tripled energy density and doubled power density compared to its asymmetric counterpart while accomplishing stretchability of up to 100% through the prestrainning-then-buckling approach. The stretchable asymmetric WSS constituted of MnO2/CNT hybrid fiber positive electrode, aerogel CNT fiber negative electrode and KOH-PVA electrolyte possesses a high specific capacitance of around 157.53 μF cm(-1) at 50 mV s(-1) and a high energy density varying from 17.26 to 46.59 nWh cm(-1) with the corresponding power density changing from 7.63 to 61.55 μW cm(-1). Remarkably, a cyclic tensile strain of up to 100% exerts negligible effects on the electrochemical performance of the stretchable asymmetric WSS. Moreover, after 10,000 galvanostatic charge-discharge cycles, the specific capacitance retains over 99%, demonstrating a long cyclic stability.

  19. High Temperature Life Testing of 80Ni-20Cr Wire in a Simulated Mars Atmosphere for the Sample Analysis at Mars (SAM) Instrument Suit Gas Processing System (GPS) Carbon Dioxide Scrubber

    NASA Technical Reports Server (NTRS)

    Gundersen, Cynthia; Hoffman, Christopher; Munoz, Bruno; Steohenson, Timothy; Thomas, Walter

    2008-01-01

    In support of the GPS for the SAM instrument suite built by GSFC, a life test facility was developed to test the suitability of 80Ni-20Cr wire, 0.0056 inches in diameter, for use as a heater element for the carbon dioxide scrubber. The wire would be required to operate at 1000 C in order to attain the 800 C required for regeneration of the getter. The wire also would need to operate in the Mars atmosphere, which consists mostly of CO2 at pressures between 4 and 12 torr. Data on the high temperature degradation mechanism of 80Ni-20Cr in low pressure CO2, together with the effects of thermal cycling, were unknown. In addition, the influence of work hardening of the wire during assembly and the potential for catastrophic grain growth also were unknown. Verification of the wire reliability as defined by the mission goals required the construction of a test facility that would accurately simulate the duty cycles in a simulated Mars atmosphere. The experimental set-up, along with the test protocol and results will be described.

  20. Inorganic and Organometallic Molecular Wires for Single-Molecule Devices.

    PubMed

    Tanaka, Yuya; Kiguchi, Manabu; Akita, Munetaka

    2017-04-06

    Recent developments of single-molecule conductance measurements allow us to understand fundamental conducting properties of molecular wires. While a wide variety of organic molecular wires have been studied so far, inorganic and organometallic molecular wires have received much less attention. However, molecular wires with transition-metal atoms show interesting features and functions distinct from those of organic wires. These properties originate mainly from metal-ligand dπ-pπ interactions and metal-metal d-d interactions. Thanks to the rich combination of metal atoms and supporting ligands, frontier orbital energies of the molecular wires can be finely tuned to lead to highly conducting molecular wires. Moreover, the unique electronic structures of metal complexes are susceptible to subtle environmental changes, leading to potential functional molecular devices. This article reviews recent advances in the single-molecule conductance study of inorganic and organometallic molecular wires. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  1. Twisted aligned carbon nanotube/silicon composite fiber anode for flexible wire-shaped lithium-ion battery.

    PubMed

    Lin, Huijuan; Weng, Wei; Ren, Jing; Qiu, Longbin; Zhang, Zhitao; Chen, Peining; Chen, Xuli; Deng, Jue; Wang, Yonggang; Peng, Huisheng

    2014-02-26

    Twisted, aligned carbon nanotube/silicon composite fibers with remarkable mechanical and electronic properties are designed to develop novel flexible lithium-ion batteries with a high cyclic stability. The core-sheath architecture and the aligned structure of the composite nanotube offer excellent combined properties. © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  2. Excited-state intramolecular proton transfer to carbon atoms: nonadiabatic surface-hopping dynamics simulations.

    PubMed

    Xia, Shu-Hua; Xie, Bin-Bin; Fang, Qiu; Cui, Ganglong; Thiel, Walter

    2015-04-21

    Excited-state intramolecular proton transfer (ESIPT) between two highly electronegative atoms, for example, oxygen and nitrogen, has been intensely studied experimentally and computationally, whereas there has been much less theoretical work on ESIPT to other atoms such as carbon. We have employed CASSCF, MS-CASPT2, RI-ADC(2), OM2/MRCI, DFT, and TDDFT methods to study the mechanistic photochemistry of 2-phenylphenol, for which such an ESIPT has been observed experimentally. According to static electronic structure calculations, irradiation of 2-phenylphenol populates the bright S1 state, which has a rather flat potential in the Franck-Condon region (with a shallow enol minimum at the CASSCF level) and may undergo an essentially barrierless ESIPT to the more stable S1 keto species. There are two S1/S0 conical intersections that mediate relaxation to the ground state, one in the enol region and one in the keto region, with the latter one substantially lower in energy. After S1 → S0 internal conversion, the transient keto species can return back to the S0 enol structure via reverse ground-state hydrogen transfer in a facile tautomerization. This mechanistic scenario is verified by OM2/MRCI-based fewest-switches surface-hopping simulations that provide detailed dynamic information. In these trajectories, ESIPT is complete within 118 fs; the corresponding S1 excited-state lifetime is computed to be 373 fs in vacuum. Most of the trajectories decay to the ground state via the S1/S0 conical intersection in the keto region (67%), and the remaining ones via the enol region (33%). The combination of static electronic structure computations and nonadiabatic dynamics simulations is expected to be generally useful for understanding the mechanistic photophysics and photochemistry of molecules with intramolecular hydrogen bonds.

  3. Wire diameter dependence in the catalytic decomposition of H2

    NASA Astrophysics Data System (ADS)

    Umemoto, Hironobu

    2014-01-01

    Jansen et al. have demonstrated that the dissociaiton rate of H2 molecules on hot wire surfaces, normalized per unit surface area, depends on the wire diameter based on the electrical power consumption measurements [J. Appl. Phys. 66, 5749 (1989)]. Mathematical modeling calculations have also been presented to support their experimental results. In the present paper, it is shown that such a wire diameter dependence cannot be observed and that the H-atom density normalized by the wire surface area depends little on the wire diameter. Modeling calculations also show that the wire diameter dependence of the dissociation rate cannot be expected under typical decomposition conditions.

  4. Precision wire feeder for small diameter wire

    DOEpatents

    Brandon, Eldon D.; Hooper, Frederick M.; Reichenbach, Marvin L.

    1992-01-01

    A device for feeding small diameter wire having a diameter less than 0.04 mm (16 mil) to a welding station includes a driving wheel for controllably applying a non-deforming driving force to the wire to move the free end of the wire towards the welding station; and a tension device such as a torque motor for constantly applying a reverse force to the wire in opposition to the driving force to keep the wire taut.

  5. Precision wire feeder for small diameter wire

    DOEpatents

    Brandon, E.D.; Hooper, F.M.; Reichenbach, M.L.

    1992-08-11

    A device for feeding small diameter wire having a diameter less than 0.04 mm (16 mil) to a welding station includes a driving wheel for controllably applying a non-deforming driving force to the wire to move the free end of the wire towards the welding station; and a tension device such as a torque motor for constantly applying a reverse force to the wire in opposition to the driving force to keep the wire taut. 1 figure.

  6. Charge Transport through Organic Molecular Wires Embedded in Ultrathin Insulating Inorganic Layer

    SciTech Connect

    Edri, Eran; Frei, Heinz

    2015-12-07

    Dense phase silica layers with thickness of a few nanometers featuring embedded organic molecular wires of type p-oligo(phenylenevinylene) are shown by visible light sensitized electrochemical measurements to transport charges across the insulating membrane. Here, we find that such hybrid materials combination allows electronic charge transport only through the wires, while blocking molecular transport. Embodiment of the wire molecules in the silica was accomplished by atomic layer deposition under mild temperature conditions. Grown on Co oxide films for water oxidation, with the wire molecules covalently anchored on the oxide surface, the layer functions as a proton conducting separation membrane. Characterization by XPS, FT-IR and STEM/EDX confirms the integrity of the silica-encapsulated organic wires. Cyclic voltammetry with redox couple of selected potential relative to the energy levels of the wire molecules shows that the membrane is free of pinholes. The new type of membrane allows separation of incompatible redox reaction environments on the length scale of nanometers while enabling controlled electron transport between them. Finally, this opens up the coupling of carbon dioxide reduction with water oxidation, the essential reactions of artificial photosynthesis, in an integrated nanoscale photosystem.

  7. ALMA observations of atomic carbon in z ˜ 4 dusty star-forming galaxies

    NASA Astrophysics Data System (ADS)

    Bothwell, M. S.; Aguirre, J. E.; Aravena, M.; Bethermin, M.; Bisbas, T. G.; Chapman, S. C.; De Breuck, C.; Gonzalez, A. H.; Greve, T. R.; Hezaveh, Y.; Ma, J.; Malkan, M.; Marrone, D. P.; Murphy, E. J.; Spilker, J. S.; Strandet, M.; Vieira, J. D.; Weiß, A.

    2017-04-01

    We present Atacama Large Millimeter Array [C I](1 - 0) (rest frequency 492 GHz) observations for a sample of 13 strongly lensed dusty star-forming galaxies (DSFGs) originally discovered at 1.4 mm in a blank-field survey by the South Pole Telescope (SPT). We compare these new data with available [C I] observations from the literature, allowing a study of the interstellar medium (ISM) properties of ˜30 extreme DSFGs spanning a redshift range 2 < z < 5. Using the [C I] line as a tracer of the molecular ISM, we find a mean molecular gas mass for SPT-DSFGs of 6.6 × 1010 M⊙. This is in tension with gas masses derived via low-J 12CO and dust masses; bringing the estimates into accordance requires either (a) an elevated CO-to-H2 conversion factor for our sample of αCO ˜ 2.5 and a gas-to-dust ratio ˜200, or (b) an high carbon abundance X_{C I} ˜ 7× 10^{-5}. Using observations of a range of additional atomic and molecular lines (including [C I], [C II]and multiple transitions of CO), we use a modern photodissociation region code (3D-PDR) to assess the physical conditions (including the density, UV radiation field strength and gas temperature) within the ISM of the DSFGs in our sample. We find that the ISM within our DSFGs is characterized by dense gas permeated by strong UV fields. We note that previous efforts to characterize photodissociation region regions in DSFGs may have significantly under-estimated the density of the ISM. Combined, our analysis suggests that the ISM of extreme dusty starbursts at high redshift consists of dense, carbon-rich gas not directly comparable to the ISM of starbursts in the local Universe.

  8. Direct determination and speciation of mercury compounds in environmental and biological samples by carbon bed atomic absorption spectroscopy

    SciTech Connect

    Skelly, E.M.

    1982-01-01

    A method was developed for the direct determination of mercury in water and biological samples using a unique carbon bed atomizer for atomic absorption spectroscopy. The method avoided sources of error such as loss of volatile mercury during sample digestion and contamination of samples through added reagents by eliminating sample pretreatment steps. The design of the atomizer allowed use of the 184.9 nm mercury resonance line in the vacuum ultraviolet region, which increased sensitivity over the commonly used spin-forbidden 253.7 nm line. The carbon bed atomizer method was applied to a study of mercury concentrations in water, hair, sweat, urine, blood, breath and saliva samples from a non-occupationally exposed population. Data were collected on the average concentration, the range and distribution of mercury in the samples. Data were also collected illustrating individual variations in mercury concentrations with time. Concentrations of mercury found were significantly higher than values reported in the literature for a ''normal'' population. This is attributed to the increased accuracy gained by eliminating pretreatment steps and increasing atomization efficiency. Absorption traces were obtained for various solutions of pure and complexed mercury compounds. Absorption traces of biological fluids were also obtained. Differences were observed in the absorption-temperatures traces of various compounds. The utility of this technique for studying complexation was demonstrated.

  9. Long range interactions on wires: A reciprocal space based formalism

    NASA Astrophysics Data System (ADS)

    Mináry, Peter; Morrone, Joseph A.; Yarne, Dawn A.; Tuckerman, Mark E.; Martyna, Glenn J.

    2004-12-01

    There are many atomic scale systems in materials, chemistry, and biology that can be effectively modeled as finite in two of the physical spatial dimensions and periodically replicated in the third including nanoscale metallic and semiconducting wires, carbon nanotubes, and DNA. However, it is difficult to design techniques to treat long range forces in these systems without truncation or recourse to slowly convergent supercells or computationally inefficient Poisson solvers. In this paper, a rigorous reciprocal space based formalism which permits long range forces on wires to be evaluated simply and easily via a small modification of existing methods for three dimensional periodicity is derived. The formalism is applied to determine long range interactions both between point particles using an Ewald-like approach and the continuous charge distributions that appear in electronic structure calculations. In this way, both empirical force field calculations and, for example, plane-wave based density functional theory computations on wires can be performed easily. The methodology is tested on model and realistic systems including a lithium doped carbon nanotube.

  10. Atomic layer deposition of aluminum oxide films for carbon nanotube network transistor passivation.

    PubMed

    Grigoras, Kestutis; Zavodchikova, Marina Y; Nasibulin, Albert G; Kauppinen, Esko I; Ermolov, Vladimir; Franssila, Sami

    2011-10-01

    Ultra-thin (2-5 nm thick) aluminum oxide layers were grown on non-functionalized individual single walled carbon nanotubes (SWCNT) and their bundles by atomic layer deposition (ALD) technique in order to investigate the mechanism of the coating process. Transmission electron microscopy (TEM) was used to examine the uniformity and conformality of the coatings grown at different temperatures (80 degrees C or 220 degrees C) and with different precursors for oxidation (water and ozone). We found that bundles of SWCNTs were coated continuously, but at the same time, bare individual nanotubes remained uncoated. The successful coating of bundles was explained by the formation of interstitial pores between the individual SWCNTs constituting the bundle, where the precursor molecules can adhere, initiating the layer growth. Thicker alumina layers (20-35 nm thick) were used for the coating of bottom-gated SWCNT-network based field effect transistors (FETs). ALD layers, grown at different conditions, were found to influence the performance of the SWCNT-network FETs: low temperature ALD layers caused the ambipolarity of the channel and pronounced n-type conduction, whereas high temperature ALD processes resulted in hysteresis suppression in the transfer characteristics of the SWCNT transistors and preserved p-type conduction. Fixed charges in the ALD layer have been considered as the main factor influencing the conduction change of the SWCNT network based transistors.

  11. Atomic Force Microscopy of DNA-wrapped Single-walled Carbon Nanotubes in Aqueous Solution.

    PubMed

    Hayashida, Takuya; Umemura, Kazuo

    2016-07-01

    We evaluated hybrids of DNA and single-walled carbon nanotubes (SWNTs) in aqueous solution and in air using atomic force microscopy (AFM). Although intensive AFM observations of these hybrids were previously carried out for samples in air, this is the first report on AFM observations of these hybrids in solution. As expected, diameters of DNA-SWNT hybrids dramatically increased in tris(hydroxymethyl)aminomethane-ethylenediaminetetraacetic acid (TE) buffer solution. The data suggest that DNA molecules maintain their structures even on the SWNT surfaces. Furthermore, we simultaneously observed single DNA-SWNT hybrids using three different AFM modes in air and in the TE buffer solution. Height value of the hybrids was largest in the solution, and lowest for the mode that repulsive force is expected in air. For the bare SWNT molecules, height differences among the three AFM modes were much lower than those of the DNA-SWNT hybrids. DNA molecules adsorbed on SWNT surfaces flexibly changed their morphology as well as DNA molecules on flat surfaces such as mica. This is hopeful results for biological applications of DNA-SWNT hybrids. In addition, our results revealed the importance of the single-molecule approach to evaluate DNA structures on SWNT surfaces.

  12. Atomically precise understanding of nanofluids: nanodiamonds and carbon nanotubes in ionic liquids.

    PubMed

    Chaban, Vitaly V; Fileti, Eudes Eterno

    2016-09-29

    A nanofluid (NF) is composed of a base liquid and suspended nanoparticles (NPs). High-performance NFs exhibit significantly better heat conductivities, as compared to their base liquids. In the present work, we applied all-atom molecular dynamics (MD) simulations to characterize diffusive and ballistic energy transfer mechanisms within nanodiamonds (NDs), carbon nanotubes (CNTs), and N-butylpyridinium tetrafluoroborate ionic liquid (IL). We showed that heat transfer within both NDs and CNTs is orders of magnitude faster than that in the surrounding IL, whereas diffusion of all particles in the considered NF is similar. Intramolecular heat transfer in NPs is a key factor determining the difference of NFs from base liquids. Solvation free energy of NDs and CNTs in ILs was estimated from MD simulations. The geometric dimensions of NPs were shown to be a major source of entropic penalty. Temperature adjusts the entropic factor substantially by modifying a genuine local structure of the bulk base liquid. Our work contributes to engineering more stable and productive suspensions of NPs in ILs, which are necessary for essential progress in the field of NFs.

  13. Quantitative Conductive Atomic Force Microscopy on Single-Walled Carbon Nanotube-Based Polymer Composites.

    PubMed

    Bârsan, Oana A; Hoffmann, Günter G; van der Ven, Leendert G J; de With, Gijsbertus

    2016-08-03

    Conductive atomic force microscopy (C-AFM) is a valuable technique for correlating the electrical properties of a material with its topographic features and for identifying and characterizing conductive pathways in polymer composites. However, aspects such as compatibility between tip material and sample, contact force and area between the tip and the sample, tip degradation and environmental conditions render quantifying the results quite challenging. This study aims at finding the suitable conditions for C-AFM to generate reliable, reproducible, and quantitative current maps that can be used to calculate the resistance in each point of a single-walled carbon nanotube (SWCNT) network, nonimpregnated as well as impregnated with a polymer. The results obtained emphasize the technique's limitation at the macroscale as the resistance of these highly conductive samples cannot be distinguished from the tip-sample contact resistance. Quantitative C-AFM measurements on thin composite sections of 150-350 nm enable the separation of sample and tip-sample contact resistance, but also indicate that these sections are not representative for the overall SWCNT network. Nevertheless, the technique was successfully used to characterize the local electrical properties of the composite material, such as sample homogeneity and resistance range of individual SWCNT clusters, at the nano- and microscale.

  14. The CH + CO reaction: Rate coefficient for carbon atom exchange at 294 K

    SciTech Connect

    Anderson, S.M.; McCurdy, K.E.; Kolb, C.E. )

    1989-02-09

    A fast-flow reactor equipped with isotope-specific laser-excited fluorescence detection of CH radicals has been used to study carbon atom exchange in the reaction between CH and CO at 294 K and 2 Torr of total pressure. The rate coefficient for exchange, k{sub 3} = (2.1 {times} 0.3) {times} 10{sup {minus}12} cm{sup 3} s{sup {minus}1}, is about an order of magnitude larger than the bimolecular rate for the addition reaction, k{sub 2} = (2.7 {plus minus} 0.4) {times} 10{sup {minus}13}. High-pressure limiting bimolecular and low-pressure termolecular recombination rate coefficients of 1.1 {times} 10{sup {minus}10} cm{sup 3} s{sup {minus}1} and 4.9 {times} 10{sup {minus}30} cm{sup 6} s{sup {minus}1} are derived. The results are discussed in the context of previous work on the title reaction and on the chemistry of singlet CH{sub 2}.

  15. Controlled manipulation of flexible carbon nanotubes through shape-dependent pushing by atomic force microscopy.

    PubMed

    Yang, Seung-Cheol; Qian, Xiaoping

    2013-09-17

    A systematic approach to manipulating flexible carbon nanotubes (CNTs) has been developed on the basis of atomic force microscope (AFM) based pushing. Pushing CNTs enables efficient transport and precise location of individual CNTs. A key issue for pushing CNTs is preventing defective distortion in repetitive bending and unbending deformation. The approach presented here controls lateral movement of an AFM tip to bend CNTs without permanent distortion. The approach investigates possible defects caused by tensile strain of the outer tube under uniform bending and radial distortion by kinking. Using the continuum beam model and experimental bending tests, dependency of maximum bending strain on the length of bent CNTs and radial distortion on bending angles at a bent point have been demonstrated. Individual CNTs are manipulated by limiting the length of bent CNTs and the bending angle. In our approach, multiwalled CNTs with 5-15 nm diameter subjected to bending deformation produce no outer tube breakage under uniform bending and reversible radial deformation with bending angles less than 110°. The lateral tip movement is determined by a simple geometric model that relies on the shape of multiwalled CNTs. The model effectively controls deforming CNT length and bending angle for given CNT shape. Experimental results demonstrate successful manipulation of randomly dispersed CNTs without visual defects. This approach to pushing can be extended to develop a wide range of CNT based nanodevice applications.

  16. Sub-5 nm nanostructures fabricated by atomic layer deposition using a carbon nanotube template

    NASA Astrophysics Data System (ADS)

    Woo, Ju Yeon; Han, Hyo; Kim, Ji Weon; Lee, Seung-Mo; Ha, Jeong Sook; Shim, Joon Hyung; Han, Chang-Soo

    2016-07-01

    The fabrication of nanostructures having diameters of sub-5 nm is very a important issue for bottom-up nanofabrication of nanoscale devices. In this work, we report a highly controllable method to create sub-5 nm nano-trenches and nanowires by combining area-selective atomic layer deposition (ALD) with single-walled carbon nanotubes (SWNTs) as templates. Alumina nano-trenches having a depth of 2.6 ∼ 3.0 nm and SiO2 nano-trenches having a depth of 1.9 ∼ 2.2 nm fully guided by the SWNTs have been formed on SiO2/Si substrate. Through infilling ZnO material by ALD in alumina nano-trenches, well-defined ZnO nanowires having a thickness of 3.1 ∼ 3.3 nm have been fabricated. In order to improve the electrical properties of ZnO nanowires, as-fabricated ZnO nanowires by ALD were annealed at 350 °C in air for 60 min. As a result, we successfully demonstrated that as-synthesized ZnO nanowire using a specific template can be made for various high-density resistive components in the nanoelectronics industry.

  17. Atomic-force-microscopy nanowriting on ultrathin tetrahedral amorphous carbon films

    NASA Astrophysics Data System (ADS)

    Pivovarov, Pavel A.; Zavedeev, Evgeny V.; Frolov, Vadim D.; Roch, Teja; Scheibe, Hans-Joachim; Pimenov, Sergei M.

    2016-11-01

    We report the atomic-force-microscopy (AFM)-based nanolithography writing of surface patterns on ultrathin (<100 nm thick) ta-C films in ambient air and following contact-mode AFM reading of nanoscale topography, nanofriction properties, and local electrical conductivity of the produced nanopatterns. AFM writing of various patterns such as single nanospots, linear nanostructures, and raster images (`nanoletters') is demonstrated, depending on the magnitude and duration of the voltage pulses applied between the ta-C film and conductive probe, and the relative humidity of ambient air. It is found that the AFM tip-assisted nanowriting process occurring under (1) the presence of adsorbed water layers on the ta-C surface, (2) the applied voltage of >4 V, and (3) the contact pressures in the GPa range results in the formation of a novel carbon phase in a nm-thick surface layer characterized by the lower density, lower mechanical strength, lower electrical conductivity, and increased nanofriction as compared to the original film. The structure of the tip-modified nm-thick layer on the ta-C film is assumed to be a structure of graphite oxide which can be further modified in the presence of water under high contact pressures.

  18. Study of adhesion of vertically aligned carbon nanotubes to a substrate by atomic-force microscopy

    NASA Astrophysics Data System (ADS)

    Ageev, O. A.; Blinov, Yu. F.; Il'ina, M. V.; Il'in, O. I.; Smirnov, V. A.; Tsukanova, O. G.

    2016-02-01

    The adhesion to a substrate of vertically aligned carbon nanotubes (VA CNT) produced by plasmaenhanced chemical vapor deposition has been experimentally studied by atomic-force microscopy in the current spectroscopy mode. The longitudinal deformation of VA CNT by applying an external electric field has been simulated. Based on the results, a technique of determining VA CNT adhesion to a substrate has been developed that is used to measure the adhesion strength of connecting VA CNT to a substrate. The adhesion to a substrate of VA CNT 70-120 nm in diameter varies from 0.55 to 1.19 mJ/m2, and the adhesion force from 92.5 to 226.1 nN. When applying a mechanical load, the adhesion strength of the connecting VA CNT to a substrate is 714.1 ± 138.4 MPa, and the corresponding detachment force increases from 1.93 to 10.33 μN with an increase in the VA CNT diameter. As an external electric field is applied, the adhesion strength is almost doubled and is 1.43 ± 0.29 GPa, and the corresponding detachment force is changed from 3.83 to 20.02 μN. The results can be used in the design of technological processes of formation of emission structures, VA CNT-based elements for vacuum microelectronics and micro- and nanosystem engineering, and also the methods of probe nanodiagnostics of VA CNT.

  19. High-resolution imaging of pelagic bacteria by Atomic Force Microscopy and implications for carbon cycling.

    PubMed

    Malfatti, Francesca; Samo, Ty J; Azam, Farooq

    2010-03-01

    In microbial oceanography, cell size, volume and carbon (C) content of pelagic bacteria and archaea ('bacteria') are critical parameters in addressing the in situ physiology and functions of bacteria, and their role in the food web and C cycle. However, because of the diminutive size of most pelagic bacteria and errors caused by sample fixation and processing, an accurate measurement of the size and volume has been challenging. We used atomic force microscopy (AFM) to obtain high-resolution images of pelagic bacteria and Synechococcus. We measured the length, width and height of live and formalin-fixed pelagic bacteria, and computed individual cell volumes. AFM-based measurements were compared with those by epifluorescence microscopy (EFM) using 4',6-diamidino-2-phenylindole (DAPI). The ability to measure cell height by AFM provides methodological advantage and ecophysiological insight. For the samples examined, EFM (DAPI)-based average cell volume was in good agreement (1.1-fold) with live sample AFM. However, the agreement may be a fortuitous balance between cell shrinkage due to fixation/drying (threefold) and Z-overestimation (as EFM does not account for cell flattening caused by sample processing and assumes that height=width). The two methods showed major differences in cell volume and cell C frequency distributions. This study refines the methodology for quantifying bacteria-mediated C fluxes and the role of bacteria in marine ecosystems, and suggests the potential of AFM for individual cell physiological interrogations in natural marine assemblages.

  20. Synthesis of porous carbon supported palladium nanoparticle catalysts by atomic layer deposition: application for rechargeable lithium-O2 battery.

    PubMed

    Lei, Yu; Lu, Jun; Luo, Xiangyi; Wu, Tianpin; Du, Peng; Zhang, Xiaoyi; Ren, Yang; Wen, Jianguo; Miller, Dean J; Miller, Jeffrey T; Sun, Yang-Kook; Elam, Jeffrey W; Amine, Khalil

    2013-09-11

    In this study, atomic layer deposition (ALD) was used to deposit nanostructured palladium on porous carbon as the cathode material for Li-O2 cells. Scanning transmission electron microscopy showed discrete crystalline nanoparticles decorating the surface of the porous carbon support, where the size could be controlled in the range of 2-8 nm and depended on the number of Pd ALD cycles performed. X-ray absorption spectroscopy at the Pd K-edge revealed that the carbon supported Pd existed in a mixed phase of metallic palladium and palladium oxide. The conformality of ALD allowed us to uniformly disperse the Pd catalyst onto the carbon support while preserving the initial porous structure. As a result, the charging and discharging performance of the oxygen cathode in a Li-O2 cell was improved. Our results suggest that ALD is a promising technique for tailoring the surface composition and structure of nanoporous supports in energy storage devices.

  1. Application of graphene-ionic liquid-chitosan composite-modified carbon molecular wire electrode for the sensitive determination of adenosine-5'-monophosphate.

    PubMed

    Shi, Fan; Gong, Shixing; Xu, Li; Zhu, Huanhuan; Sun, Zhenfan; Sun, Wei

    2013-12-01

    In this paper, a graphene (GR) ionic liquid (IL) 1-octyl-3-methylimidazolium hexafluorophosphate and chitosan composite-modified carbon molecular wire electrode (CMWE) was fabricated by a drop-casting method and further applied to the sensitive electrochemical detection of adenosine-5'-monophosphate (AMP). CMWE was prepared with diphenylacetylene (DPA) as the modifier and the binder. The properties of modified electrode were examined by scanning electron microscopy, cyclic voltammetry and electrochemical impedance spectroscopy. Electrochemical behaviors of AMP was carefully investigated with enhanced responses appeared, which was due to the presence of GR-IL composite on the electrode surface with excellent electrocatalytic ability. A well-defined oxidation peak of AMP appeared at 1.314 V and the electrochemical parameters were calculated by electrochemical methods. Under the selected conditions, the oxidation peak current of AMP was proportional to its concentration in the range from 0.01 μM to 80.0 μM with the detection limit as 3.42 nM (3σ) by differential pulse voltammetry. The proposed method exhibited good selectivity and was applied to the detection of vidarabine monophosphate injection samples with satisfactory results.

  2. A journey from order to disorder - atom by atom transformation from graphene to a 2D carbon glass.

    PubMed

    Eder, Franz R; Kotakoski, Jani; Kaiser, Ute; Meyer, Jannik C

    2014-02-11

    One of the most interesting questions in solid state theory is the structure of glass, which has eluded researchers since the early 1900's. Since then, two competing models, the random network theory and the crystallite theory, have both gathered experimental support. Here, we present a direct, atomic-level structural analysis during a crystal-to-glass transformation, including all intermediate stages. We introduce disorder on a 2D crystal, graphene, gradually, utilizing the electron beam of a transmission electron microscope, which allows us to capture the atomic structure at each step. The change from a crystal to a glass happens suddenly, and at a surprisingly early stage. Right after the transition, the disorder manifests as a vitreous network separating individual crystallites, similar to the modern version of the crystallite theory. However, upon increasing disorder, the vitreous areas grow on the expense of the crystallites and the structure turns into a random network. Thereby, our results show that, at least in the case of a 2D structure, both of the models can be correct, and can even describe the same material at different degrees of disorder.

  3. Atomic Scale Interface Manipulation, Structural Engineering, and Their Impact on Ultrathin Carbon Films in Controlling Wear, Friction, and Corrosion.

    PubMed

    Dwivedi, Neeraj; Yeo, Reuben J; Yak, Leonard J K; Satyanarayana, Nalam; Dhand, Chetna; Bhat, Thirumaleshwara N; Zhang, Zheng; Tripathy, Sudhiranjan; Bhatia, Charanjit S

    2016-07-13

    Reducing friction, wear, and corrosion of diverse materials/devices using <2 nm thick protective carbon films remains challenging, which limits the developments of many technologies, such as magnetic data storage systems. Here, we present a novel approach based on atomic scale interface manipulation to engineer and control the friction, wear, corrosion, and structural characteristics of 0.7-1.7 nm carbon-based films on CoCrPt:oxide-based magnetic media. We demonstrate that when an atomically thin (∼0.5 nm) chromium nitride (CrNx) layer is sandwiched between the magnetic media and an ultrathin carbon overlayer (1.2 nm), it modifies the film-substrate interface, creates various types of interfacial bonding, increases the interfacial adhesion, and tunes the structure of carbon in terms of its sp(3) bonding. These contribute to its remarkable functional properties, such as stable and lowest coefficient of friction (∼0.15-0.2), highest wear resistance and better corrosion resistance despite being only ∼1.7 nm thick, surpassing those of ∼2.7 nm thick current commercial carbon overcoat (COC) and other overcoats in this work. While this approach has direct implications for advancing current magnetic storage technology with its ultralow thickness, it can also be applied to advance the protective and barrier capabilities of other ultrathin materials for associated technologies.

  4. Fungal-induced corrosion of wire rope

    SciTech Connect

    Little, B.; Ray, R.; Hart, K.; Wagner, P.

    1995-10-01

    Localized corrosion of carbon steel wire rope stored in a humid environment on wooden spools was caused by organic acid and carbon dioxide production by fungi growing directly on the wood. Fungal growth was found on the interior so the wooden spools, and corrosion was most severe on the wrap of wire in direct contact with the wood. Laboratory experiments and an extensive review of the literature demonstrated causal relationships between storage conditions and fungal growth and localized corrosion.

  5. Corrosion and biocompatibility of orthodontic wires.

    PubMed

    Widu, F; Drescher, D; Junker, R; Bourauel, C

    1999-05-01

    With the increasing number of orthodontic treatments using devices containing nickel and the growing prevalence of nickel allergy in the average population, biocompatibility studies of these devices have become a topic of major interest. The corrosion behavior of orthodontic wires is a decisive factor determining their biocompatibility. Therefore four nickel-titanium guiding arches, a titanium-molybdenum and a stainless steel wire were analyzed for corrosion behavior under realistic conditions. Pure potentiostatic, pure mechanical and combined potentiostatic and mechanical stresses were applied to the specimens. Subsequently, the surfaces of the wires were investigated employing atomic force microscopy (AFM) and nickel loss was measured with an atomic absorption spectrophotometer. The results yield information about the relative corrosion tendency of the wires under in vitro conditions. The wires examined can be classified into two groups, one with a high and a second group with a low tendency towards corrosion, that is American Orthodontics Memory wire as well as GAC Neo Sentalloy and Ormco Ni-Ti as well as Unitek Nitinol respectively. Although corrosion behavior under clinical conditions can not be directly derived from these results, analyses of wires after clinical usage indicate that changes of wire surfaces might show the same characteristics under in vitro conditions.

  6. Wire Retrieves Broken Pin

    NASA Technical Reports Server (NTRS)

    Burow, G. H.

    1984-01-01

    Safety wire retains pieces of broken tool. Retrieval wire running through shaft of tool used to pull pieces of tool out of hole, should tool break during use. Safety wire concept suitable for pins subject to deflection or breakage.

  7. Single Atom (Pd/Pt) Supported on Graphitic Carbon Nitride as an Efficient Photocatalyst for Visible-Light Reduction of Carbon Dioxide.

    PubMed

    Gao, Guoping; Jiao, Yan; Waclawik, Eric R; Du, Aijun

    2016-05-18

    Reducing carbon dioxide to hydrocarbon fuel with solar energy is significant for high-density solar energy storage and carbon balance. In this work, single atoms of palladium and platinum supported on graphitic carbon nitride (g-C3N4), i.e., Pd/g-C3N4 and Pt/g-C3N4, respectively, acting as photocatalysts for CO2 reduction were investigated by density functional theory calculations for the first time. During CO2 reduction, the individual metal atoms function as the active sites, while g-C3N4 provides the source of hydrogen (H*) from the hydrogen evolution reaction. The complete, as-designed photocatalysts exhibit excellent activity in CO2 reduction. HCOOH is the preferred product of CO2 reduction on the Pd/g-C3N4 catalyst with a rate-determining barrier of 0.66 eV, while the Pt/g-C3N4 catalyst prefers to reduce CO2 to CH4 with a rate-determining barrier of 1.16 eV. In addition, deposition of atom catalysts on g-C3N4 significantly enhances the visible-light absorption, rendering them ideal for visible-light reduction of CO2. Our findings open a new avenue of CO2 reduction for renewable energy supply.

  8. Quantum dynamics of hydrogen interacting with single-walled carbon nanotubes: multiple H-atom adsorbates.

    PubMed

    McAfee, Jason L; Poirier, Bill

    2011-02-21

    In a previous paper [J. L. McAfee and B. Poirier, J. Chem. Phys. 130, 064701 (2009)], using spin-polarized density functional theory (DFT), the authors reported a binding energy of 0.755 eV, for a single hydrogen atom adsorbed on a pristine (unrelaxed) (5,5) single-walled carbon nanotube (SWNT) substrate. A full three-dimensional (3D) potential energy surface (PES) for the SWNT-H system was also developed, and used in a quantum dynamics calculation to compute all rovibrational bound states, and associated equatorial and longitudinal adsorbate migration rates. A highly pronounced preference for the latter migration pathway at ambient temperatures was observed. In this work, we extend the aforementioned study to include multiple H-atom adsorbates. Extensive DFT calculations are performed, in order to ascertain the most relevant dynamical pathways. For two adsorbates, the SWNT-H-H system is found to exhibit highly site-specific binding, as well as long-range correlation and pronounced binding energy enhancement. The latter effect is even more pronounced in the full-hydrogenation limit, increasing the per-adsorbate binding energy to 2.6 eV. To study migration dynamics, a single-hole model is developed, for which the binding energy drops to 2.11 eV. A global 3D PES is developed for the hole migration model, using 40 radial × 18 cylindrical ab initio geometries, fit to a Fourier basis with radially dependent expansion coefficients (rms error 4.9 meV). As compared with the single-adsorbate case, the hole migration PES does not exhibit separate chemisorption and physisorption wells. The barrier to longitudinal migration is also found to be much lower. Quantum dynamics calculations for all rovibrational states are then performed (using a mixed spectral basis/phase-space optimized discrete variable representation), and used to compute longitudinal migration rates. Ramifications for the use of SWNTs as potential hydrogen storage materials are discussed.

  9. Silver-filled single-walled carbon nanotubes: Atomic and electronic structures from first-principles calculations

    NASA Astrophysics Data System (ADS)

    Li, Weifeng; Zhao, Mingwen; Xia, Yueyuan; He, Tao; Song, Chen; Lin, Xiaohang; Liu, Xiangdong; Mei, Liangmo

    2006-11-01

    We have studied the atomic and electronic structures of silver-filled (n,0) single-walled carbon nanotubes (Ag@SWCNTs) for n=6 , 7, 8, and 10 by using first-principles calculations. We find that silver atoms encapsulated in SWCNTs self-aggregate to form ultrathin nanowires, of which the atomic arrangement depends on the diameter of the SWCNTs as well as the silver content. The electronic structures of the Ag@SWCNTs can be tuned from semiconducting to metallic by controlling the silver content. The hybridization of electronic states and the charge transfer between the encapsulated silver nanowires (AgNWs) and the SWCNTs are also addressed by performing Milliken population analysis combined with the projected density of states.

  10. Protection of Diamond-like Carbon Films from Energetic Atomic Oxygen Degradation Through Si-doping Technology

    SciTech Connect

    Yokota, Kumiko; Tagawa, Masahito; Kitamura, Akira; Matsumoto, Koji; Yoshigoe, Akitaka; Teraoka, Yuden; Fontaine, Julien; Belin, Michel

    2009-01-05

    The effect of hyperthermal atomic oxygen (AO) exposure on the surface properties of Si-doped diamond-like carbon (DLC) was investigated. Two types of DLC were tested that contain approximately 10 at% and 20 at% of Si atoms. Surface analytical results of high-resolution x-ray photoelectron spectroscopy using synchrotron radiation (synchrotron radiation photoemission spectroscopy; SR-PES) as well as Rutherford backscattering spectroscopy (RBS) have been used for characterization of the AO-exposed Si-doped DLC. It was identified by SR-PES that a SiO{sub 2} layer was formed by the hyperthermal AO exposure at the Si-doped DLC surface. RBS data indicates that AO exposure leads to severe thickness loss on the undopedd DLC. In contrast, a SiO{sub 2} layer formed by the hyperthermal atomic oxygen reaction of Si-doped DLC protects the DLC underneath the SiO{sub 2} layer.

  11. Permeation of low-Z atoms through carbon sheets: Density functional theory study on energy barriers and deformation effects

    SciTech Connect

    Huber, Stefan E. E-mail: Michael.probst@uibk.ac.at; Mauracher, Andreas; Probst, Michael E-mail: Michael.probst@uibk.ac.at

    2013-12-15

    Energetic and geometric aspects of the permeation of the atoms hydrogen to neon neutral atoms through graphene sheets are investigated by investigating the associated energy barriers and sheet deformations. Density functional theory calculations on cluster models, where graphene is modeled by planar polycyclic aromatic hydrocarbons (PAHs), provide the energies and geometries. Particularities of our systems, such as convergence of both energy barriers and deformation curves with increasing size of the PAHs, are discussed. Three different interaction regimes, adiabatic, planar and vertical, are investigated by enforcing different geometrical constraints. The adiabatic energy barriers range from 5 eV for hydrogen to 20 eV for neon. We find that the permeation of oxygen and carbon into graphene is facilitated by temporary chemical bonding while for other, in principle reactive atoms, it is not. We discuss implications of our results for modeling chemical sputtering of graphite.

  12. Atom probe tomography investigation of assisted precipitation of secondary hardening carbides in a medium carbon martensitic steels.

    PubMed

    Danoix, F; Danoix, R; Akre, J; Grellier, A; Delagnes, D

    2011-12-01

    A medium carbon martensitic steel containing nanometer scale secondary hardening carbides and intermetallic particles is investigated by field ion microscopy and atom probe tomography. The interaction between the concomitant precipitations of both types of particles is investigated. It is shown that the presence of the intermetallic phase affects the nucleation mechanism and the spatial distribution of the secondary hardening carbides, which shifts from heterogeneous on dislocations to heterogeneous on the intermetallic particles.

  13. An extended defect in graphene as a metallic wire.

    PubMed

    Lahiri, Jayeeta; Lin, You; Bozkurt, Pinar; Oleynik, Ivan I; Batzill, Matthias

    2010-05-01

    Many proposed applications of graphene require the ability to tune its electronic structure at the nanoscale. Although charge transfer and field-effect doping can be applied to manipulate charge carrier concentrations, using them to achieve nanoscale control remains a challenge. An alternative approach is 'self-doping', in which extended defects are introduced into the graphene lattice. The controlled engineering of these defects represents a viable approach to creation and nanoscale control of one-dimensional charge distributions with widths of several atoms. However, the only experimentally realized extended defects so far have been the edges of graphene nanoribbons, which show dangling bonds that make them chemically unstable. Here, we report the realization of a one-dimensional topological defect in graphene, containing octagonal and pentagonal sp(2)-hybridized carbon rings embedded in a perfect graphene sheet. By doping the surrounding graphene lattice, the defect acts as a quasi-one-dimensional metallic wire. Such wires may form building blocks for atomic-scale, all-carbon electronics.

  14. High density harp or wire scanner for particle beam diagnostics

    DOEpatents

    Fritsche, Craig T.; Krogh, Michael L.

    1996-05-21

    A diagnostic detector head harp (23) used to detect and characterize high energy particle beams using an array of closely spaced detector wires (21), typically carbon wires, spaced less than 0.1 cm (0.040 inch) connected to a hybrid microcircuit (25) formed on a ceramic substrate (26). A method to fabricate harps (23) to obtain carbon wire spacing and density not previously available utilizing hybrid microcircuit technology. The hybrid microcircuit (25) disposed on the ceramic substrate (26) connects electrically between the detector wires (21) and diagnostic equipment (37) which analyzes pulses generated in the detector wires (21) by the high energy particle beams.

  15. High density harp or wire scanner for particle beam diagnostics

    DOEpatents

    Fritsche, C.T.; Krogh, M.L.

    1996-05-21

    Disclosed is a diagnostic detector head harp used to detect and characterize high energy particle beams using an array of closely spaced detector wires, typically carbon wires, spaced less than 0.1 cm (0.040 inch) connected to a hybrid microcircuit formed on a ceramic substrate. A method to fabricate harps to obtain carbon wire spacing and density not previously available utilizing hybrid microcircuit technology. The hybrid microcircuit disposed on the ceramic substrate connects electrically between the detector wires and diagnostic equipment which analyzes pulses generated in the detector wires by the high energy particle beams. 6 figs.

  16. Atomic-scale wear of amorphous hydrogenated carbon during intermittent contact: a combined study using experiment, simulation, and theory.

    PubMed

    Vahdat, Vahid; Ryan, Kathleen E; Keating, Pamela L; Jiang, Yijie; Adiga, Shashishekar P; Schall, J David; Turner, Kevin T; Harrison, Judith A; Carpick, Robert W

    2014-07-22

    In this study, we explore the wear behavior of amplitude modulation atomic force microscopy (AM-AFM, an intermittent-contact AFM mode) tips coated with a common type of diamond-like carbon, amorphous hydrogenated carbon (a-C:H), when scanned against an ultra-nanocrystalline diamond (UNCD) sample both experimentally and through molecular dynamics (MD) simulations. Finite element analysis is utilized in a unique way to create a representative geometry of the tip to be simulated in MD. To conduct consistent and quantitative experiments, we apply a protocol that involves determining the tip-sample interaction geometry, calculating the tip-sample force and normal contact stress over the course of the wear test, and precisely quantifying the wear volume using high-resolution transmission electron microscopy imaging. The results reveal gradual wear of a-C:H with no sign of fracture or plastic deformation. The wear rate of a-C:H is consistent with a reaction-rate-based wear theory, which predicts an exponential dependence of the rate of atom removal on the average normal contact stress. From this, kinetic parameters governing the wear process are estimated. MD simulations of an a-C:H tip, whose radius is comparable to the tip radii used in experiments, making contact with a UNCD sample multiple times exhibit an atomic-level removal process. The atomistic wear events observed in the simulations are correlated with under-coordinated atomic species at the contacting surfaces.

  17. Structural modifications of graphyne layers consisting of carbon atoms in the sp- and sp{sup 2}-hybridized states

    SciTech Connect

    Belenkov, E. A.; Mavrinskii, V. V.; Belenkova, T. E.; Chernov, V. M.

    2015-05-15

    A model scheme is proposed for obtaining layered compounds consisting of carbon atoms in the sp- and (vnsp){sup 2}-hybridized states. This model is used to find the possibility of existing the following seven basic structural modifications of graphyne: α-, β1-, β2-, β3-, γ1-, γ2-, and γ3-graphyne. Polymorphic modifications β3 graphyne and γ3 graphyne are described. The basic structural modifications of graphyne contain diatomic polyyne chains and consist only of carbon atoms in two different crystallographically equivalent states. Other nonbasic structural modifications of graphyne can be formed via the elongation of the carbyne chains that connect three-coordinated carbon atoms and via the formation of graphyne layers with a mixed structure consisting of basic layer fragments, such as α-β-graphyne, α-γ-graphyne, and β-γ-graphyne. The semiempirical quantum-mechanical MNDO, AM1, and PM3 methods and ab initio STO6-31G basis calculations are used to find geometrically optimized structures of the basic graphyne layers, their structural parameters, and energies of their sublimation. The energy of sublimation is found to be maximal for γ2-graphyne, which should be the most stable structural modification of graphyne.

  18. Fast wire scanner for intense electron beams

    NASA Astrophysics Data System (ADS)

    Moore, T.; Agladze, N. I.; Bazarov, I. V.; Bartnik, A.; Dobbins, J.; Dunham, B.; Full, S.; Li, Y.; Liu, X.; Savino, J.; Smolenski, K.

    2014-02-01

    We have developed a cost-effective, fast rotating wire scanner for use in accelerators where high beam currents would otherwise melt even carbon wires. This new design uses a simple planetary gear setup to rotate a carbon wire, fixed at one end, through the beam at speeds in excess of 20 m/s. We present results from bench tests, as well as transverse beam profile measurements taken at Cornell's high-brightness energy recovery linac photoinjector, for beam currents up to 35 mA.

  19. The warm ISM in the Sgr A region: mid-J CO, atomic carbon, ionized atomic carbon, and ionized nitrogen line observations with the Herschel/HIFI and NANTEN2/SMART Telescopes

    NASA Astrophysics Data System (ADS)

    García, Pablo; Simon, Robert; Stutzki, Jürgen; Requena-Torres, Miguel; Güsten, Rolf; Fukui, Yasuo; Yamamoto, Hiroaki; Bertoldi, Frank; Burton, Michael; Bronfman, Leonardo; Ogawa, Hideo

    2014-05-01

    We present Herschel/HIFI sub-mm atomic carbon ([Ci] 3 P 1 - 3 P 0 and [Ci] 3 P 2 - 3 P 1), ionized carbon ([Cii] 2 P 3/2 - 2 P 1/2), and ionized nitrogen ([Nii] 3 P 1 - 3 P 0) line observations obtained in the frame of the Herschel Guaranteed Time HEXGAL (Herschel EXtraGALactic) key program (P. I. Rolf Güsten, MPIfR), and NANTEN2/SMART carbon monoxide (CO(J = 4 - 3)) observations of the warm gas around the Sgr A region. The spectrally resolved emission from all lines, and the corresponding line intensity ratios, show a very complex morphology. The determination of spatial and spectral (anti)correlation with known sources in the Sgr A region such as the Arched Filaments, NTF filaments, the Sickle, Quintuplet cluster, CND clouds, is ongoing work.

  20. Automated wire preparation system

    NASA Astrophysics Data System (ADS)

    McCulley, Deborah J.

    The first step toward an automated wire harness facility for the aerospace industry has been taken by implementing the Wire Vektor 2000 into the wire harness preparation area. An overview of the Wire Vektor 2000 is given, including the facilities for wire cutting, marking, and transporting, for wire end processing, and for system control. Production integration in the Wire Vektor 2000 system is addressed, considering the hardware/software debug system and the system throughput. The manufacturing changes that have to be made in implementing the Wire Vektor 2000 are discussed.

  1. Torsional behaviors of polymer-infiltrated carbon nanotube yarn muscles studied with atomic force microscopy

    NASA Astrophysics Data System (ADS)

    Kwon, Cheong Hoon; Chun, Kyoung-Yong; Kim, Shi Hyeong; Lee, Jae-Hyeok; Kim, Jae-Ho; Lima, Márcio D.; Baughman, Ray H.; Kim, Seon Jeong

    2015-01-01

    Torsional behaviors of polymer-infiltrated carbon nanotube (CNT) yarn muscles have been investigated in relation to molecular architecture by using atomic force microscopy (AFM). Two polymers with different stiffnesses, polystyrene (PS) and poly(styrene-b-isoprene-b-styrene) (SIS), were uniformly infiltrated into CNT yarns for electrothermal torsional actuation. The torsional behaviors of hybrid yarn muscles are completely explained by the volume change of each polymer, based on the height and full width at half maximum profiles from the AFM morphological images. The volume expansion of the PS yarn muscle (1.7 nm of vertical change and 22 nm of horizontal change) is much larger than that of the SIS yarn muscle (0.3 nm and 11 nm change in vertical and horizontal directions) at 80 °C, normalized by their values at 25 °C. We demonstrate that their maximum rotations are consequently 29.7 deg mm-1 for the PS-infiltrated CNT yarn muscle (relatively larger rotation) and 14.4 deg mm-1 for the SIS-infiltrated CNT yarn muscle (smaller rotation) at 0.75 V m-1. These hybrid yarn muscles could be applied in resonant controllers or damping magnetoelectric sensors.Torsional behaviors of polymer-infiltrated carbon nanotube (CNT) yarn muscles have been investigated in relation to molecular architecture by using atomic force microscopy (AFM). Two polymers with different stiffnesses, polystyrene (PS) and poly(styrene-b-isoprene-b-styrene) (SIS), were uniformly infiltrated into CNT yarns for electrothermal torsional actuation. The torsional behaviors of hybrid yarn muscles are completely explained by the volume change of each polymer, based on the height and full width at half maximum profiles from the AFM morphological images. The volume expansion of the PS yarn muscle (1.7 nm of vertical change and 22 nm of horizontal change) is much larger than that of the SIS yarn muscle (0.3 nm and 11 nm change in vertical and horizontal directions) at 80 °C, normalized by their values at 25

  2. Evaluation of carbon nanotube probes in critical dimension atomic force microscopes

    PubMed Central

    Choi, Jinho; Park, Byong Chon; Ahn, Sang Jung; Kim, Dal-Hyun; Lyou, Joon; Dixson, Ronald G.; Orji, Ndubuisi G.; Fu, Joseph; Vorburger, Theodore V.

    2016-01-01

    The decreasing size of semiconductor features and the increasing structural complexity of advanced devices have placed continuously greater demands on manufacturing metrology, arising both from the measurement challenges of smaller feature sizes and the growing requirement to characterize structures in more than just a single critical dimension. For scanning electron microscopy, this has resulted in increasing sophistication of imaging models. For critical dimension atomic force microscopes (CD-AFMs), this has resulted in the need for smaller and more complex tips. Carbon nanotube (CNT) tips have thus been the focus of much interest and effort by a number of researchers. However, there have been significant issues surrounding both the manufacture and use of CNT tips. Specifically, the growth or attachment of CNTs to AFM cantilevers has been a challenge to the fabrication of CNT tips, and the flexibility and resultant bending artifacts have presented challenges to using CNT tips. The Korea Research Institute for Standards and Science (KRISS) has invested considerable effort in the controlled fabrication of CNT tips and is collaborating with the National Institute of Standards and Technology on the application of CNT tips for CD-AFM. Progress by KRISS on the precise control of CNT orientation, length, and end modification, using manipulation and focused ion beam processes, has allowed us to implement ball-capped CNT tips and bent CNT tips for CD-AFM. Using two different generations of CD-AFM instruments, we have evaluated these tip types by imaging a line/space grating and a programmed line edge roughness specimen. We concluded that these CNTs are capable of scanning the profiles of these structures, including re-entrant sidewalls, but there remain important challenges to address. These challenges include tighter control of tip geometry and careful optimization of scan parameters and algorithms for using CNT tips. PMID:27840664

  3. Evaluation of carbon nanotube probes in critical dimension atomic force microscopes

    NASA Astrophysics Data System (ADS)

    Choi, Jinho; Park, Byong Chon; Ahn, Sang Jung; Kim, Dal-Hyun; Lyou, Joon; Dixson, Ronald G.; Orji, Ndubuisi G.; Fu, Joseph; Vorburger, Theodore V.

    2016-07-01

    The decreasing size of semiconductor features and the increasing structural complexity of advanced devices have placed continuously greater demands on manufacturing metrology, arising both from the measurement challenges of smaller feature sizes and the growing requirement to characterize structures in more than just a single critical dimension. For scanning electron microscopy, this has resulted in increasing sophistication of imaging models. For critical dimension atomic force microscopes (CD-AFMs), this has resulted in the need for smaller and more complex tips. Carbon nanotube (CNT) tips have thus been the focus of much interest and effort by a number of researchers. However, there have been significant issues surrounding both the manufacture and use of CNT tips. Specifically, the growth or attachment of CNTs to AFM cantilevers has been a challenge to the fabrication of CNT tips, and the flexibility and resultant bending artifacts have presented challenges to using CNT tips. The Korea Research Institute for Standards and Science (KRISS) has invested considerable effort in the controlled fabrication of CNT tips and is collaborating with the National Institute of Standards and Technology on the application of CNT tips for CD-AFM. Progress by KRISS on the precise control of CNT orientation, length, and end modification, using manipulation and focused ion beam processes, has allowed us to implement ball-capped CNT tips and bent CNT tips for CD-AFM. Using two different generations of CD-AFM instruments, we have evaluated these tip types by imaging a line/space grating and a programmed line edge roughness specimen. We concluded that these CNTs are capable of scanning the profiles of these structures, including re-entrant sidewalls, but there remain important challenges to address. These challenges include tighter control of tip geometry and careful optimization of scan parameters and algorithms for using CNT tips.

  4. Evaluation of carbon nanotube probes in critical dimension atomic force microscopes.

    PubMed

    Choi, Jinho; Park, Byong Chon; Ahn, Sang Jung; Kim, Dal-Hyun; Lyou, Joon; Dixson, Ronald G; Orji, Ndubuisi G; Fu, Joseph; Vorburger, Theodore V

    2016-07-01

    The decreasing size of semiconductor features and the increasing structural complexity of advanced devices have placed continuously greater demands on manufacturing metrology, arising both from the measurement challenges of smaller feature sizes and the growing requirement to characterize structures in more than just a single critical dimension. For scanning electron microscopy, this has resulted in increasing sophistication of imaging models. For critical dimension atomic force microscopes (CD-AFMs), this has resulted in the need for smaller and more complex tips. Carbon nanotube (CNT) tips have thus been the focus of much interest and effort by a number of researchers. However, there have been significant issues surrounding both the manufacture and use of CNT tips. Specifically, the growth or attachment of CNTs to AFM cantilevers has been a challenge to the fabrication of CNT tips, and the flexibility and resultant bending artifacts have presented challenges to using CNT tips. The Korea Research Institute for Standards and Science (KRISS) has invested considerable effort in the controlled fabrication of CNT tips and is collaborating with the National Institute of Standards and Technology on the application of CNT tips for CD-AFM. Progress by KRISS on the precise control of CNT orientation, length, and end modification, using manipulation and focused ion beam processes, has allowed us to implement ball-capped CNT tips and bent CNT tips for CD-AFM. Using two different generations of CD-AFM instruments, we have evaluated these tip types by imaging a line/space grating and a programmed line edge roughness specimen. We concluded that these CNTs are capable of scanning the profiles of these structures, including re-entrant sidewalls, but there remain important challenges to address. These challenges include tighter control of tip geometry and careful optimization of scan parameters and algorithms for using CNT tips.

  5. Probing the role of an atomically thin SiNx interlayer on the structure of ultrathin carbon films.

    PubMed

    Dwivedi, Neeraj; Rismani-Yazdi, Ehsan; Yeo, Reuben J; Goohpattader, Partho S; Satyanarayana, Nalam; Srinivasan, Narasimhan; Druz, Boris; Tripathy, S; Bhatia, C S

    2014-05-21

    Filtered cathodic vacuum arc (FCVA) processed carbon films are being considered as a promising protective media overcoat material for future hard disk drives (HDDs). However, at ultrathin film levels, FCVA-deposited carbon films show a dramatic change in their structure in terms of loss of sp3 bonding, density, wear resistance etc., compared to their bulk counterpart. We report for the first time how an atomically thin (0.4 nm) silicon nitride (SiNx) interlayer helps in maintaining/improving the sp3 carbon bonding, enhancing interfacial strength/bonding, improving oxidation/corrosion resistance, and strengthening the tribological properties of FCVA-deposited carbon films, even at ultrathin levels (1.2 nm). We propose the role of the SiNx interlayer in preventing the catalytic activity of Co and Pt in media, leading to enhanced sp3C bonding (relative enhancement~40%). These findings are extremely important in view of the atomic level understanding of structural modification and the development of high density HDDs.

  6. Probing the Role of an Atomically Thin SiNx Interlayer on the Structure of Ultrathin Carbon Films

    PubMed Central

    Dwivedi, Neeraj; Rismani-Yazdi, Ehsan; Yeo, Reuben J.; Goohpattader, Partho S.; Satyanarayana, Nalam; Srinivasan, Narasimhan; Druz, Boris; Tripathy, S.; Bhatia, C. S.

    2014-01-01

    Filtered cathodic vacuum arc (FCVA) processed carbon films are being considered as a promising protective media overcoat material for future hard disk drives (HDDs). However, at ultrathin film levels, FCVA-deposited carbon films show a dramatic change in their structure in terms of loss of sp3 bonding, density, wear resistance etc., compared to their bulk counterpart. We report for the first time how an atomically thin (0.4 nm) silicon nitride (SiNx) interlayer helps in maintaining/improving the sp3 carbon bonding, enhancing interfacial strength/bonding, improving oxidation/corrosion resistance, and strengthening the tribological properties of FCVA-deposited carbon films, even at ultrathin levels (1.2 nm). We propose the role of the SiNx interlayer in preventing the catalytic activity of Co and Pt in media, leading to enhanced sp3C bonding (relative enhancement ~40%). These findings are extremely important in view of the atomic level understanding of structural modification and the development of high density HDDs. PMID:24846506

  7. Voltage-pulsed and laser-pulsed atom probe tomography of a multiphase high-strength low-carbon steel.

    PubMed

    Mulholland, Michael D; Seidman, David N

    2011-12-01

    The differences in artifacts associated with voltage-pulsed and laser-pulsed (wavelength = 532 or 355 nm) atom-probe tomographic (APT) analyses of nanoscale precipitation in a high-strength low-carbon steel are assessed using a local-electrode atom-probe tomograph. It is found that the interfacial width of nanoscale Cu precipitates increases with increasing specimen apex temperatures induced by higher laser pulse energies (0.6-2 nJ pulse(-1) at a wavelength of 532 nm). This effect is probably due to surface diffusion of Cu atoms. Increasing the specimen apex temperature by using pulse energies up to 2 nJ pulse(-1) at a wavelength of 532 nm is also found to increase the severity of the local magnification effect for nanoscale M2C metal carbide precipitates, which is indicated by a decrease of the local atomic density inside the carbides from 68 ± 6 nm(-3) (voltage pulsing) to as small as 3.5 ± 0.8 nm(-3). Methods are proposed to solve these problems based on comparisons with the results obtained from voltage-pulsed APT experiments. Essentially, application of the Cu precipitate compositions and local atomic density of M2C metal carbide precipitates measured by voltage-pulsed APT to 532 or 355 nm wavelength laser-pulsed data permits correct quantification of precipitation.

  8. Measurement of the resistance induced by a single atomic impurity on a (7,6) semiconducting carbon nanotube: scattering strength of individual potassium atoms as a function of gate voltage

    NASA Astrophysics Data System (ADS)

    Tsuchikawa, Ryuichi; Ahmadi, Amin; Heligman, Daniel; Zhang, Zhengyi; Mucciolo, Eduardo; Hone, James; Ishigami, Masa

    2015-03-01

    Despite many years of research, no measurements have been performed to determine resistance induced by impurities in carbon nanotubes. Over the last few years, we have developed a capability to measure the resistance induced by a single impurity atom on nanotubes with known chirality. Using this capability, we measured the resistance induced by an individual potassium atom on a (7,6) semiconducting carbon nanotube. The ``atomic'' resistance of potassium is found to be in the kohm range and has a strong dependence on the applied gate voltage. The scattering strength of the p-type (valence band) channel is approximately 20 times greater than that of the n-type (conduction band) channel. We integrate our atomically-controlled experimental result to a numerical recursive Green's function technique, which can precisely model the experiment, to understand the measured ``atomic'' resistance and the asymmetry. This work is based upon research supported by the National Science Foundation under Grant No. 0955625 and 1006230.

  9. Self-Assembled Fe-N-Doped Carbon Nanotube Aerogels with Single-Atom Catalyst Feature as High-Efficiency Oxygen Reduction Electrocatalysts

    DOE PAGES

    Zhu, Chengzhou; Fu, Shaofang; Song, Junhua; ...

    2017-02-06

    In this study, self-assembled M–N-doped carbon nanotube aerogels with single-atom catalyst feature are for the first time reported through one-step hydrothermal route and subsequent facile annealing treatment. By taking advantage of the porous nanostructures, 1D nanotubes as well as single-atom catalyst feature, the resultant Fe–N-doped carbon nanotube aerogels exhibit excellent oxygen reduction reaction electrocatalytic performance even better than commercial Pt/C in alkaline solution.

  10. Self-Assembled Fe-N-Doped Carbon Nanotube Aerogels with Single-Atom Catalyst Feature as High-Efficiency Oxygen Reduction Electrocatalysts.

    PubMed

    Zhu, Chengzhou; Fu, Shaofang; Song, Junhua; Shi, Qiurong; Su, Dong; Engelhard, Mark H; Li, Xiaolin; Xiao, Dongdong; Li, Dongsheng; Estevez, Luis; Du, Dan; Lin, Yuehe

    2017-04-01

    Self-assembled M-N-doped carbon nanotube aerogels with single-atom catalyst feature are for the first time reported through one-step hydrothermal route and subsequent facile annealing treatment. By taking advantage of the porous nanostructures, 1D nanotubes as well as single-atom catalyst feature, the resultant Fe-N-doped carbon nanotube aerogels exhibit excellent oxygen reduction reaction electrocatalytic performance even better than commercial Pt/C in alkaline solution.

  11. An efficient synthesis of organic carbonates: atom economic protocol with a new catalytic system.

    PubMed

    Veldurthy, Bhaskar; Figueras, François

    2004-03-21

    Selective and solvent free synthesis of unsymmetrical organic carbonates catalysed by a reusable MgLa mixed oxide is achieved for the first time via direct condensation of an alcohol and diethyl carbonate in economic route with excellent yields.

  12. 30 CFR 75.1003 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 75.1003 Section 75.1003... Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. Trolley wires, trolley feeder wires, and bare signal wires shall be insulated...

  13. Vertical Alignment of Single-Walled Carbon Nanotubes on Nanostructure Fabricated by Atomic Force Microscope

    DTIC Science & Technology

    2009-12-16

    Kobayashi Y, Yamashita T, Ueno Y, Niwa O, Homma Y, Ogino T. Extremely intense Raman signals from single-walled carbon nanotubes suspended between Si...carbon nanotube field effect transistors with carbon nanotube electrodes. Appl Phys Lett. 2008;92(4):043110-3. [13] Jung YJ, Homma Y, Ogino T...Homma Y, Yamashita T, Kobayashi Y, Ogino T. Interconnection of nanostructures using carbon nanotubes. Physica B. 2002;323(1-4):122-3. [23] Searson

  14. Windows: Life after Wire.

    ERIC Educational Resources Information Center

    Razwick, Jerry

    2003-01-01

    Although wired glass is extremely common in school buildings, the International Building Code adopted new standards that eliminate the use of traditional wired glass in K-12 schools, daycare centers, and athletic facilities. Wired glass breaks easily, and the wires can cause significant injuries by forming dangerous snags when the glass breaks.…

  15. Windows: Life after Wire.

    ERIC Educational Resources Information Center

    Razwick, Jerry

    2003-01-01

    Although wired glass is extremely common in school buildings, the International Building Code adopted new standards that eliminate the use of traditional wired glass in K-12 schools, daycare centers, and athletic facilities. Wired glass breaks easily, and the wires can cause significant injuries by forming dangerous snags when the glass breaks.…

  16. Formulation of atomic positions and carbon-carbon bond length in armchair graphene nanoribbons: an ab initio study

    NASA Astrophysics Data System (ADS)

    Balarastaghi, Mehran; Ahmadi, Vahid

    2017-09-01

    In this paper, we investigate the atomic positions of single layer armchair graphene nanoribbon for two cases, with and without hydrogen-passivate edges, accurately and propose a formula which either removes the need of structural relaxation generally or decreases its time extremely (up to seven times). We also propose a general pattern (hyperbolic) for these positions. On the other hand, we show that edge effect influences several atoms near the edge not just one. These results can be used in software, which compute atomic positions and can increase their efficiency. In addition, we prove that the C-C bond distance depends on dimer number and differs in length and width directions, especially for narrow AGNRs. The maximum value of these differences is about 0.017 Å.

  17. Strain rate effect in high-speed wire drawing process

    NASA Astrophysics Data System (ADS)

    He, S.; Van Houtte, P.; Van Bael, A.; Mei, F.; Sarban, A.; Boesman, P.; Galvez, F.; Atienza, J. M.

    2002-05-01

    This paper presents a study on the strain rate effect during high-speed wire drawing process by means of finite element simulation. Based on the quasistatic stresses obtained by normal tensile tests and dynamic stresses at high strain rates by split Hopkinson pressure bar tests, the wire drawing process was simulated for low carbon steel and high carbon steel. The results show that both the deformation process and the final properties of drawn wires are influenced by the strain rate.

  18. 78 FR 75545 - Prestressed Concrete Steel Rail Tie Wire From the People's Republic of China: Preliminary...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-12-12

    ... International Trade Administration Prestressed Concrete Steel Rail Tie Wire From the People's Republic of China... concrete steel rail tie wire (``PC tie wire'') from the People's Republic of China (``PRC'') is being, or... prestressed tendons in concrete railroad ties (``PC tie wire''). High carbon steel is defined as steel...

  19. Carbon Redistribution and Carbide Precipitation in a High-Strength Low-Carbon HSLA-115 Steel Studied on a Nanoscale by Atom Probe Tomography

    NASA Astrophysics Data System (ADS)

    Jain, Divya; Isheim, Dieter; Seidman, David N.

    2017-07-01

    HSLA-115 is a newly developed Cu-bearing high-strength low-carbon martensitic steel for use in Naval structural applications. This research provides, for the first time, a comprehensive compositional analysis of carbon redistribution and associated complex phase transformations in an isothermal aging study of HSLA-115 at 823 K (550 °C). Specifically, we characterize carbon segregation at lath boundaries, grain-refining niobium carbonitrides, cementite, and secondary hardening M2C carbides, in addition to copper precipitation, by 3D atom probe tomography (APT). Segregation of carbon (3 to 6 at. pct C) is observed at martensitic lath boundaries in the as-quenched and 0.12-hour aged microstructures. On further aging, carbon redistributes itself forming cementite and M2C carbides. Niobium carbonitride precipitates do not dissolve during the austenitizing treatment and are inherited in the as-quenched and aged microstructures; these are characterized along with cementite by synchrotron X-ray diffraction and APT. Sub-nanometer-sized M2C carbide precipitates are observed after the formation of Cu precipitates, co-located with the latter, indicating heterogeneous nucleation of M2C. The temporal evolution of the composition and morphology of M2C carbides at 823 K (550 °C) is described using APT; their precipitation kinetics is intertwined with Cu precipitates, affecting the bulk mechanical properties of HSLA-115. Phase compositions determined by APT are compared with computed compositions at thermodynamic equilibrium using ThermoCalc.

  20. Stretched Wire Mechanics

    SciTech Connect

    Bowden, Gordon; /SLAC

    2005-09-06

    Stretched wires are beginning to play an important role in the alignment of accelerators and synchrotron light sources. Stretched wires are proposed for the alignment of the 130 meter long LCLS undulator. Wire position technology has reached sub-micron resolution yet analyses of perturbations to wire straightness are hard to find. This paper considers possible deviations of stretched wire from the simple 2-dimensional catenary form.

  1. Effect of doping by boron, carbon, and nitrogen atoms on the magnetic and photocatalytic properties of anatase

    NASA Astrophysics Data System (ADS)

    Zainullina, V. M.; Zhukov, V. P.; Korotin, M. A.; Polyakov, E. V.

    2011-07-01

    The effect of doping of titanium dioxide with the anatase structure by boron, carbon, and nitrogen atoms on the magnetic and optical properties and the electronic spectrum of this compound has been investigated using the ab initio tight-binding linear muffin-tin orbital (TB-LMTO) band-structure method in the local spin density approximation explicitly including Coulomb correlations (LSDA + U) in combination with the semiempirical extended Hückel theory (EHT) method. The LSDA + U calculations of the electronic structure, the imaginary part of the dielectric function, the total magnetic moments, and the magnetic moments at the impurity atoms have been carried out. The diagrams of the molecular orbitals of the clusters Ti3 X ( X = B, C, N) have been calculated and the pseudo-space images of the molecular orbitals of the clusters have been constructed. The effect of doping on the nature and origin of photocatalytic activity in the visible spectral range and the specific features of the generation of ferromagnetic interactions in doped anatase have been discussed based on the analysis of the obtained data. It has been shown that, in the sequence TiO2 - y N y → TiO2 - y C y → TiO2 - y B y ( y = 1/16), the photocatalytic activity can increase with the generation of electronic excitations with the participation of impurity bands. The calculated magnetic moments for boron and nitrogen atoms are equal to 1 μB, whereas the impurity carbon atoms are nonmagnetic.

  2. Computational design of organometallic oligomers featuring 1,3-metal-carbon bonding and planar tetracoordinate carbon atoms.

    PubMed

    Zhao, Xue-Feng; Yuan, Cai-Xia; Wang, Xiang; Li, Jia-Jia; Wu, Yan-Bo; Wang, Xiaotai

    2016-01-15

    Density functional theory computations (B3LYP) have been used to explore the chemistry of titanium-aromatic carbon "edge complexes" with 1,3-metal-carbon (1,3-MC) bonding between Ti and planar tetracoordinate Cβ . The titanium-coordinated, end-capping chlorides are replaced with OH or SH groups to afford two series of difunctional monomers that can undergo condensation to form oxide- and sulfide-bridged oligomers. The sulfide-linked oligomers have less molecular strain and are more exergonic than the corresponding oxide-linked oligomers. The HOMO-LUMO gap of the oligomers varies with their composition and decreases with growing oligomer chain. This theoretical study is intended to enrich 1,3-MC bonding and planar tetracoordinate carbon chemistry and provide interesting ideas to experimentalists. Organometallic complexes with the TiE2 (E = OH and SH) decoration on the edge of aromatic hydrocarbons have been computationally designed, which feature 1,3-metal-carbon (1,3-MC) bonding between titanium and planar tetracoordinate β-carbon. Condensation of these difunctional monomers by eliminating small molecules (H2O and H2S) produce chain-like oligomers. The HOMO-LUMO gaps of the oligomers decreases with growing oligomer chain, a trend that suggests possible semiconductor properties for oligomers with longer chains.

  3. Transition metal-catalyzed/mediated reaction of allenes with a nucleophilic functionality connected to the alpha-carbon atom.

    PubMed

    Ma, Shengming

    2003-09-01

    Allenes with a nucleophilic functionality connected to the alpha-carbon atom have been shown to be versatile building blocks for the syn-thesis of gamma-butenolides, gamma-lactams, gamma-iminolactones, vinylic epoxides, 4-amino-2-alkenols, 2-amino-3-alkenols, 2,5-dihydrofurans, furans, vinylic cyclopropanes, and cyclopentenes, depending on the nature of the nucleophilic centers. The reaction may proceed via the carbometalation-nucleophilic attack mechanism or nucleometallation-reductive elimination. The stereochemical outcomes by these two pathways are different.

  4. Large-Scale Fabrication of Carbon Nanotube Probe Tips For Atomic Force Microscopy Critical Dimension Imaging Applications

    NASA Technical Reports Server (NTRS)

    Ye, Qi Laura; Cassell, Alan M.; Stevens, Ramsey M.; Meyyappan, Meyya; Li, Jun; Han, Jie; Liu, Hongbing; Chao, Gordon

    2004-01-01

    Carbon nanotube (CNT) probe tips for atomic force microscopy (AFM) offer several advantages over Si/Si3N4 probe tips, including improved resolution, shape, and mechanical properties. This viewgraph presentation discusses these advantages, and the drawbacks of existing methods for fabricating CNT probe tips for AFM. The presentation introduces a bottom up wafer scale fabrication method for CNT probe tips which integrates catalyst nanopatterning and nanomaterials synthesis with traditional silicon cantilever microfabrication technology. This method makes mass production of CNT AFM probe tips feasible, and can be applied to the fabrication of other nanodevices with CNT elements.

  5. Improved electroless plating method through ultrasonic spray atomization for depositing silver nanoparticles on multi-walled carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Zhao, Qi; Xie, Ming; Liu, Yichun; Yi, Jianhong

    2017-07-01

    A novel method was developed to deposit nanosized silver particles on multi-walled carbon nanotubes (MWCNTs). The electroless plating of silver on MWCNTs accomplished in small solution drops generated by ultrasonic spray atomization, which inhibited excessive growth of silver particles and led to much more uniform nanometer grain-sized coatings. The results showed that pretreatment was essential for silver particles to deposit on the MWCNTs, and the electrolyte concentration and reaction temperature were important parameters which had a great influence on the morphology and structure of the silver coatings. Possible mechanisms of this method are also discussed in the paper.

  6. Large-Scale Fabrication of Carbon Nanotube Probe Tips For Atomic Force Microscopy Critical Dimension Imaging Applications

    NASA Technical Reports Server (NTRS)

    Ye, Qi Laura; Cassell, Alan M.; Stevens, Ramsey M.; Meyyappan, Meyya; Li, Jun; Han, Jie; Liu, Hongbing; Chao, Gordon

    2004-01-01

    Carbon nanotube (CNT) probe tips for atomic force microscopy (AFM) offer several advantages over Si/Si3N4 probe tips, including improved resolution, shape, and mechanical properties. This viewgraph presentation discusses these advantages, and the drawbacks of existing methods for fabricating CNT probe tips for AFM. The presentation introduces a bottom up wafer scale fabrication method for CNT probe tips which integrates catalyst nanopatterning and nanomaterials synthesis with traditional silicon cantilever microfabrication technology. This method makes mass production of CNT AFM probe tips feasible, and can be applied to the fabrication of other nanodevices with CNT elements.

  7. Concealed wire tracing apparatus

    DOEpatents

    Kronberg, James W.

    1994-01-01

    An apparatus and method that combines a signal generator and a passive signal receiver to detect and record the path of partially or completely concealed electrical wiring without disturbing the concealing surface. The signal generator applies a series of electrical pulses to the selected wiring of interest. The applied pulses create a magnetic field about the wiring that can be detected by a coil contained within the signal receiver. An audible output connected to the receiver and driven by the coil reflects the receivers position with respect to the wiring. The receivers audible signal is strongest when the receiver is directly above the wiring and the long axis of the receivers coil is parallel to the wiring. A marking means is mounted on the receiver to mark the location of the wiring as the receiver is directed over the wiring's concealing surface. Numerous marks made on various locations of the concealing surface will trace the path of the wiring of interest.

  8. Magnetic properties of a single iron atomic chain encapsulated in armchair carbon nanotubes: A Monte Carlo study

    NASA Astrophysics Data System (ADS)

    Masrour, R.; Jabar, A.; Hamedoun, M.; Benyoussef, A.; Hlil, E. K.

    2017-06-01

    The magnetic properties have been investigated of FeCuxC1-x for a Fe atom chain wrapped in armchair (N,N) carbon nanotubes (N = 4,6,8,10,12) diluted by Cu2+ ions using Monte Carlo simulations. The thermal total magnetization and magnetic susceptibility are found. The reduced transition temperatures of iron and carbon have been calculated for different N and the exchange interactions. The total magnetization is obtained for different exchange interactions and crystal field. The Magnetic hysteresis cycles are obtained for different N, the reduced temperatures and exchange interactions. The multiple magnetic hysteresis is found. This system shows it can be used as magnetic nanostructure possessing potential current and future applications in permanent magnetism, magnetic recording and spintronics.

  9. Attosecond angular flux of partial charges on the carbon atoms of benzene in non-aromatic excited state

    NASA Astrophysics Data System (ADS)

    Hermann, Gunter; Liu, ChunMei; Manz, Jörn; Paulus, Beate; Pohl, Vincent; Tremblay, Jean Christophe

    2017-09-01

    Recently, it was discovered that excitation of the oriented model benzene from its aromatic electronic ground state S0 (1A1g) to the non-aromatic S0 +S2 (1B1u) superposition state generates negative and positive partial charges on alternating carbon atoms. Subsequently, they vary periodically, due to adiabatic attosecond charge migration AACM. Here, we determine the angular electronic flux that mediates this new type of AACM, by means of quantum dynamics simulations. It is found to be periodic, with period τ bar = 590as , and with a pincer motion type pattern such that a total of 1.2 valence electrons flow concertedly between alternating sources and sinks at the carbon nuclei.

  10. Operando atomic structure and active sites of TiO2(110)-supported gold nanoparticles during carbon monoxide oxidation.

    PubMed

    Saint-Lager, Marie-Claire; Laoufi, Issam; Bailly, Aude

    2013-01-01

    It is well known that gold nanoparticles supported on TiO2 act as a catalyst for CO oxidation, even below room temperature. Despite extensive studies, the origin of this catalytic activity remains under debate. Indeed, when the particle size decreases, many changes may occur; thus modifying the nanoparticles' electronic properties and consequently their catalytic performances. Thanks to a state-of-the-art home-developed setup, model catalysts can be prepared in ultra-high vacuum and their morphology then studied in operando conditions by Grazing Incidence Small Angle X-ray Scattering, as well as their atomic structure by Grazing Incidence X-ray Diffraction as a function of their catalytic activity. We previously reported on the existence of a catalytic activity maximum observed for three-dimensional gold nanoparticles with a diameter of 2-3 nm and a height of 6-7 atomic planes. In the present work we correlate this size dependence of the catalytic activity to the nanoparticles' atomic structure. We show that even when their size decreases below the optimum diameter, the gold nanoparticles keep the face-centered cubic structure characteristic of bulk gold. Nevertheless, for these smallest nanoparticles, the lattice parameter presents anisotropic strains with a larger contraction in the direction perpendicular to the surface. Moreover a careful analysis of the atomic-scale morphology around the catalytic activity maximum tends to evidence the role of sites with a specific geometry at the interface between the nanoparticles and the substrate. This argues for models where atoms at the interface periphery act as catalytically active sites for carbon monoxide oxidation.

  11. Wire Test Grip Fixture

    NASA Technical Reports Server (NTRS)

    Burke, Christopher S.

    2011-01-01

    Wire-testing issues, such as the gripping strains imposed on the wire, play a critical role in obtaining clean data. In a standard test frame fitted with flat wedge grips, the gripping action alone creates stresses on the wire specimen that cause the wire to fail at the grip location. A new test frame, which is outfitted with a vacuum chamber, negated the use of any conventional commercially available wire test fixtures, as only 7 in. (17.8 cm) existed between the grip faces. An innovative grip fixture was designed to test thin gauge wire for a variety of applications in an existing Instron test frame outfitted with a vacuum chamber.

  12. An atom probe study of carbon distribution in martensite in 2[1/4]Cr1Mo steel

    SciTech Connect

    Thomson, R.C. . Dept. of Materials Science and Metallurgy); Miller, M.K. . Metals and Ceramics Division)

    1995-01-15

    2[1/4]Cr1Mo steel is used widely for superheater tubing in power plants, and as a filler material for joining [1/2]Cr[1/2]Mo[1/4]V steam piping. Components in power plants can be massive and therefore differences in cooling rates can result in a mixed microstructure of allotriomorphic ferrite, bainite and martensite. The creep strength of the steel is critically dependent on the carbide distribution within the microstructure. The position and nature of carbides within the microstructure is itself a critical function of the movement of carbon through the microstructure during the early stages of tempering. In this paper, atom probe field ion microscopy has been used to examine carbon segregation to lath boundaries in martensite in 2[1/4]Cr1Mo steel. Significant carbon enrichment was observed at the lath boundaries. This enrichment is consistent with the observation of retained austenite films at the lath boundaries in the transmission electron microscope, and with carbon levels previously found in retained austenite in low alloy ferrous martensites.

  13. Motion control of the accumulator flying wires

    SciTech Connect

    Wang, X.Q.

    1990-04-23

    Flying wire systems for the Fermilab Accumulator are being constructed in order to measure the transverse beam profiles during stacking. Each device passes a 25 micron carbon filament through the beam transversely at a constant velocity of 10 m/s. Collisions between the beam particles and the wire produce secondary particle cascades, which in turn produce photons in a scintillator. A photomultiplier tube is used to measure the light intensity while the wire position is determined by an optical encoder. There are six Accumulator flying wire systems. Four of them are to be used in normal stacking operation: two horizontal and two vertical flying wires are in the AP40 high dispersion section, covering the core orbit and the extraction orbit respectively. The other two horizontal wires are for measuring the momentum distribution of the beam on the central orbit at the Accumulator transition energy. At the AP40 high dispersion region a wire covers the central orbit, the other is in the AP30 low dispersion section. The operation and control of the flying wire system is discussed in this paper. 11 figs.

  14. Low-temperature carbon monoxide oxidation catalysed by regenerable atomically dispersed palladium on alumina

    SciTech Connect

    Peterson, Eric J.; DelaRiva, Andrew T.; Lin, Sen; Johnson, Ryan S.; Guo, Hua; Miller, Jeffrey T.; Kwak, Ja Hun; Peden, Charles H.F.; Kiefer, Boris; Allard, Lawrence F.; Ribeiro, Fabio H.; Datye, Abhaya K.

    2014-09-15

    Catalysis by single isolated atoms of precious metals has attracted much recent interest since it promises the ultimate economy in atom efficiency. Previous reports have been confined to reducible oxide supports such as FeOx, TiO₂ or CeO₂. Here we show that isolated Pd atoms can be stabilized on industrially relevant gamma-alumina supports. At low Pd loadings (≤0.5 wt%) these catalysts contain exclusively atomically dispersed Pd species. The addition of lanthanum-oxide to the alumina, long known for its ability to improve alumina stability, is found to also help in the stabilization of isolated Pd atoms. Aberration-corrected scanning transmission electron microscopy (AC-STEM) confirms the presence of intermingled Pd and La on the gamma-alumina surface. Operando X-ray absorption spectroscopy, performed on Pd/La-alumina and Pd/gamma-alumina (0.5 wt% Pd) demonstrates the presence of catalytically active atomically dispersed ionic Pd in the Pd/La-doped gamma-alumina system. CO oxidation reactivity measurements show onset of catalytic activity at 40 °C, indicating that the ionic Pd species are not poisoned by CO. The reaction order in CO and O₂ is positive, suggesting a reaction mechanism that is different from that on metallic Pd. The catalyst activity is lost if the Pd species are reduced to their metallic form, but the activity can be regenerated by oxidation at 700 °C in air. The high-temperature stability of these ionic Pd species on commercial alumina supports makes this catalyst system of potential interest for low-temperature exhaust treatment catalysts.

  15. Partially oxidized atomic cobalt layers for carbon dioxide electroreduction to liquid fuel

    NASA Astrophysics Data System (ADS)

    Gao, Shan; Lin, Yue; Jiao, Xingchen; Sun, Yongfu; Luo, Qiquan; Zhang, Wenhua; Li, Dianqi; Yang, Jinlong; Xie, Yi

    2016-01-01

    Electroreduction of CO2 into useful fuels, especially if driven by renewable energy, represents a potentially ‘clean’ strategy for replacing fossil feedstocks and dealing with increasing CO2 emissions and their adverse effects on climate. The critical bottleneck lies in activating CO2 into the CO2•- radical anion or other intermediates that can be converted further, as the activation usually requires impractically high overpotentials. Recently, electrocatalysts based on oxide-derived metal nanostructures have been shown to enable CO2 reduction at low overpotentials. However, it remains unclear how the electrocatalytic activity of these metals is influenced by their native oxides, mainly because microstructural features such as interfaces and defects influence CO2 reduction activity yet are difficult to control. To evaluate the role of the two different catalytic sites, here we fabricate two kinds of four-atom-thick layers: pure cobalt metal, and co-existing domains of cobalt metal and cobalt oxide. Cobalt mainly produces formate (HCOO-) during CO2 electroreduction; we find that surface cobalt atoms of the atomically thin layers have higher intrinsic activity and selectivity towards formate production, at lower overpotentials, than do surface cobalt atoms on bulk samples. Partial oxidation of the atomic layers further increases their intrinsic activity, allowing us to realize stable current densities of about 10 milliamperes per square centimetre over 40 hours, with approximately 90 per cent formate selectivity at an overpotential of only 0.24 volts, which outperforms previously reported metal or metal oxide electrodes evaluated under comparable conditions. The correct morphology and oxidation state can thus transform a material from one considered nearly non-catalytic for the CO2 electroreduction reaction into an active catalyst. These findings point to new opportunities for manipulating and improving the CO2 electroreduction properties of metal systems

  16. Negative ion productions in high velocity collision between small carbon clusters and Helium atom target

    NASA Astrophysics Data System (ADS)

    M, Chabot; K, Béroff; T, Pino; G, Féraud; N, Dothi; Padellec A, Le; G, Martinet; S, Bouneau; Y, Carpentier

    2012-11-01

    We measured absolute double capture cross section of Cn+ ions (n=1,5) colliding, at 2.3 and 2.6 a.u velocities, with an Helium target atom and the branching ratios of fragmentation of the so formed electronically excited anions Cn-*. We also measured absolute cross section for the electronic attachment on neutral Cn clusters colliding at same velocities with He atom. This is to our knowledge the first measurement of neutral-neutral charge exchange in high velocity collision.

  17. Chemisorption of Transition-Metal Atoms on Boron- and Nitrogen-Doped Carbon Nanotubes: Energetics and Geometric and Electronic Structures

    SciTech Connect

    An, Wei; Turner, C. H.

    2009-04-30

    The well-defined binding between transition-metals (TM) and the sidewall of carbon nanotubes (CNTs) plays a key role in the performance of CNT-based anoelectronics, as well as the stability of catalysts used in either heterogeneous catalysis or fuel-cell electrocatalysis. Spin-polarized density functional theory calculations demonstrate that either boron or nitrogen doping can increase the binding strength of TM atoms with singlewall carbon nanotubes (SWCNTs), and comparatively, boron doping is more effective. The binding nature can be identified as chemisorption, based on the magnitude of the binding energy and the formation of multiple bonds. The chemisorbed TM atoms can modify the electronic structure of the doped nanotubes in various ways, depending upon the TM and helicity of the CNT, rendering the TM/doped-SWCNT composite viable for a wide range of applications. A total of 11 technologically relevant TMs adsorbed on two distinct and stable doped-SWCNT models have been investigated in this study. The doping sites are arranged in either a locally concentrated or uniform fashion within semiconducting SWCNT(8,0) and metallic SWCNT(6,6). The results serve as a starting point for studying larger, more complex TM nanostructures anchored on the sidewall of boron- or nitrogen-doped CNTs.

  18. 4.4.2 R1, R2 and R3: Leading atom other than carbon

    NASA Astrophysics Data System (ADS)

    Beckwith, A. L. J.

    This document is part of Subvolume A1 `Inorganic Radicals, Metal Complexes and Nonconjugated Carbon Centered Radicals' of Volume 26 `Magnetic Properties of Free Radicals' of Landolt-Börnstein Group II `Molecules and Radicals'.

  19. 4.4.1 R1, R2 and R3: Leading atom is carbon

    NASA Astrophysics Data System (ADS)

    Beckwith, A. L. J.

    This document is part of Subvolume A1 `Inorganic Radicals, Metal Complexes and Nonconjugated Carbon Centered Radicals' of Volume 26 `Magnetic Properties of Free Radicals' of Landolt-Börnstein Group II `Molecules and Radicals'.

  20. Base Information Transport Infrastructure Wired (BITI Wired)

    DTIC Science & Technology

    2016-03-01

    2016 Major Automated Information System Annual Report Base Information Transport Infrastructure Wired (BITI Wired) Defense Acquisition Management ...Major Automated Information System MAIS OE - MAIS Original Estimate MAR – MAIS Annual Report MDA - Milestone Decision Authority MDD - Materiel...Combat Information Transport System program was restructured into two pre-Major Automated Information System (pre-MAIS) components: Information

  1. Cable Bundle Wire Derating

    NASA Technical Reports Server (NTRS)

    Lundquist, Ray A.; Leidecker, Henning

    1999-01-01

    The allowable operating currents of electrical wiring when used in the space vacuum environment is predominantly determined by the maximum operating temperature of the wire insulation. For Kapton insulated wire this value is 200 degree C. Guidelines provided in the Goddard Space Flight Center (GSFC) Preferred Parts List (PPL) limit the operating current of wire within vacuum to ensure the maximum insulation temperature is not exceeded. For 20 AWG wire, these operating parameters are: (1) 3.7 amps per wire (2) bundle of 15 or more wires (3) 70 C environment (4) vacuum of 10(exp -5) torr or less To determine the behavior and temperature of electrical wire at different operating conditions, a thermal vacuum test was performed on a representative electrical harness of the Hubble Space Telescope (HST) power distribution system. This paper describes the test and the results.

  2. Cable Bundle Wire Derating

    NASA Technical Reports Server (NTRS)

    Lundquist, Ray A.; Leidecker, Henning

    1998-01-01

    The allowable operating currents of electrical wiring when used in the space vacuum environment is predominantly determined by the maximum operating temperature of the wire insulation. For Kapton insulated wire this value is 200 C. Guidelines provided in the Goddard Space Flight Center (GSFC) Preferred Parts List (PPL) limit the operating current of wire within vacuum to ensure the maximum insulation temperature is not exceeded. For 20 AWG wire, these operating parameters are: 3.7 amps per wire, bundle of 15 or more wires, 70 C environment, and vacuum of 10(exp -5) torr or less. To determine the behavior and temperature of electrical wire at different operating conditions, a thermal vacuum test was performed on a representative electrical harness of the Hubble Space Telescope (HST) power distribution system. This paper describes the test and the results.

  3. Cable Bundle Wire Derating

    NASA Technical Reports Server (NTRS)

    Lundquist, Ray A.; Leidecker, Henning

    1998-01-01

    The allowable operating currents of electrical wiring when used in the space vacuum environment is predominantly determined by the maximum operating temperature of the wire insulation. For Kapton insulated wire this value is 200 C. Guidelines provided in the Goddard Space Flight Center (GSFC) Preferred Parts List (PPL) limit the operating current of wire within vacuum to ensure the maximum insulation temperature is not exceeded. For 20 AWG wire, these operating parameters are: (1) 3.7 amps per wire; (2) bundle of 15 or more wires; (3) 70 C environment: and (4) vacuum of 10(exp -5) torr or less. To determine the behavior and temperature of electrical wire at different operating conditions, a thermal vacuum test was performed on a representative electrical harness of the Hubble Space Telescope (HST) power distribution system. This paper describes the test and the results.

  4. Cable Bundle Wire Derating

    NASA Technical Reports Server (NTRS)

    Lundquist, Ray A.; Leidecker, Henning

    1998-01-01

    The allowable operating currents of electrical wiring when used in the space vacuum environment is predominantly determined by the maximum operating temperature of the wire insulation. For Kapton insulated wire this value is 200 C. Guidelines provided in the Goddard Space Flight Center (GSFC) Preferred Parts List (PPL) limit the operating current of wire within vacuum to ensure the maximum insulation temperature is not exceeded. For 20 AWG wire, these operating parameters are: 3.7 amps per wire, bundle of 15 or more wires, 70 C environment, and vacuum of 10(exp -5) torr or less. To determine the behavior and temperature of electrical wire at different operating conditions, a thermal vacuum test was performed on a representative electrical harness of the Hubble Space Telescope (HST) power distribution system. This paper describes the test and the results.

  5. Wire harness twisting aid

    NASA Technical Reports Server (NTRS)

    Casey, E. J.; Commadore, C. C.; Ingles, M. E.

    1980-01-01

    Long wire bundles twist into uniform spiral harnesses with help of simple apparatus. Wires pass through spacers and through hand-held tool with hole for each wire. Ends are attached to low speed bench motor. As motor turns, operator moves hand tool away forming smooth twists in wires between motor and tool. Technique produces harnesses that generate less radio-frequency interference than do irregularly twisted cables.

  6. Wire harness twisting aid

    NASA Technical Reports Server (NTRS)

    Casey, E. J.; Commadore, C. C.; Ingles, M. E.

    1980-01-01

    Long wire bundles twist into uniform spiral harnesses with help of simple apparatus. Wires pass through spacers and through hand-held tool with hole for each wire. Ends are attached to low speed bench motor. As motor turns, operator moves hand tool away forming smooth twists in wires between motor and tool. Technique produces harnesses that generate less radio-frequency interference than do irregularly twisted cables.

  7. Force-controlled lifting of molecular wires

    NASA Astrophysics Data System (ADS)

    Fournier, N.; Wagner, C.; Weiss, C.; Temirov, R.; Tautz, F. S.

    2011-07-01

    Lifting a single molecular wire off the surface with a combined frequency-modulated atomic force and tunneling microscope it is possible to monitor the evolution of both the wire configuration and the contacts simultaneously with the transport conductance experiment. In particular, critical points where individual bonds to the surface are broken and instabilities where the wire is prone to change its contact configuration can be identified in the force gradient and dissipation responses of the junction. This additional mechanical information can be used to unambiguously determine the conductance of a true molecular wire, that is, of a molecule that is contacted via a pointlike “crocodile clip” to each of the electrodes but is otherwise free.

  8. Laser Wire Stripper

    NASA Technical Reports Server (NTRS)

    1983-01-01

    NASA-developed space shuttle technology is used in a laser wire stripper designed by Raytheon Company. Laser beams cut through insulation on a wire without damaging conductive metal, because laser radiation that melts plastic insulation is reflected by the metal. The laser process is fast, clean, precise and repeatable. It eliminates quality control problems and the expense of rejected wiring.

  9. EMF wire code research

    SciTech Connect

    Jones, T.

    1993-11-01

    This paper examines the results of previous wire code research to determines the relationship with childhood cancer, wire codes and electromagnetic fields. The paper suggests that, in the original Savitz study, biases toward producing a false positive association between high wire codes and childhood cancer were created by the selection procedure.

  10. Flicking-wire drag tensioner

    NASA Technical Reports Server (NTRS)

    Dassele, M. A.; Fairall, H.

    1978-01-01

    Wire-drag system improves wire profile and applies consistent drag to wire. Wire drag is continuously adjustable from zero drag to tensile strength of wire. No-sag wire drag is easier to thread than former system and requires minimal downtime for cleaning and maintenance.

  11. Adhesion and friction between individual carbon nanotubes measured using force-versus-distance curves in atomic force microscopy

    NASA Astrophysics Data System (ADS)

    Bhushan, Bharat; Ling, Xing

    2008-07-01

    The adhesion and friction between individual nanotubes was investigated in ambient using a dynamic atomic force microscope (AFM) operating in force-calibration mode to capture force-versus-distance curves. A multiwalled carbon nanotube (MWNT) tip attached to a conventional AFM probe was brought into contact with and then ramped in vertical direction against a single-walled carbon nanotube (SWNT) bridge suspended over a 2-μm -wide trench. The interaction between nanotubes altered the oscillation amplitude, phase lag, and average deflection of AFM cantilever, from which the interacting forces between nanotubes are quantitatively derived. During ramping, a stick-slip motion was found to dominate the sliding between the nanotubes. The stick was attributed to the presence of high-energy points, such as structural defects or coating of amorphous carbon, on the surface of the MWNT tip. The coefficients of static friction and shear strength between nanotubes were evaluated to be about 0.2 and 1.4 GPa, respectively. They are about 2 orders of magnitude larger than the kinetic counterparts. The kinetic values are on the same order as that measured previously by sliding a MWNT tip across a SWNT bridge in lateral direction.

  12. Divalent Fe Atom Coordination in Two-Dimensional Microporous Graphitic Carbon Nitride.

    PubMed

    Oh, Youngtak; Hwang, Jin Ok; Lee, Eui-Sup; Yoon, Minji; Le, Viet-Duc; Kim, Yong-Hyun; Kim, Dong Ha; Kim, Sang Ouk

    2016-09-28

    Graphitic carbon nitride (g-C3N4) is a rising two-dimensional material possessing intrinsic semiconducting property with unique geometric configuration featuring superimposed heterocyclic sp(2) carbon and nitrogen network, nonplanar layer chain structure, and alternating buckling. The inherent porous structure of heptazine-based g-C3N4 features electron-rich sp(2) nitrogen, which can be exploited as a stable transition metal coordination site. Multiple metal-functionalized g-C3N4 systems have been reported for versatile applications, but local coordination as well as its electronic structure variation upon incoming metal species is not well understood. Here we present detailed bond coordination of divalent iron (Fe(2+)) through micropore sites of graphitic carbon nitride and provide both experimental and computational evidence supporting the aforementioned proposition. In addition, the utilization of electronic structure variation is demonstrated through comparative photocatalytic activities of pristine and Fe-g-C3N4.

  13. A high-pressure atomic force microscope for imaging in supercritical carbon dioxide.

    PubMed

    Lea, A S; Higgins, S R; Knauss, K G; Rosso, K M

    2011-04-01

    A high-pressure atomic force microscope (AFM) that enables in situ, atomic scale measurements of topography of solid surfaces in contact with supercritical CO(2) (scCO(2)) fluids has been developed. This apparatus overcomes the pressure limitations of the hydrothermal AFM and is designed to handle pressures up to 100 atm at temperatures up to ∼350 K. A standard optically-based cantilever deflection detection system was chosen. When imaging in compressible supercritical fluids such as scCO(2), precise control of pressure and temperature in the fluid cell is the primary technical challenge. Noise levels and imaging resolution depend on minimization of fluid density fluctuations that change the fluid refractive index and hence the laser path. We demonstrate with our apparatus in situ atomic scale imaging of a calcite (CaCO(3)) mineral surface in scCO(2); both single, monatomic steps and dynamic processes occurring on the (1014) surface are presented. This new AFM provides unprecedented in situ access to interfacial phenomena at solid-fluid interfaces under pressure. © 2011 American Institute of Physics

  14. A high-pressure atomic force microscope for imaging in supercritical carbon dioxide

    SciTech Connect

    Lea, A. S.; Higgins, S. R.; Knauss, K. G.; Rosso, K. M.

    2011-01-01

    A high-pressure atomic force microscope(AFM) that enables in situ, atomic scale measurements of topography of solid surfaces in contact with supercritical CO2 (scCO2) fluids has been developed. This apparatus overcomes the pressure limitations of the hydrothermal AFM and is designed to handle pressures up to 100 atm at temperatures up to ~350 K. A standard optically-based cantilever deflection detection system was chosen. When imaging in compressible supercritical fluids such as scCO2, precise control of pressure and temperature in the fluid cell is the primary technical challenge. Noise levels and imaging resolution depend on minimization of fluid density fluctuations that change the fluidrefractive index and hence the laser path. We demonstrate with our apparatus in situ atomic scale imaging of a calcite (CaCO3) mineral surface in scCO2; both single, monatomic steps and dynamic processes occurring on the (101¯4) surface are presented. Finally, this new AFM provides unprecedented in situ access to interfacial phenomena at solid–fluid interfaces under pressure.

  15. Kinetic and Mechanistic Studies of Carbon-to-Metal Hydrogen Atom Transfer Involving Os-Centered Radicals: Evidence for Tunneling

    SciTech Connect

    Lewandowska-Androlojc, Anna; Grills, David C.; Zhang, Jie; Bullock, R. Morris; Miyazawa, Akira; Kawanishi, Yuji; Fujita, Etsuko

    2014-03-05

    We have investigated the kinetics of novel carbon-to-metal hydrogen atom transfer reactions, in which homolytic cleavage of a C-H bond is accomplished by a single metal-centered radical. Studies by means of time-resolved IR spectroscopic measurements revealed efficient hydrogen atom transfer from xanthene, 9,10-dihydroanthracene and 1,4-cyclohexadiene to Cp(CO)2Os• and (n5-iPr4C5H)(CO)2Os• radicals, formed by photoinduced homolysis of the corresponding osmium dimers. The rate constants for hydrogen abstraction from these hydrocarbons were found to be in the range 1.54 × 105 M 1 s 1 -1.73 × 107 M 1 s-1 at 25 °C. For the first time, kinetic isotope effects for carbon-to-metal hydrogen atom transfer were determined. Large primary kinetic isotope effects of 13.4 ± 1.0 and 16.6 ± 1.4 were observed for the hydrogen abstraction from xanthene to form Cp(CO)2OsH and (n5-iPr4C5H)(CO)2OsH, respectively, at 25 °C. Temperature-dependent measurements of the kinetic isotope effects over a 60 -C temperature range were carried out to obtain the difference in activation energies and the pre-exponential factor ratio. For hydrogen atom transfer from xanthene to (n5-iPr4C5H)(CO)2Os•, the (ED - EH) = 3.25 ± 0.20 kcal/mol and AH/AD = 0.056 ± 0.018 values are greater than the semi-classical limits and thus suggest a quantum mechanical tunneling mechanism. The work at BNL was carried out under contract DE-AC02-98CH10886 with the U.S. Department of Energy and supported by its Division of Chemical Sciences, Geosciences & Biosciences, Office of Basic Energy Sciences. RMB also thanks the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences & Biosciences for support. Pacific Northwest National Laboratory is operated by Battelle for the U.S. Department of Energy.

  16. The abundances of atomic carbon and carbon monoxide compared with visual extinction in the Ophiuchus molecular cloud complex

    NASA Technical Reports Server (NTRS)

    Frerking, Margaret A.; Keene, Jocelyn; Blake, Geoffrey A.; Phillips, T. G.

    1989-01-01

    Emission from the 492 GHz lines of C I have been observed toward six positions in the Ophiuchus molecular cloud complex for which accurate visual extinctions are available. The column density of C I increases with A(V) to greater than 2 x 10 to the 17th/sq cm at 100 mag, the column-averaged fractional abundance reaches a peak of about 2.2 x 10 to the -5th for A(V) in the range 4-11 mag and the column-averaged abundance ratio of C I to CO decreases with A(V) from about 1 at 2 mag to greater that about 0.03 at 100 mag. These results imply that, while C I is not the primary reservoir of gaseous carbon even at cloud edges, its fractional abundance remains high for at least 10 mag into the cloud and may be significant at even greater depths.

  17. Selected developments in laser wire stripping. [cutting insulation from aerospace-type wires and cables

    NASA Technical Reports Server (NTRS)

    1977-01-01

    The operation of mechanical and thermal strippers and the early development of laser wire strippers are reviewed. NASA sponsored development of laser wire stripping for space shuttle includes bench-type strippers as well as an advanced portable hand-held stripper which incorporates a miniaturized carbon dioxide laser and a rotating optics unit with a gas-jet assist and debris exhaust. Drives and controls girdle the wire and slit the remaining slug without manual assistance. This unit can strip wire sizes 26 through 12 gage. A larger-capacity hand-held unit for wire sizes through 1/0 gage was built using a neodynium-doped yttrium aluminum garnet (Nd:YAG) laser. The hand-held units have a flexible umbilical cable to an accompanying cart that carries the power supply, gas supply, cooling unit, and the controls.

  18. Combined nano-SIMS/AFM/EBSD analysis and atom probe tomography, of carbon distribution in austenite/ε-martensite high-Mn steels.

    PubMed

    Seol, Jae-Bok; Lee, B-H; Choi, P; Lee, S-G; Park, C-G

    2013-09-01

    We introduce a new experimental approach for the identification of the atomistic position of interstitial carbon in a high-Mn binary alloy consisting of austenite and ε-martensite. Using combined nano-beam secondary ion mass spectroscopy, atomic force microscopy and electron backscatter diffraction analyses, we clearly observe carbon partitioning to austenite. Nano-beam secondary ion mass spectroscopy and atom probe tomography studies also reveal carbon trapping at crystal imperfections as identified by transmission electron microscopy. Three main trapping sites can be distinguished: phase boundaries between austenite and ε-martensite, stacking faults in austenite, and prior austenite grain boundaries. Our findings suggest that segregation and/or partitioning of carbon can contribute to the austenite-to-martensite transformation of the investigated alloy. Crown Copyright © 2013. Published by Elsevier B.V. All rights reserved.

  19. Atomic layer deposition of ruthenium on plasma-treated vertically aligned carbon nanotubes for high-performance ultracapacitors.

    PubMed

    Kim, Jun Woo; Kim, Byungwoo; Park, Suk Won; Kim, Woong; Shim, Joon Hyung

    2014-10-31

    It is challenging to realize a conformal metal coating by atomic layer deposition (ALD) because of the high surface energy of metals. In this study, ALD of ruthenium (Ru) on vertically aligned carbon nanotubes (CNTs) was carried out. To activate the surface of CNTs that lack surface functional groups essential for ALD, oxygen plasma was applied ex situ before ALD. X-ray photoelectron spectroscopy and Raman spectroscopy confirmed surface activation of CNTs by the plasma pretreatment. Transmission electron microscopy analysis with energy-dispersive x-ray spectroscopy composition mapping showed that ALD Ru grew conformally along CNTs walls. ALD Ru/CNTs were electrochemically oxidized to ruthenium oxide (RuOx) that can be a potentially useful candidate for use in the electrodes of ultracapacitors. Electrode performance of RuOx/CNTs was evaluated using cyclic voltammetry and galvanostatic charge-discharge measurements.

  20. Biofunctionalization of carbon nanotubes/chitosan hybrids on Ti implants by atom layer deposited ZnO nanostructures

    NASA Astrophysics Data System (ADS)

    Zhu, Yizhou; Liu, Xiangmei; Yeung, Kelvin W. K.; Chu, Paul K.; Wu, Shuilin

    2017-04-01

    One-dimensional (1D) nanostructures of ZnO using atomic layer deposition (ALD) on chitosan (CS) modified carbon nanotubes (CNTs) were first introduced onto the surfaces of biomedical implants. When the content of ZnO is not sufficient, CNTs can strengthen the antibacterial activity against E. coli and S. aureus by 8% and 39%, respectively. CS can improve the cytocompatibility of CNTs and ZnO. The amount of Zn content can be controlled by changing the cycling numbers of ALD processes. This hybrid coating can not only endow medical implants with high self-antibacterial efficacy against Escherichia coli (E. coli) and Staphylococcus aureus (S. aureus) of over 73% and 98%, respectively, but also regulate the proliferation and osteogenic differentiation of osteoblasts by controlling the amount of ZnO.

  1. 78 FR 75547 - Prestressed Concrete Steel Rail Tie Wire From Thailand: Preliminary Determination of Sales at Not...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-12-12

    ... International Trade Administration Prestressed Concrete Steel Rail Tie Wire From Thailand: Preliminary... concrete steel rail tire wire (``PC tie wire'') from Thailand is not being, or likely to be, sold in the... prestressed tendons in concrete railroad ties (``PC tie wire''). High carbon steel is defined as steel...

  2. Removal of carbon and nanoparticles from lithographic materials by plasma assisted cleaning by metastable atom neutralization (PACMAN)

    NASA Astrophysics Data System (ADS)

    Lytle, W. M.; Lofgren, R. E.; Surla, V.; Neumann, M. J.; Ruzic, D. N.

    2010-04-01

    System cleanliness is a major issue facing the lithographic community as the prospects of integrating EUV lithography into integrated circuit manufacturing progress. Mask cleanliness, especially of particles in the sub-micron range, remains an issue for the implementation of EUV lithography since traditional mask cleaning processes are limited in their ability to remove nanometer scale contaminants. The result is lower wafer throughput due to errors in pattern transfer to the wafer from the particulate defects on the mask. Additionally, carbon contamination and growth on the collector optics due to energetic photon interactions degrade the mirror and shortens its functional life. Plasma cleaning of surfaces has been used for a variety of applications in the past, and now is being extended to cleaning surfaces for EUV, specifically the mask and collector optics, through a process developed in the Center for Plasma-Material Interactions (CPMI) called Plasma Assisted Cleaning by Metastable Atom Neutralization (PACMAN). This process uses energetic neutral atoms (metastables) in addition to a high-density plasma (Te ~ 3 eV and ne ~ 1017 m-3) to remove particles. The PACMAN process is a completely dry process and is carried out in a vacuum which makes it compatible with other EUV related processing steps. Experiments carried out on cleaning polystyrene latex (PSL) nanoparticles (30 nm to 500 nm) on silicon wafers, chrome coated mask blanks, and EUV mask blanks result in 100 % particle removal with a helium plasma and helium metastables. Removal rates greater than 20 nm/min have been achieved for PSL material. Similar removal rates have been achieved for the PACMAN cleaning of carbon from silicon wafers (simulating collector optic material) with 100% removal with helium plasma and helium metastables. The PACMAN cleaning technique has not caused any damage to the substrate type being cleaned either through roughening or surface sputtering. Current results of cleaning

  3. Perfluoroalkyl carboxylic acids with up to 22 carbon atoms in snow and soil samples from a ski area.

    PubMed

    Plassmann, Merle M; Berger, Urs

    2013-05-01

    The use of fluorinated ski waxes as a direct input route of perfluoroalkyl carboxylic acids (PFCAs) to the environment was investigated. PFCA homologues with 6-22 carbon atoms (C6-22 PFCAs) were detected in fluorinated ski waxes and their raw materials by liquid chromatography coupled to tandem mass spectrometry. Snow and soil samples from a ski area in Sweden were taken after a skiing competition and after snowmelt, respectively. In both snow and soil samples C6-22 PFCAs were detected, representing the first report of PFCAs with up to 22 carbon atoms in environmental samples. Single analyte concentrations in snow (analyzed as melt water) and soil ranged up to 0.8μgL(-1) and 5ngg(-1) dry weight, respectively. ∑PFCA concentrations in snow and soil decreased from the start to the finish of the ski trail. Distinct differences in PFCA patterns between snow (prevalence of C14-20 PFCAs) and soil samples (C6-14 PFCAs dominating) were observed. Additionally, a PFCA pattern change from the start to about two third of the distance of the ski trail was found both for snow and soil, with a larger fraction of longer chain homologues present in samples from the start. These observations are probably a result of differences in PFCA homologue patterns present in different types of waxes. The calculated PFCA input from snow affected by the skiing competition was smaller than the PFCA inventory in soil for all chain lengths and markedly smaller for C6-15 PFCAs, presenting evidence for long-term accumulation in soil.

  4. From atoms to minerals: how calcium carbonates form and why we should care.

    NASA Astrophysics Data System (ADS)

    Diego Rodriguez-Blanco, Juan

    2017-04-01

    Calcium carbonate minerals are ubiquitous on Earth where they play a key role in many marine and terrestrial biomineralization processes, controlling the evolution of past and future ocean chemistry and a large part of the global carbon cycle. However, the mechanisms by which biominerals form and transform are not well understood because these processes frequently involve the formation of poorly-ordered and crystalline metastable phases (e.g., amorphous calcium carbonate, vaterite, monohydrocalcite). Furthermore, the degree of ordering, hydration and particle size of these phases and their crystallisation pathways are largely controlled by their origin and conditions of formation. These include a number of factors like temperature, pH, and concentration of foreign ions in solution (e.g., Mg2+, Sr2+, SO42-, organics, etc.). Over the last few years, new experimental and characterization approaches have been developed, combining classical characterization techniques with synchrotron-based methods that allow in situ and real-time monitoring of the reactions (e.g., time-resolved synchrotron-based scattering and diffraction, pair distribution function). These techniques have provided very useful data to attain the mechanisms and quantify the kinetics of crystallization in abiotic systems. I will present a series of results obtained from synchrotron- and lab-based experiments that shed light on the mechanisms of formation of a number of biominerals (e.g., vaterite, calcite, aragonite, monohydrocalcite, dolomite). These results provide a detailed understanding of how calcium carbonate phases form during biomineralization processes, the effects of seawater ions and organics during the formation and transformation of biominerals, and the implications for past and future ocean chemistry, CO2 capture and storage and industrial mineral synthesis.

  5. Scaling Atomic Partial Charges of Carbonate Solvents for Lithium Ion Solvation and Diffusion

    DOE PAGES

    Chaudhari, Mangesh I.; Nair, Jijeesh R.; Pratt, Lawrence R.; ...

    2016-10-21

    Lithium-ion solvation and diffusion properties in ethylene carbonate (EC) and propylene carbonate (PC) were studied by molecular simulation, experiments, and electronic structure calculations. Studies carried out in water provide a reference for interpretation. Classical molecular dynamics simulation results are compared to ab initio molecular dynamics to assess nonpolarizable force field parameters for solvation structure of the carbonate solvents. Quasi-chemical theory (QCT) was adapted to take advantage of fourfold occupancy of the near-neighbor solvation structure observed in simulations and used to calculate solvation free energies. The computed free energy for transfer of Li+ to PC from water, based on electronic structuremore » calculations with cluster-QCT, agrees with the experimental value. The simulation-based direct-QCT results with scaled partial charges agree with the electronic structure-based QCT values. The computed Li+/PF6- transference numbers of 0.35/0.65 (EC) and 0.31/0.69 (PC) agree well with NMR experimental values of 0.31/0.69 (EC) and 0.34/0.66 (PC) and similar values obtained here with impedance spectroscopy. These combined results demonstrate that solvent partial charges can be scaled in systems dominated by strong electrostatic interactions to achieve trends in ion solvation and transport properties that are comparable to ab initio and experimental results. Thus, the results support the use of scaled partial charges in simple, nonpolarizable force fields in future studies of these electrolyte solutions.« less

  6. Scaling Atomic Partial Charges of Carbonate Solvents for Lithium Ion Solvation and Diffusion

    SciTech Connect

    Chaudhari, Mangesh I.; Nair, Jijeesh R.; Pratt, Lawrence R.; Soto, Fernando A.; Balbuena, Perla B.; Rempe, Susan B.

    2016-10-21

    Lithium-ion solvation and diffusion properties in ethylene carbonate (EC) and propylene carbonate (PC) were studied by molecular simulation, experiments, and electronic structure calculations. Studies carried out in water provide a reference for interpretation. Classical molecular dynamics simulation results are compared to ab initio molecular dynamics to assess nonpolarizable force field parameters for solvation structure of the carbonate solvents. Quasi-chemical theory (QCT) was adapted to take advantage of fourfold occupancy of the near-neighbor solvation structure observed in simulations and used to calculate solvation free energies. The computed free energy for transfer of Li+ to PC from water, based on electronic structure calculations with cluster-QCT, agrees with the experimental value. The simulation-based direct-QCT results with scaled partial charges agree with the electronic structure-based QCT values. The computed Li+/PF6- transference numbers of 0.35/0.65 (EC) and 0.31/0.69 (PC) agree well with NMR experimental values of 0.31/0.69 (EC) and 0.34/0.66 (PC) and similar values obtained here with impedance spectroscopy. These combined results demonstrate that solvent partial charges can be scaled in systems dominated by strong electrostatic interactions to achieve trends in ion solvation and transport properties that are comparable to ab initio and experimental results. Thus, the results support the use of scaled partial charges in simple, nonpolarizable force fields in future studies of these electrolyte solutions.

  7. T-shaped ionic liquid crystals based on the imidazolium motif: exploring substitution of the C-2 imidazolium carbon atom.

    PubMed

    Goossens, Karel; Wellens, Sil; Van Hecke, Kristof; Van Meervelt, Luc; Cardinaels, Thomas; Binnemans, Koen

    2011-04-04

    In this contribution the first examples of so-called rigid-core, T-shaped imidazolium ionic liquid crystals, in which the C-2 atom of the imidazolium ring is substituted with an aryl moiety decorated with one or two alkoxy chains, are described. The length of the alkoxy chain(s) was varied from six to eighteen carbon atoms (n=6, 10, 14-18). Whereas the compounds with one long alkoxy chain display only smectic A phases, the salts containing two alkoxy chains exhibit smectic A, multicontinuous cubic, as well as hexagonal columnar phases, as evidenced by polarising optical microscopy, differential scanning calorimetry, and powder X-ray diffraction. Structural models are proposed for the self-assembly of the molecules within the mesophases. The imidazolium head groups and the iodide counterions were found to adopt a peculiar orientation in the central part of the columns of the hexagonal columnar phases. The enantiotropic cubic phase shown by the 1,3-dimethyl-2-[3,4-bis(pentadecyloxy)phenyl]imidazolium iodide salt has a multicontinuous Pm ̄3m structure. To the best of our knowledge, this is the first example of a thermotropic cubic mesophase of this symmetry.

  8. Molybdoenzyme That Catalyzes the Anaerobic Hydroxylation of a Tertiary Carbon Atom in the Side Chain of Cholesterol*

    PubMed Central

    Dermer, Juri; Fuchs, Georg

    2012-01-01

    Cholesterol is a ubiquitous hydrocarbon compound that can serve as substrate for microbial growth. This steroid and related cyclic compounds are recalcitrant due to their low solubility in water, complex ring structure, the presence of quaternary carbon atoms, and the low number of functional groups. Aerobic metabolism therefore makes use of reactive molecular oxygen as co-substrate of oxygenases to hydroxylate and cleave the sterane ring system. Consequently, anaerobic metabolism must substitute oxygenase-catalyzed steps by O2-independent hydroxylases. Here we show that one of the initial reactions of anaerobic cholesterol metabolism in the β-proteobacterium Sterolibacterium denitrificans is catalyzed by an unprecedented enzyme that hydroxylates the tertiary C25 atom of the side chain without molecular oxygen forming a tertiary alcohol. This steroid C25 dehydrogenase belongs to the dimethyl sulfoxide dehydrogenase molybdoenzyme family, the closest relative being ethylbenzene dehydrogenase. It is a heterotrimer, which is probably located at the periplasmic side of the membrane and contains one molybdenum cofactor, five [Fe-S] clusters, and one heme b. The draft genome of the organism contains several genes coding for related enzymes that probably replace oxygenases in steroid metabolism. PMID:22942275

  9. How surface reparation prevents catalytic oxidation of carbon monoxide on atomic gold at defective magnesium oxide surfaces.

    PubMed

    Töpfer, Kai; Tremblay, Jean Christophe

    2016-07-21

    In this contribution, we study using first principles the co-adsorption and catalytic behaviors of CO and O2 on a single gold atom deposited at defective magnesium oxide surfaces. Using cluster models and point charge embedding within a density functional theory framework, we simulate the CO oxidation reaction for Au1 on differently charged oxygen vacancies of MgO(001) to rationalize its experimentally observed lack of catalytic activity. Our results show that: (1) co-adsorption is weakly supported at F(0) and F(2+) defects but not at F(1+) sites, (2) electron redistribution from the F(0) vacancy via the Au1 cluster to the adsorbed molecular oxygen weakens the O2 bond, as required for a sustainable catalytic cycle, (3) a metastable carbonate intermediate can form on defects of the F(0) type, (4) only a small activation barrier exists for the highly favorable dissociation of CO2 from F(0), and (5) the moderate adsorption energy of the gold atom on the F(0) defect cannot prevent insertion of molecular oxygen inside the defect. Due to the lack of protection of the color centers, the surface becomes invariably repaired by the surrounding oxygen and the catalytic cycle is irreversibly broken in the first oxidation step.

  10. 30 CFR 75.1003 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 30 Mineral Resources 1 2011-07-01 2011-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 75.1003 Section 75.1003... Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and...

  11. 30 CFR 77.1802 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 30 Mineral Resources 1 2013-07-01 2013-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 77.1802 Section 77.1802... Wires and Trolley Feeder Wires § 77.1802 Insulation of trolley wires, trolley feeder wires and bare...

  12. 30 CFR 75.1003 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 30 Mineral Resources 1 2014-07-01 2014-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 75.1003 Section 75.1003... Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and...

  13. 30 CFR 77.1802 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 30 Mineral Resources 1 2011-07-01 2011-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 77.1802 Section 77.1802... Wires and Trolley Feeder Wires § 77.1802 Insulation of trolley wires, trolley feeder wires and bare...

  14. 30 CFR 75.1003 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 30 Mineral Resources 1 2013-07-01 2013-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 75.1003 Section 75.1003... Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and...

  15. 30 CFR 75.1003 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 30 Mineral Resources 1 2012-07-01 2012-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 75.1003 Section 75.1003... Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and...

  16. 30 CFR 77.1802 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 30 Mineral Resources 1 2014-07-01 2014-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 77.1802 Section 77.1802... Wires and Trolley Feeder Wires § 77.1802 Insulation of trolley wires, trolley feeder wires and bare...

  17. 30 CFR 77.1802 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 30 Mineral Resources 1 2012-07-01 2012-07-01 false Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 77.1802 Section 77.1802... Wires and Trolley Feeder Wires § 77.1802 Insulation of trolley wires, trolley feeder wires and bare...

  18. 30 CFR 77.1802 - Insulation of trolley wires, trolley feeder wires and bare signal wires; guarding of trolley...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... wires and bare signal wires; guarding of trolley wires and trolley feeder wires. 77.1802 Section 77.1802... Wires and Trolley Feeder Wires § 77.1802 Insulation of trolley wires, trolley feeder wires and bare..., and bare signal wires shall be adequately guarded: (a) At all points where men are required to work or...

  19. In Situ Studies of Solid Electrolyte Interphase (SEI) Formation on Crystalline Carbon Surfaces by Neutron Reflectometry and Atomic Force Microscopy.

    PubMed

    Steinhauer, Miriam; Stich, Michael; Kurniawan, Mario; Seidlhofer, Beatrix-Kamelia; Trapp, Marcus; Bund, Andreas; Wagner, Norbert; Friedrich, K Andreas

    2017-10-05

    The solid electrolyte interphase (SEI) is a complex and fragile passivation layer with crucial importance for the functionality of lithium-ion batteries. Due to its fragility and reactivity, the use of in situ techniques is preferable for the determination of the SEI's true structure and morphology during its formation. In this study, we use in situ neutron reflectometry (NR) and in situ atomic force microscopy (AFM) to investigate the SEI formation on a carbon surface. It was found that a lithium-rich adsorption layer is already present at the open circuit voltage on the carbon sample surface and that the first decomposition products start to deposit close to this potential. During the negative potential sweep, the growth of the SEI can be observed in detail by AFM and NR. This allows precise monitoring of the morphology evolution and the resulting heterogeneities of individual SEI features. NR measurements show a maximum SEI thickness of 192 Å at the lower cutoff potential (0.02 V vs Li/Li(+)), which slightly decreases during the positive potential scan. The scattering length density (SLD) obtained by NR provides additional information on the SEI's chemical nature and structural evolution.

  20. Evaluation of the nanotube intrinsic resistance across the tip-carbon nanotube-metal substrate junction by Atomic Force Microscopy

    PubMed Central

    2011-01-01

    Using an atomic force microscope (AFM) at a controlled contact force, we report the electrical signal response of multi-walled carbon nanotubes (MWCNTs) disposed on a golden thin film. In this investigation, we highlight first the theoretical calculation of the contact resistance between two types of conductive tips (metal-coated and doped diamond-coated), individual MWCNTs and golden substrate. We also propose a circuit analysis model to schematize the «tip-CNT-substrate» junction by means of a series-parallel resistance network. We estimate the contact resistance R of each contribution of the junction such as Rtip-CNT, RCNT-substrate and Rtip-substrate by using the Sharvin resistance model. Our final objective is thus to deduce the CNT intrinsic radial resistance taking into account the calculated electrical resistance values with the global resistance measured experimentally. An unwished electrochemical phenomenon at the tip apex has also been evidenced by performing measurements at different bias voltages with diamond tips. For negative tip-substrate bias, a systematic degradation in color and contrast of the electrical cartography occurs, consisting of an important and non-reversible increase of the measured resistance. This effect is attributed to the oxidation of some amorphous carbon areas scattered over the diamond layer covering the tip. For a direct polarization, the CNT and substrate surface can in turn be modified by an oxidation mechanism. PMID:21711904