Science.gov

Sample records for kev fullerene bombardment

  1. Secondary ion emission from V and Al surfaces under keV light ion on bombardment

    NASA Astrophysics Data System (ADS)

    Blauner, Patricia G.; Weller, Martha R.; Kaurin, Michael G.; Weller, Robert A.

    1986-03-01

    Positive secondary ion mass spectra have been measured for oxidized polycrystalline V and Al targets bombarded by H +, H 2+, He + and Ar + ions with beam energies ranging from 25 keV to 275 keV. An enhancement in the relative yield of positive ions of electronegative surface constituents, in particular O + is observed under light ion bombardment. Metallic ion intensities were found to decrease with increasing primary beam energy in proportion to the estimated total sputtering yields for these targets and beams. In contrast, the O + secondary ion intensities were independent of primary beam energy. This behavior is similar to that observed previously with heavy ions of comparable velocities. In addition, for the projectiles and targets used in these measurements, no energy thresholds or collective effects were observed in the emission of any positive ion. Published data on secondary ion emission resulting from electron, photon, and heavy ion bombardment are compared with these results.

  2. STABILITY OF EXTRATERRESTRIAL GLYCINE UNDER ENERGETIC PARTICLE RADIATION ESTIMATED FROM 2 keV ELECTRON BOMBARDMENT EXPERIMENTS

    SciTech Connect

    Maté, B.; Tanarro, I.; Escribano, R.; Moreno, M. A.; Herrero, V. J.

    2015-06-20

    The destruction of solid glycine under irradiation with 2 keV electrons has been investigated by means of IR spectroscopy. Destruction cross sections, radiolysis yields, and half-life doses were determined for samples at 20, 40, 90, and 300 K. The thickness of the irradiated samples was kept below the estimated penetration depth of the electrons. No significant differences were obtained in the experiments below 90 K, but the destruction cross section at 300 K was larger by a factor of 2. The radiolysis yields and half-life doses are in good accordance with recent MeV proton experiments, which confirms that electrons in the keV range can be used to simulate the effects of cosmic rays if the whole sample is effectively irradiated. In the low temperature experiments, electron irradiation leads to the formation of residues. IR absorptions of these residues are assigned to the presence CO{sub 2}, CO, OCN{sup −}, and CN{sup −} and possibly to amide bands I to III. The protection of glycine by water ice is also studied. A water ice film of ∼150 nm is found to provide efficient shielding against the bombardment of 2 keV electrons. The results of this study show also that current Monte Carlo predictions provide a good global description of electron penetration depths. The lifetimes estimated in this work for various environments ranging from the diffuse interstellar medium to the inner solar system, show that the survival of hypothetical primeval glycine from the solar nebula in present solar system bodies is not very likely.

  3. Stability of Extraterrestrial Glycine under Energetic Particle Radiation Estimated from 2 keV Electron Bombardment Experiments

    NASA Astrophysics Data System (ADS)

    Maté, B.; Tanarro, I.; Escribano, R.; Moreno, M. A.; Herrero, V. J.

    2015-06-01

    The destruction of solid glycine under irradiation with 2 keV electrons has been investigated by means of IR spectroscopy. Destruction cross sections, radiolysis yields, and half-life doses were determined for samples at 20, 40, 90, and 300 K. The thickness of the irradiated samples was kept below the estimated penetration depth of the electrons. No significant differences were obtained in the experiments below 90 K, but the destruction cross section at 300 K was larger by a factor of 2. The radiolysis yields and half-life doses are in good accordance with recent MeV proton experiments, which confirms that electrons in the keV range can be used to simulate the effects of cosmic rays if the whole sample is effectively irradiated. In the low temperature experiments, electron irradiation leads to the formation of residues. IR absorptions of these residues are assigned to the presence CO2, CO, OCN-, and CN- and possibly to amide bands I to III. The protection of glycine by water ice is also studied. A water ice film of ˜150 nm is found to provide efficient shielding against the bombardment of 2 keV electrons. The results of this study show also that current Monte Carlo predictions provide a good global description of electron penetration depths. The lifetimes estimated in this work for various environments ranging from the diffuse interstellar medium to the inner solar system, show that the survival of hypothetical primeval glycine from the solar nebula in present solar system bodies is not very likely.

  4. Steady State Sputtering Yields and Surface Compositions of Depleted Uranium and Uranium Carbide bombarded by 30 keV Gallium or 16 keV Cesium Ions.

    SciTech Connect

    Siekhaus, W. J.; Teslich, N. E.; Weber, P. K.

    2014-10-23

    Depleted uranium that included carbide inclusions was sputtered with 30-keV gallium ions or 16-kev cesium ions to depths much greater than the ions’ range, i.e. using steady-state sputtering. The recession of both the uranium’s and uranium carbide’s surfaces and the ion corresponding fluences were used to determine the steady-state target sputtering yields of both uranium and uranium carbide, i.e. 6.3 atoms of uranium and 2.4 units of uranium carbide eroded per gallium ion, and 9.9 uranium atoms and 3.65 units of uranium carbide eroded by cesium ions. The steady state surface composition resulting from the simultaneous gallium or cesium implantation and sputter-erosion of uranium and uranium carbide were calculated to be U₈₆Ga₁₄, (UC)₇₀Ga₃₀ and U₈₁Cs₉, (UC)₇₉Cs₂₁, respectively.

  5. Spectral reflectance change and luminescence of selected salts during 2-10 KeV proton bombardment - Implications for Io

    NASA Technical Reports Server (NTRS)

    Nelson, R. M.; Nash, D. B.

    1979-01-01

    Radiation damage and luminescence caused by magnetospheric charged particles have been suggested by several investigators as mechanisms that are capable of explaining some of the peculiar spectral/albedo features of Io. In the present paper, this possibility is pursued by measuring the UV-visual spectral reflectance and luminescent efficiency of several proposed Io surface constituents during 2 to 10 keV proton irradiation at room and low temperatures. The luminescence efficiencies of pure samples, studied in the laboratory, suggest that charged-particle induced luminescence from Io's surface might be observable by spacecraft such as Voyager when viewing Io's dark side.

  6. The temperature effect on the glycine decomposition induced by 2 keV electron bombardment in space analog conditions

    NASA Astrophysics Data System (ADS)

    Pilling, Sergio; Nair, Binu G.; Escobar, Antonio; Fraser, Helen; Mason, Nigel

    2014-03-01

    Glycine is the simplest proteinaceous amino acid that has been extensively detected in carbonaceous meteorites and was recently observed in the cometary samples returned to Earth by NASA's Stardust spacecraft. In space, such species is exposed to several radiation fields at different temperatures. In aqueous solutions, this species appears mainly as zwitterionic glycine (+NH3CH2COO-) however, in solid phase, it may be found in amorphous or crystalline forms. Here, we present an experimental study on the destruction of two zwitterionic glycine crystals ( α- and β-form) at two different temperatures (300 K and 14 K) by 2 keV electrons in an attempt to test the behavior and stability of this molecular species in different space environments. The samples were analyzed in situ by Fourier transform infrared spectrometry at electron fluences. The experiments were carried out under ultra-high vacuum conditions at the Molecular Physics Laboratory at the Open University at Milton Keynes, UK. The dissociation cross section of glycine is approximately 5 times higher for the 14 K samples when compared to the 300 K samples. In contrast, no significant differences emerged between the dissociation cross sections of α- and β-forms of glycine for fixed temperature experiments. We therefore conclude that the destruction cross section is more heavily dependent on temperature than the phase of the condensed glycine material. This may be associated with the opening of additional reaction routes in the frozen samples involving the trapped daughter species (e.g. CO2 and CO). The half-life of studied samples extrapolated to space conditions shows that glycine molecules on the surface of interstellar grains has less survivability and they are highly sensitive to ambient radiations, however, they can survive extended period of time in the solar system like environments. Survivability increases by a factor of 5 if the samples are at 300 K when compared to low temperature experiments at 14

  7. Elasticity, internal excitation, and charge transfer during grazing scattering of keV fullerenes from a LiF(1 0 0) surface

    NASA Astrophysics Data System (ADS)

    Wethekam, S.; Winter, H.

    2011-06-01

    C60+ molecular ions with energies of 5-45 keV are scattered under grazing angles of incidence of 1-3° from a LiF(1 0 0) surface. From the analysis of polar angular distributions, fragment size distributions, and ion fractions for scattered projectiles, information on elastic, internal excitation, and charge transfer processes are derived. The results are compared to classical molecular dynamics simulations, which reproduce the angular distributions on a quantitative level, but the internal excitation only in part. In addition to the transfer of the normal energy loss to internal degrees of freedom of the molecule, an excitation is identified and interpreted as resonant coherent excitation in the oscillating electric field in front of the surface experienced by the moving projectile. The ion fractions are in accord with a complete suppression of charge transfer between fullerene ion and surface.

  8. Dose dependence of the production yield of endohedral 133Xe-fullerene by ion implantation

    NASA Astrophysics Data System (ADS)

    Watanabe, S.; Ishioka, N. S.; Shimomura, H.; Muramatsu, H.; Sekine, T.

    2003-05-01

    The production yield of endohedral 133Xe-fullerene by ion implantation has been studied by taking advantage of the radioactivity of 133Xe. Fullerene targets, which were produced by vacuum evaporation of C 60 or C 70 on a Ni backing, were bombarded with 30-38 keV 133Xe ions by using an isotope separator at doses ranging from 1 × 10 12 to 1 × 10 14 cm -2. The production yield of endohedral 133Xe-fullerene was determined by an high performance liquid chromatography analysis following the dissolution of the targets in o-dichlorobenzene. It was found that the production yield decreased with increasing dose and incident energy, and the production yield of 133Xe@C 70 was higher than that of 133Xe@C 60 for the same dose and incident energy. Those production yields are discussed in connection with amorphization of fullerene molecules in collisions with 133Xe ions.

  9. Single impacts of keV fullerene ions on free standing graphene: Emission of ions and electrons from confined volume

    SciTech Connect

    Verkhoturov, Stanislav V.; Geng, Sheng; Schweikert, Emile A.; Czerwinski, Bartlomiej; Young, Amanda E.; Delcorte, Arnaud

    2015-10-28

    We present the first data from individual C{sub 60} impacting one to four layer graphene at 25 and 50 keV. Negative secondary ions and electrons emitted in transmission were recorded separately from each impact. The yields for C{sub n}{sup −} clusters are above 10% for n ≤ 4, they oscillate with electron affinities and decrease exponentially with n. The result can be explained with the aid of MD simulation as a post-collision process where sufficient vibrational energy is accumulated around the rim of the impact hole for sputtering of carbon clusters. The ionization probability can be estimated by comparing experimental yields of C{sub n}{sup −} with those of C{sub n}{sup 0} from MD simulation, where it increases exponentially with n. The ionization probability can be approximated with ejecta from a thermally excited (3700 K) rim damped by cluster fragmentation and electron detachment. The experimental electron probability distributions are Poisson-like. On average, three electrons of thermal energies are emitted per impact. The thermal excitation model invoked for C{sub n}{sup −} emission can also explain the emission of electrons. The interaction of C{sub 60} with graphene is fundamentally different from impacts on 3D targets. A key characteristic is the high degree of ionization of the ejecta.

  10. Single impacts of keV fullerene ions on free standing graphene: Emission of ions and electrons from confined volume.

    PubMed

    Verkhoturov, Stanislav V; Geng, Sheng; Czerwinski, Bartlomiej; Young, Amanda E; Delcorte, Arnaud; Schweikert, Emile A

    2015-10-28

    We present the first data from individual C60 impacting one to four layer graphene at 25 and 50 keV. Negative secondary ions and electrons emitted in transmission were recorded separately from each impact. The yields for C(n)(-) clusters are above 10% for n ≤ 4, they oscillate with electron affinities and decrease exponentially with n. The result can be explained with the aid of MD simulation as a post-collision process where sufficient vibrational energy is accumulated around the rim of the impact hole for sputtering of carbon clusters. The ionization probability can be estimated by comparing experimental yields of C(n)(-) with those of C(n)(0) from MD simulation, where it increases exponentially with n. The ionization probability can be approximated with ejecta from a thermally excited (3700 K) rim damped by cluster fragmentation and electron detachment. The experimental electron probability distributions are Poisson-like. On average, three electrons of thermal energies are emitted per impact. The thermal excitation model invoked for C(n)(-) emission can also explain the emission of electrons. The interaction of C60 with graphene is fundamentally different from impacts on 3D targets. A key characteristic is the high degree of ionization of the ejecta. PMID:26520508

  11. Single impacts of keV fullerene ions on free standing graphene: Emission of ions and electrons from confined volume

    NASA Astrophysics Data System (ADS)

    Verkhoturov, Stanislav V.; Geng, Sheng; Czerwinski, Bartlomiej; Young, Amanda E.; Delcorte, Arnaud; Schweikert, Emile A.

    2015-10-01

    We present the first data from individual C60 impacting one to four layer graphene at 25 and 50 keV. Negative secondary ions and electrons emitted in transmission were recorded separately from each impact. The yields for Cn- clusters are above 10% for n ≤ 4, they oscillate with electron affinities and decrease exponentially with n. The result can be explained with the aid of MD simulation as a post-collision process where sufficient vibrational energy is accumulated around the rim of the impact hole for sputtering of carbon clusters. The ionization probability can be estimated by comparing experimental yields of Cn- with those of Cn0 from MD simulation, where it increases exponentially with n. The ionization probability can be approximated with ejecta from a thermally excited (3700 K) rim damped by cluster fragmentation and electron detachment. The experimental electron probability distributions are Poisson-like. On average, three electrons of thermal energies are emitted per impact. The thermal excitation model invoked for Cn- emission can also explain the emission of electrons. The interaction of C60 with graphene is fundamentally different from impacts on 3D targets. A key characteristic is the high degree of ionization of the ejecta.

  12. Fullerenes and disk-fullerenes

    NASA Astrophysics Data System (ADS)

    Deza, M.; Dutour Sikirić, M.; Shtogrin, M. I.

    2013-08-01

    A geometric fullerene, or simply a fullerene, is the surface of a simple closed convex 3-dimensional polyhedron with only 5- and 6-gonal faces. Fullerenes are geometric models for chemical fullerenes, which form an important class of organic molecules. These molecules have been studied intensively in chemistry, physics, crystallography, and so on, and their study has led to the appearance of a vast literature on fullerenes in mathematical chemistry and combinatorial and applied geometry. In particular, several generalizations of the notion of a fullerene have been given, aiming at various applications. Here a new generalization of this notion is proposed: an n-disk-fullerene. It is obtained from the surface of a closed convex 3-dimensional polyhedron which has one n-gonal face and all other faces 5- and 6-gonal, by removing the n-gonal face. Only 5- and 6-disk-fullerenes correspond to geometric fullerenes. The notion of a geometric fullerene is therefore generalized from spheres to compact simply connected two-dimensional manifolds with boundary. A two-dimensional surface is said to be unshrinkable if it does not contain belts, that is, simple cycles consisting of 6-gons each of which has two neighbours adjacent at a pair of opposite edges. Shrinkability of fullerenes and n-disk-fullerenes is investigated. Bibliography: 87 titles.

  13. The Fullerenes

    NASA Astrophysics Data System (ADS)

    Kroto, H. W.; Walton, D. R. M.

    1993-09-01

    1. The evolution of the football structure for the C60 molecule: a retrospective E. Osawa; 2. Dreams in a charcoal fire: predictions about giant fullerenes and graphite nanotubes D. E. H. Jones; 3. On the formation of the fullerenes R. F. Curl; 4. Production and discovery of fullerites: new forms of crystalline carbon W. Kratschmer and D. R. Huffman; 5. Systematics of fullerenes and related clusters P. W. Fowler; 6. The fullerenes: powerful carbon-based electron acceptors R. C. Haddon; 7. The carbon-bearing material in the outflows from luminous carbon-rich stars M. Jura; 8. Elemental carbon as interstellar dust C. T. Pillinger; 9. The pattern of additions to fullerenes R. Taylor; 10. Polyynes and the formation of fullerenes H. W. Kroto and D. R. M. Walton; 11. Hypothetical graphite structures with negative gaussian curvature A. L. Mackay and H. Terrones; 12. Fullerenes as an example of basic research in industry E. Wasserman; 13. Deltahedral views of fullerene polymorphism D. L. D. Caspar; 14. Geodesic domes and fullerenes.

  14. Fullerene Machines

    NASA Technical Reports Server (NTRS)

    Globus, Al; Saini, Subhash

    1998-01-01

    Recent computational efforts at NASA Ames Research Center and computation and experiment elsewhere suggest that a nanotechnology of machine phase functionalized fullerenes may be synthetically accessible and of great interest. We have computationally demonstrated that molecular gears fashioned from (14,0) single-walled carbon nanotubes and benzyne teeth should operate well at 50-100 gigahertz. Preliminary results suggest that these gears can be cooled by a helium atmosphere and a laser motor can power fullerene gears if a positive and negative charge have been added to form a dipole. In addition, we have unproven concepts based on experimental and computational evidence for support structures, computer control, a system architecture, a variety of components, and manufacture. Combining fullerene machines with the remarkable mechanical properties of carbon nanotubes, there is some reason to believe that a focused effort to develop fullerene nanotechnology could yield materials with tremendous properties.

  15. Fullerene materials

    SciTech Connect

    Malhotra, R.; Ruoff, R.S.; Lorents, D.C.

    1995-04-01

    Fullerenes are all-carbon cage molecules. The most celebrated fullerene is the soccer-ball shaped C{sub 60}, which is composed of twenty hexagons and twelve pentagons. Because its structure is reminiscent of the geodesic domes of architect R. Buckminster Fuller, C{sub 60} is called buckminsterfullerene, and all the materials in the family are designated fullerenes. Huffman and Kraetschmer`s discovery unleashed activity around the world as scientists explored production methods, properties, and potential uses of fullerenes. Within a short period, methods for their production in electric arcs, plasmas, and flames were discovered, and several companies began selling fullerenes to the research market. What is remarkable is that in all these methods, carbon atoms assemble themselves into cage structures. The capability for self-assembly points to some inherent stability of these structures that allows their formation. The unusual structure naturally leads to unusual properties. Among them are ready solubility in solvents and a relatively high vapor pressure for a pure carbon material. The young fullerene field has already produced a surprising array of structures for the development of carbon-base materials having completely new and different properties from any that were previously possible.

  16. Ion bombardment of Europa

    NASA Astrophysics Data System (ADS)

    Cassidy, Timothy A.; Paranicas, C.; Hendrix, A.; Johnson, R. E.

    2010-10-01

    The spectral difference between Europa's leading and trailing hemispheres has long been explained as a result of magnetospheric bombardment. A closer look at the longitudinal variation of ultraviolet spectral features reveals, however, that several processes, both exogenic and endogenic, are operating on the surface (Hendrix et al., 2010, submitted; Dalton et al., 2010, in preparation). Even magnetospheric bombardment can produce a variety of exogenic patterns; each "population” of particles has a distinct bombardment pattern. Work is ongoing to connect exogenic and spectral patterns. Here we describe one piece of that ongoing work, the calculation of ion bombardment and sputtering rates. We calculated the ion bombardment rate using a program that traces ion motion given the magnetic and electric fields in the vicinity of Europa's orbit, along with information on ion composition and energies from the Voyager and Galileo missions. We conclude that the vast majority of sulfur ions impact Europa's trailing hemisphere, while the sputtering rate is more uniform, in qualitative agreement with previous work. Overall, we find that the sputtering rate at the trailing hemisphere apex (where ion flux peaks) is about 3 times that at the leading hemisphere apex. This likely results in a net erosion of Europa's entire surface, not, as some have suggested, a net deposition of ice onto the leading hemisphere. We also conclude that the energetic ion flux peaks at Europa's poles, though the sputtering rate still peaks at the equatorial trailing hemisphere apex, where the combined sputtering by "cold” and "suprathermal” ions is highest.

  17. Illusory Late Heavy Bombardments.

    PubMed

    Boehnke, Patrick; Harrison, T Mark

    2016-09-27

    The Late Heavy Bombardment (LHB), a hypothesized impact spike at ∼3.9 Ga, is one of the major scientific concepts to emerge from Apollo-era lunar exploration. A significant portion of the evidence for the existence of the LHB comes from histograms of (40)Ar/(39)Ar "plateau" ages (i.e., regions selected on the basis of apparent isochroneity). However, due to lunar magmatism and overprinting from subsequent impact events, virtually all Apollo-era samples show evidence for (40)Ar/(39)Ar age spectrum disturbances, leaving open the possibility that partial (40)Ar* resetting could bias interpretation of bombardment histories due to plateaus yielding misleadingly young ages. We examine this possibility through a physical model of (40)Ar* diffusion in Apollo samples and test the uniqueness of the impact histories obtained by inverting plateau age histograms. Our results show that plateau histograms tend to yield age peaks, even in those cases where the input impact curve did not contain such a spike, in part due to the episodic nature of lunar crust or parent body formation. Restated, monotonically declining impact histories yield apparent age peaks that could be misinterpreted as LHB-type events. We further conclude that the assignment of apparent (40)Ar/(39)Ar plateau ages bears an undesirably high degree of subjectivity. When compounded by inappropriate interpretations of histograms constructed from plateau ages, interpretation of apparent, but illusory, impact spikes is likely. PMID:27621460

  18. Illusory Late Heavy Bombardments.

    PubMed

    Boehnke, Patrick; Harrison, T Mark

    2016-09-27

    The Late Heavy Bombardment (LHB), a hypothesized impact spike at ∼3.9 Ga, is one of the major scientific concepts to emerge from Apollo-era lunar exploration. A significant portion of the evidence for the existence of the LHB comes from histograms of (40)Ar/(39)Ar "plateau" ages (i.e., regions selected on the basis of apparent isochroneity). However, due to lunar magmatism and overprinting from subsequent impact events, virtually all Apollo-era samples show evidence for (40)Ar/(39)Ar age spectrum disturbances, leaving open the possibility that partial (40)Ar* resetting could bias interpretation of bombardment histories due to plateaus yielding misleadingly young ages. We examine this possibility through a physical model of (40)Ar* diffusion in Apollo samples and test the uniqueness of the impact histories obtained by inverting plateau age histograms. Our results show that plateau histograms tend to yield age peaks, even in those cases where the input impact curve did not contain such a spike, in part due to the episodic nature of lunar crust or parent body formation. Restated, monotonically declining impact histories yield apparent age peaks that could be misinterpreted as LHB-type events. We further conclude that the assignment of apparent (40)Ar/(39)Ar plateau ages bears an undesirably high degree of subjectivity. When compounded by inappropriate interpretations of histograms constructed from plateau ages, interpretation of apparent, but illusory, impact spikes is likely.

  19. Fast Atom Bombardment Mass Spectrometry.

    ERIC Educational Resources Information Center

    Rinehart, Kenneth L., Jr.

    1982-01-01

    Discusses reactions and characteristics of fast atom bombardment (FAB) mass spectroscopy in which samples are ionized in a condensed state by bombardment with xenon or argon atoms, yielding positive/negative secondary ions. Includes applications of FAB to structural problems and considers future developments using the technique. (Author/JN)

  20. Induction of antioxidant enzyme activity and lipid peroxidation level in ion-beam-bombarded rice seeds

    NASA Astrophysics Data System (ADS)

    Semsang, Nuananong; Yu, LiangDeng

    2013-07-01

    Low-energy ion beam bombardment has been used to mutate a wide variety of plant species. To explore the indirect effects of low-energy ion beam on biological damage due to the free radical production in plant cells, the increase in antioxidant enzyme activities and lipid peroxidation level was investigated in ion-bombarded rice seeds. Local rice seeds were bombarded with nitrogen or argon ion beams at energies of 29-60 keV and ion fluences of 1 × 1016 ions cm-2. The activities of the antioxidant enzymes; superoxide dismutase (SOD), catalase (CAT), ascorbate peroxidase (APX), dehydroascorbate reductase (DHAR), glutathione reductase (GR), glutathione S-transferase (GST) and lipid peroxidation level were assayed in the germinated rice seeds after ion bombardment. The results showed most of the enzyme activities and lipid peroxidation levels in both the argon and nitrogen bombarded samples were higher than those in the natural control. N-ion bombardment could induce higher levels of antioxidant enzyme activities in the rice samples than the Ar-ion bombardment. Additional effects due to the vacuum condition were found to affect activities of some antioxidant enzymes and lipid peroxidation level. This study demonstrates that ion beam bombardment and vacuum condition could induce the antioxidant enzyme activity and lipid peroxidation level which might be due to free radical production in the bombarded rice seeds.

  1. Conversion of fullerenes to diamond

    DOEpatents

    Gruen, Dieter M.

    1994-01-01

    A method of forming synthetic diamond on a substrate. The method involves providing a substrate surface covered with a fullerene or diamond coating, positioning a fullerene in an ionization source, creating a fullerene vapor, ionizing fullerene molecules, accelerating the fullerene ions to energies above 250 eV to form a fullerene ion beam, impinging the fullerene ion beam on the substrate surface and continuing these steps to obtain a diamond film thickness on the substrate.

  2. Conversion of fullerenes to diamond

    DOEpatents

    Gruen, Dieter M.

    1993-01-01

    A method of forming synthetic diamond on a substrate is disclosed. The method involves providing a substrate surface covered with a fullerene or diamond coating, positioning a fullerene in an ionization source, creating a fullerene vapor, ionizing fullerene molecules, accelerating the fullerene ions to energies above 250 eV to form a fullerene ion beam, impinging the fullerene ion beam on the substrate surface and continuing these steps to obtain a diamond thickness on the substrate.

  3. Fullerene Nanogears

    NASA Technical Reports Server (NTRS)

    1997-01-01

    The Numerical Aerospace Simulation Systems Division (NAS) of the NASA Ames Research Center, Moffett Field, California is conducting research into molecular-sized devices known as Nanotechnology. This photograph depicts two 'Fullerene Nano-gears' with multiple teeth. The hope is that one day, products can be constructed made of thousands of tiny machines that could self-repair and adapt to the environment in which they exist. Researchers have simulated attaching benzyne molecules to the outside of a nanotube to form gear teeth. Nanotubes are molecular-sized pipes made of carbon atoms. To 'drive' the gears, the supercomputer simulated a laser that served as a motor. The laser creates an electric field around the nanotube. A positively charged atom is placed on one side of the nanotube, and a negatively charged atom on the other side. The electric field drags the nanotube around like a shaft turning. Jie Han, Al Globus, Richard Jaffe and Glenn Deardorff are the authors of a technical paper detailing this technology which appears in The Journal of Nanotechnology.

  4. Fullerenes in Allende Meteorite

    NASA Technical Reports Server (NTRS)

    Becker, L.; Bada, J. L.; Winans, R. E.; Bunch, T. E.

    1994-01-01

    The detection of fullerenes in deposits from meteor impacts has led to renewed interest in the possibility that fullerenes are present in meteorites. Although fullerenes have not previously been detected in the Murchison and Allende meteorites, the Allende meteorite is known to contain several well-ordered graphite particles which are remarkably similar in size and appearance to the fullerene-related structures carbon onions and nanotubes. We report that fullerenes are in fact present in trace amounts in the Allende meteorite. In addition to fullerenes, we detected many polycyclic aromatic hydrocarbons (PAHs) in the Allende meteorite, consistent with previous reports. In particular, we detected benzofluoranthene and corannulene (C20H10), five-membered ring structures which have been proposed as precursors to the formation of fullerene synthesis, perhaps within circumstellar envelopes or other sites in the interstellar medium.

  5. Combustion method for producing fullerenes

    DOEpatents

    Howard, J.B.; McKinnon, J.T.

    1993-12-28

    A method for synthesizing fullerenes in flames is provided. Fullerenes are prepared by burning carbon-containing compounds in a flame and collecting the condensable. The condensable contain the desired fullerenes. Fullerene yields can be optimized and fullerene composition can be selectively varied. Fullerene yields and compositions are determined by selectively controlling flame conditions and parameters such as C/O ratio, pressure, temperature, residence time, diluent concentration and gas velocity. 4 figures.

  6. Combustion method for producing fullerenes

    DOEpatents

    Howard, Jack B.; McKinnon, J. Thomas

    1993-01-01

    A method for synthesizing fullerenes in flames is provided. Fullerenes are prepared by burning carbon-containing compounds in a flame and collecting the condensibles. The condensibles contain the desired fullerenes. Fullerene yields can be optimized and fullerene composition can be selectively varied. Fullerene yields and compositions are determined by selectively controlling flame conditions and parameters such as C/O ratio, pressure, temperature, residence time, diluent concentration and gas velocity.

  7. Information Entropy of Fullerenes.

    PubMed

    Sabirov, Denis Sh; Ōsawa, Eiji

    2015-08-24

    The reasons for the formation of the highly symmetric C60 molecule under nonequilibrium conditions are widely discussed as it dominates over numerous similar fullerene structures. In such conditions, evolution of structure rather than energy defines the processes. We have first studied the diversity of fullerenes in terms of information entropy. Sorting 2079 structures from An Atlas of Fullerenes [ Fowler , P. W. ; Manolopoulos , D. E. An Atlas of Fullerenes ; Oxford : Clarendon , 1995 . ], we have found that the information entropies of only 14 fullerenes (<1% of the studied structures) lie between the values of C60 and C70, the two most abundant fullerenes. Interestingly, buckminsterfullerene is the only fullerene with zero information entropy, i.e., an exclusive compound among the other members of the fullerene family. Such an efficient sorting demonstrates possible relevance of information entropy to chemical processes. For this reason, we have introduced an algorithm for calculating changes in information entropy at chemical transformations. The preliminary calculations of changes in information entropy at the selected fullerene reactions show good agreement with thermochemical data.

  8. Internal energy of molecules ejected due to energetic C60 bombardment

    PubMed Central

    Garrison, Barbara J.; Postawa, Zbigniew; Ryan, Kathleen E.; Vickerman, John C.; Webb, Roger P.; Winograd, Nicholas

    2009-01-01

    The early stages of C60 bombardment of octane and octatetraene crystals are modeled using molecular dynamics simulations with incident energies of 5-20 keV. Using the AIREBO potential, which allows for chemical reactions in hydrocarbon molecules, we are able to investigate how the projectile energy is partitioned into changes in potential and kinetic energy as well as how much energy flows into reacted molecules and internal energy. Several animations have been included to illustrate the bombardment process. The results show that the material near the edge of the crater can be ejected with low internal energies and that ejected molecules maintain their internal energies in the plume, in contrast to a collisional cooling mechanism previously proposed. In addition, a single C60 bombardment was able to create many free and reacted H atoms which may aid in the ionization of molecules upon subsequent bombardment events. PMID:19228010

  9. Medicinal applications of fullerenes

    PubMed Central

    Bakry, Rania; Vallant, Rainer M; Najam-ul-Haq, Muhammad; Rainer, Matthias; Szabo, Zoltan; Huck, Christian W; Bonn, Günther K

    2007-01-01

    Fullerenes have attracted considerable attention in different fields of science since their discovery in 1985. Investigations of physical, chemical and biological properties of fullerenes have yielded promising information. It is inferred that size, hydrophobicity, three-dimensionality and electronic configurations make them an appealing subject in medicinal chemistry. Their unique carbon cage structure coupled with immense scope for derivatization make them a potential therapeutic agent. The study of biological applications has attracted increasing attention despite the low solubility of carbon spheres in physiological media. The fullerene family, and especially C60, has appealing photo, electrochemical and physical properties, which can be exploited in various medical fields. Fullerene is able to fit inside the hydrophobic cavity of HIV proteases, inhibiting the access of substrates to the catalytic site of enzyme. It can be used as radical scavenger and antioxidant. At the same time, if exposed to light, fullerene can produce singlet oxygen in high quantum yields. This action, together with direct electron transfer from excited state of fullerene and DNA bases, can be used to cleave DNA. In addition, fullerenes have been used as a carrier for gene and drug delivery systems. Also they are used for serum protein profiling as MELDI material for biomarker discovery. In this review we report the aspects of medicinal applications of fullerenes. PMID:18203430

  10. Medicinal applications of fullerenes.

    PubMed

    Bakry, Rania; Vallant, Rainer M; Najam-ul-Haq, Muhammad; Rainer, Matthias; Szabo, Zoltan; Huck, Christian W; Bonn, Günther K

    2007-01-01

    Fullerenes have attracted considerable attention in different fields of science since their discovery in 1985. Investigations of physical, chemical and biological properties of fullerenes have yielded promising information. It is inferred that size, hydrophobicity, three-dimensionality and electronic configurations make them an appealing subject in medicinal chemistry. Their unique carbon cage structure coupled with immense scope for derivatization make them a potential therapeutic agent. The study of biological applications has attracted increasing attention despite the low solubility of carbon spheres in physiological media. The fullerene family, and especially C60, has appealing photo, electrochemical and physical properties, which can be exploited in various medical fields. Fullerene is able to fit inside the hydrophobic cavity of HIV proteases, inhibiting the access of substrates to the catalytic site of enzyme. It can be used as radical scavenger and antioxidant. At the same time, if exposed to light, fullerene can produce singlet oxygen in high quantum yields. This action, together with direct electron transfer from excited state of fullerene and DNA bases, can be used to cleave DNA. In addition, fullerenes have been used as a carrier for gene and drug delivery systems. Also they are used for serum protein profiling as MELDI material for biomarker discovery. In this review we report the aspects of medicinal applications of fullerenes.

  11. Hydrogen diffusion in steels under electron bombardment

    NASA Astrophysics Data System (ADS)

    Larionov, V. V.; Nikitenkov, N. N.; Tyurin, Yu. I.

    2016-05-01

    We report on the results of measurement of the coefficients of hydrogen diffusion through metal membranes in the course of their simultaneous hydrogen saturation and bombardment with electrons (energy 30 keV, current density from 3 to 30 µA/cm2) both in a broad and in a narrow beam. It is found that the time of hydrogen discharge from the membrane is determined by the parameters of the electron beam, its periodicity and duration, and also depends on the structure of the phase state of the metal membrane. It is shown that the diffusion coefficient increases when a narrow electron beam in the scanning regime is used. Analysis of the hydrogen yield as a function of time is carried out on a mass spectrometer connected to a vacuum chamber containing an electron gun, a beam sweep oscillator, and an electrolytic cell. The hydrogen diffusion coefficients under the action of a scanning electron beam are 15 times larger than under the same conditions without irradiation.

  12. Ion bombardment in RF photoguns

    SciTech Connect

    Pozdeyev,E.; Kayran, D.; Litvinenko, V. N.

    2009-05-04

    A linac-ring eRHIC design requires a high-intensity CW source of polarized electrons. An SRF gun is viable option that can deliver the required beam. Numerical simulations presented elsewhere have shown that ion bombardment can occur in an RF gun, possibly limiting lifetime of a NEA GaAs cathode. In this paper, we analytically solve the equations of motion of ions in an RF gun using the ponderomotive potential of the Rf field. We apply the method to the BNL 1/2-cell SRF photogun and demonstrate that a significant portion of ions produced in the gun can reach the cathode if no special precautions are taken. Also, the paper discusses possible mitigation techniques that can reduce the rate of ion bombardment.

  13. Cereal transformation through particle bombardment

    NASA Technical Reports Server (NTRS)

    Casas, A. M.; Kononowicz, A. K.; Bressan, R. A.; Hasegawa, P. M.; Mitchell, C. A. (Principal Investigator)

    1995-01-01

    The review focuses on experiments that lead to stable transformation in cereals using microprojectile bombardment. The discussion of biological factors that affect transformation examines target tissues and vector systems for gene transfer. The vector systems include reporter genes, selectable markers, genes of agronomic interest, and vector constructions. Other topics include physical parameters that affect DNA delivery, selection of stably transformed cells and plant regeneration, and analysis of gene expression and transmission to the progeny.

  14. Characterizing the Early Impact Bombardment

    NASA Technical Reports Server (NTRS)

    Bogard, Donald D.

    2005-01-01

    The early bombardment revealed in the larger impact craters and basins on the moon was a major planetary process that affected all bodies in the inner solar system, including the Earth and Mars. Understanding the nature and timing of this bombardment is a fundamental planetary problem. The surface density of lunar impact craters within a given size range on a given lunar surface is a measure of the age of that surface relative to other lunar surfaces. When crater densities are combined with absolute radiometric ages determined on lunar rocks returned to Earth, the flux of large lunar impactors through time can be estimated. These studies suggest that the flux of impactors producing craters greater than 1 km in diameter has been approximately constant over the past approx. 3 Gyr. However, prior to 3.0 - 3.5 Gyr the impactor flux was much larger and defines an early bombardment period. Unfortunately, no lunar surface feature older than approx. 4 Gyr is accurately dated, and the surface density of craters are saturated in most of the lunar highlands. This means that such data cannot define the impactor flux between lunar formation and approx. 4 Gyr ago.

  15. Process for fullerene functionalization

    DOEpatents

    Cahill, Paul A.; Henderson, Craig C.

    1995-01-01

    Di-addended and tetra-addended Buckminster fullerenes are synthesized through the use of novel organoborane intermediates. The C.sub.60, C.sub.70, or higher fullerene is reacted with a borane such as BH.sub.3 in a solvent such as toluene to form an organoborane intermediate. Reaction of the organoborane such as hydrolysis with water or alcohol results in the product di-addended and tetra-addended fullerene in up to 30% yields. Dihydrofullerenes and tetrahydrofullerenes are produced by the process of the invention.

  16. Process for fullerene functionalization

    DOEpatents

    Cahill, P.A.; Henderson, C.C.

    1995-12-12

    Di-addended and tetra-addended Buckminster fullerenes are synthesized through the use of novel organoborane intermediates. The C{sub 60}, C{sub 70}, or higher fullerene is reacted with a borane such as BH{sub 3} in a solvent such as toluene to form an organoborane intermediate. Reaction of the organoborane such as hydrolysis with water or alcohol results in the product di-addended and tetra-addended fullerene in up to 30% yields. Dihydrofullerenes and tetrahydrofullerenes are produced by the process of the invention. 7 figs.

  17. Metal ion bombardment of onion skin cell wall

    NASA Astrophysics Data System (ADS)

    Sangyuenyongpipat, S.; Vilaithong, T.; Yu, L. D.; Verdaguer, A.; Ratera, I.; Ogletree, D. F.; Monteiro, O. R.; Brown, I. G.

    2005-01-01

    Ion bombardment of living cellular material is a novel subfield of ion beam surface modification that is receiving growing attention from the ion beam and biological communities. Although it has been demonstrated that the technique is sound, in that an adequate fraction of the living cells can survive both the vacuum environment and energetic ion bombardment, there remains much uncertainty about the process details. Here we report on our observations of onion skin cells that were subjected to ion implantation, and propose some possible physical models that tend to support the experimental results. The ion beams used were metallic (Mg, Ti, Fe, Ni, Cu), mean ion energy was typically 30 keV, and the implantation fluence was in the range 1014-1016 ions/cm2. The cells were viewed using Atomic Force Microscopy, revealing the formation of microcrater-like structures due to ion bombardment. The implantation depth profile was measured with Rutherford backscattering spectrometry and compared to the results of the TRIM, T-DYN and PROFILE computer codes.

  18. Metal ion bombardment of onion skin cell wall

    SciTech Connect

    Sangyuenyongpipat, S.; Vilaithong, T.; Yu, L.D.; Verdaguer, A.; Ratera, I.; Ogletree, D.F.; Monteiro, O.R.; Brown, I.G.

    2004-05-10

    Ion bombardment of living cellular material is a novel subfield of ion beam surface modification that is receiving growing attention from the ion beam and biological communities. Although it has been demonstrated that the technique is sound, in that an adequate fraction of the living cells can survive both the vacuum environment and energetic ion bombardment, there remains much uncertainty about the process details. Here we report on our observations of onion skin cells that were subjected to ion implantation, and propose some possible physical models that tend to support the experimental results. The ion beams used were metallic (Mg, Ti, Fe, Ni, Cu), mean ion energy was typically 30keV, and the implantation fluence was in the range 1014 1016 ions/cm2. The cells were viewed using Atomic Force Microscopy, revealing the formation of microcrater-like structures due to ion bombardment. The implantation depth profile was measured with Rutherford backscattering spectrometry and compared to the results of the TRIM, T-DYN and PROFILE computer codes.

  19. Combustion energy of fullerene soot

    SciTech Connect

    Man, Naoki; Nagano, Yatsuhisa; Kiyobayashi, Tetsu; Sakiyama, Minoru )

    1995-02-23

    The standard energy of combustion of fullerene soot generated in arc discharge was determined to be [minus]36.0 [+-] 0.5 kJ g[sup [minus]1] by oxygen-bomb combustion calorimetry. The value was much closer to those of C[sub 60] and C[sub 70] than that of graphite. This result provides an energetic reason for the remarkable yield of fullerenes in arc discharge and supports the mechanism of fullerene formation, where fullerenes are the lowest energy products. Fullerene onion formation is interpreted in terms of energy relaxation of the fullerene soot. 20 refs., 1 tab.

  20. Conversion of fullerenes to diamond

    DOEpatents

    Gruen, Dieter M.

    1994-01-01

    A method of forming synthetic hydrogen defect free diamond or diamond like films on a substrate. The method involves providing vapor containing fullerene molecules with or without an inert gas, providing a device to impart energy to the fullerene molecules, fragmenting at least in part some of the fullerene molecules in the vapor or energizing the molecules to incipient fragmentation, ionizing the fullerene molecules, impinging ionized fullerene molecules on the substrate to assist in causing fullerene fragmentation to obtain a thickness of diamond on the substrate.

  1. Conversion of fullerenes to diamonds

    DOEpatents

    Gruen, Dieter M.

    1995-01-01

    A method of forming synthetic diamond or diamond-like films on a substrate surface. The method involves the steps of providing a vapor selected from the group of fullerene molecules or an inert gas/fullerene molecule mixture, providing energy to the fullerene molecules consisting of carbon-carbon bonds, the energized fullerene molecules breaking down to form fragments of fullerene molecules including C.sub.2 molecules and depositing the energized fullerene molecules with C.sub.2 fragments onto the substrate with farther fragmentation occurring and forming a thickness of diamond or diamond-like films on the substrate surface.

  2. Fullerenes formation in flames

    NASA Technical Reports Server (NTRS)

    Howard, Jack B.

    1993-01-01

    Fullerenes are composed of carbon atoms arranged in approximately spherical or ellipsoidal cages resembling the geodesic domes designed by Buckminster Fuller, after whom the molecules were named. The approximately spherical fullerene, which resembles a soccer ball and contains sixty atoms (C60), is called buckminsterfullerene. The fullerene containing seventy carbon atoms (C70) is approximately ellipsoidal, similar to a rugby ball. Fullerenes were first detected in 1985, in carbon vapor produced by laser evaporation of graphite. The closed shell structure, which has no edge atoms vulnerable to reaction, was proposed to explain the observed high stability of certain carbon clusters relative to that of others at high temperatures and in the presence of an oxidizing gas.

  3. Combustion synthesis of fullerenes

    SciTech Connect

    Mckinnon, J.T.; Bell, W.L. ); Barkley, R.M. )

    1992-01-01

    This paper reports the isolation of C{sub 60} and C{sub 70} from combustion soot that is produced in high-temperature, low-pressure premixed flat flames. A critical parameter for high fullerene yields in combustion appears to be a very high flame temperature. Equilibrium calculations indicate that low pressures are important, but the experimental evidence is not clear at this time. Combustion synthesis yields fullerenes with a C{sub 70}/C{sub 60} ratio of about 40%, as compared with the 12% reported for electric-arc-generated fullerenes. The overall yields from carbon are very low (ca. 0.03%) but the soot studied had been produced in flames that were in no way optimized for fullerene production.

  4. Extraterrestrial Helium Trapped in Fullerenes in the Sudbury Impact Structure

    NASA Technical Reports Server (NTRS)

    Becker, Luann; Poreda, Robert J.; Bada, Jeffrey L.

    1996-01-01

    Fullerenes (C60 and C70) in the Sudbury impact structure contain trapped helium with a He-3/He-4 ratio of 5.5 x 10(exp -4) to 5.9 x 10(exp -4). The He-3/He-4 ratio exceeds the accepted solar wind value by 20 to 30 percent and is higher by an order of magnitude than the maximum reported mantle value. Terrestrial nuclear reactions or cosmic-ray bombardment are not sufficient to generate such a high ratio. The He-3/He-4 ratios in the Sudbury fullerenes are similar to those found in meteorites and in some interplanetary dust particles. The implication is that the helium within the C60 molecules at Sudbury is of extraterrestrial origin.

  5. Fullerene Derivatives for Medical Applications

    NASA Astrophysics Data System (ADS)

    Hirsch, Andreas

    2005-09-01

    Water-soluble fullerene derivatives have a potential for a variety of medical applications. This is due to the unique structural-, electronic and chemical properties of the fullerene core. The biological properties of suitably functionalized fullerenes range from enzyme inhibition/receptor binding, anticancer and antiviral activity, cell signalling, DNA- and genomic applications, photodynamic activation and most importantly antioxidant properties. This review focusses on the anti-HIV and antioxidant properties of a couple of water soluble fullerene derivatives.

  6. Unique Crystallization of Fullerenes: Fullerene Flowers.

    PubMed

    Kim, Jungah; Park, Chibeom; Song, Intek; Lee, Minkyung; Kim, Hyungki; Choi, Hee Cheul

    2016-01-01

    Solution-phase crystallization of fullerene molecules strongly depends on the types of solvent and their ratios because solvent molecules are easily included in the crystal lattice and distort its structure. The C70 (solute)-mesitylene (solvent) system yields crystals with various morphologies and structures, such as cubes, tubes, and imperfect rods. Herein, using C60 and C70 dissolved in mesitylene, we present a novel way to grow unique flower-shaped crystals with six symmetric petals. The different solubility of C60 and C70 in mesitylene promotes nucleation of C70 with sixfold symmetry in the early stage, which is followed by co-crystallization of both C60 and C70 molecules, leading to lateral petal growth. Based on the growth mechanism, we obtained more complex fullerene crystals, such as multi-deck flowers and tube-flower complexes, by changing the sequence and parameters of crystallization. PMID:27561446

  7. Unique Crystallization of Fullerenes: Fullerene Flowers.

    PubMed

    Kim, Jungah; Park, Chibeom; Song, Intek; Lee, Minkyung; Kim, Hyungki; Choi, Hee Cheul

    2016-08-26

    Solution-phase crystallization of fullerene molecules strongly depends on the types of solvent and their ratios because solvent molecules are easily included in the crystal lattice and distort its structure. The C70 (solute)-mesitylene (solvent) system yields crystals with various morphologies and structures, such as cubes, tubes, and imperfect rods. Herein, using C60 and C70 dissolved in mesitylene, we present a novel way to grow unique flower-shaped crystals with six symmetric petals. The different solubility of C60 and C70 in mesitylene promotes nucleation of C70 with sixfold symmetry in the early stage, which is followed by co-crystallization of both C60 and C70 molecules, leading to lateral petal growth. Based on the growth mechanism, we obtained more complex fullerene crystals, such as multi-deck flowers and tube-flower complexes, by changing the sequence and parameters of crystallization.

  8. Unique Crystallization of Fullerenes: Fullerene Flowers

    NASA Astrophysics Data System (ADS)

    Kim, Jungah; Park, Chibeom; Song, Intek; Lee, Minkyung; Kim, Hyungki; Choi, Hee Cheul

    2016-08-01

    Solution-phase crystallization of fullerene molecules strongly depends on the types of solvent and their ratios because solvent molecules are easily included in the crystal lattice and distort its structure. The C70 (solute)–mesitylene (solvent) system yields crystals with various morphologies and structures, such as cubes, tubes, and imperfect rods. Herein, using C60 and C70 dissolved in mesitylene, we present a novel way to grow unique flower-shaped crystals with six symmetric petals. The different solubility of C60 and C70 in mesitylene promotes nucleation of C70 with sixfold symmetry in the early stage, which is followed by co-crystallization of both C60 and C70 molecules, leading to lateral petal growth. Based on the growth mechanism, we obtained more complex fullerene crystals, such as multi-deck flowers and tube-flower complexes, by changing the sequence and parameters of crystallization.

  9. Unique Crystallization of Fullerenes: Fullerene Flowers

    PubMed Central

    Kim, Jungah; Park, Chibeom; Song, Intek; Lee, Minkyung; Kim, Hyungki; Choi, Hee Cheul

    2016-01-01

    Solution-phase crystallization of fullerene molecules strongly depends on the types of solvent and their ratios because solvent molecules are easily included in the crystal lattice and distort its structure. The C70 (solute)–mesitylene (solvent) system yields crystals with various morphologies and structures, such as cubes, tubes, and imperfect rods. Herein, using C60 and C70 dissolved in mesitylene, we present a novel way to grow unique flower-shaped crystals with six symmetric petals. The different solubility of C60 and C70 in mesitylene promotes nucleation of C70 with sixfold symmetry in the early stage, which is followed by co-crystallization of both C60 and C70 molecules, leading to lateral petal growth. Based on the growth mechanism, we obtained more complex fullerene crystals, such as multi-deck flowers and tube-flower complexes, by changing the sequence and parameters of crystallization. PMID:27561446

  10. Fullerene formation and annealing

    SciTech Connect

    Mintmire, J.W.

    1996-04-05

    Why does the highly symmetric carbon cluster C{sub 60} form in such profusion under the right conditions? This question was first asked in 1985, when Kroto suggested that the predominance of the C{sub 60} carbon clusters observed in the molecular beam experiments could be explained by the truncated icosahedral (or soccer ball) form. The name given to this cluster, buckminsterfullerene, led to the use of the term fullerenes for the family of hollow-cage carbon clusters made up of even numbers of triply coordinated carbons arranged with 12 pentagonal rings and an almost arbitrary number of hexagonal rings. More than a decade later, we still lack a completely satisfying understanding of the fundamental chemistry that takes place during fullerene formation. Most current models for fullerene formation require a facile mechanism for ring rearrangement in the fullerene structure, but the simplest proposed mechanisms are believed to have unrealistically high activation barriers. In recent research calculations have suggested that atomic carbon in the reaction mixture could act as a catalyst and allow substantially lower activation barriers for fullerene annealing. This article discusses the background for this research and other adjunct research. 14 refs.

  11. The topology of fullerenes

    PubMed Central

    Schwerdtfeger, Peter; Wirz, Lukas N; Avery, James

    2015-01-01

    Fullerenes are carbon molecules that form polyhedral cages. Their bond structures are exactly the planar cubic graphs that have only pentagon and hexagon faces. Strikingly, a number of chemical properties of a fullerene can be derived from its graph structure. A rich mathematics of cubic planar graphs and fullerene graphs has grown since they were studied by Goldberg, Coxeter, and others in the early 20th century, and many mathematical properties of fullerenes have found simple and beautiful solutions. Yet many interesting chemical and mathematical problems in the field remain open. In this paper, we present a general overview of recent topological and graph theoretical developments in fullerene research over the past two decades, describing both solved and open problems. WIREs Comput Mol Sci 2015, 5:96–145. doi: 10.1002/wcms.1207 Conflict of interest: The authors have declared no conflicts of interest for this article. For further resources related to this article, please visit the WIREs website. PMID:25678935

  12. Ion Bombardment Experiments Suggesting an Origin for Organic Particles in Pre-Cometary and Cometary Ices

    NASA Technical Reports Server (NTRS)

    Wdowiak, Thomas J.; Robinson, Edward L.; Flickinger, Gregory C.; Boyd, David A.

    1997-01-01

    Simple molecules frozen as mantles of interstellar and circumstellar grains and incorporated into comets are subjected to ion bombardment in the form of cosmic rays, stellar flares, stellar winds, and ions accelerated in stellar wind shocks. The total expected dosage for the variety of situations range from 10 eV/molecule for interplanetary dust subjected to solar flares to 10(exp 6) eV/molecule for material in the T Tauri environment. Utilizing a Van de Graaff accelerator and a target chamber having cryogenic and mass spectrometer capabilities, we have bombarded frozen gases in the temperature range of 10 K to 30 K with 175 keV protons. After irradiation, removal of the ice by sublimation at an elevated temperature in vacuum reveals a fluffy residue. These experiments suggest that processes resulting in the formation of organic particles found in the coma of Comet Halley, "CHON", may have included ion bombardment. Also, the moderate energy (100 keV to 500 keV) shock accelerated ion environment of bipolar outflow of stars in the planetary nebula stage such as the Red Rectangle, could produce complex molecular species which emit the observed unidentified infrared bands at 3.3 micro-m, 6.2 micro-m, 7.7 micro-m, 8.6 micro-m, and 11.3 micro-m.

  13. Combustion Synthesis of Fullerenes and Fullerenic Nanostructures In Microgravity

    NASA Technical Reports Server (NTRS)

    Howard, Jack B.; Brooker, John E. (Technical Monitor)

    2002-01-01

    The objectives of the proposed research were to determine the effects of gravity on fullerenes formation in flames and, based on the observed effects, to develop fundamental understanding of fullerenes formation and to identify engineering principles for fullerenes production. The research method consisted of the operation of laminar diffusion flames under normal- and reduced-gravity conditions, and the collection from the flames and subsequent analysis of condensables including any fullerenes present, using coupled high performance liquid chromatography/mass spectrometry and high resolution transmission electron microscopy. The focus included fullerene molecules C60 and C70 and fullerenic nanostructures including tubes, spherules and other shapes. The normal-gravity experiments were performed at MIT and complementary reduced-gravity experiments were to have been contributed by NASA. The independent variables of interest are gravity, fuel type, fuel/oxygen ratio, pressure, gas velocity at burner, diluent type and concentration. Given the large number of variables and the absence of data on either fullerene formation in diffusion flames or gravitational effects on fullerene formation in diffusion or premixed flames, the first part of the work was exploratory while the later part involved detailed study of the most interesting mechanisms. Samples of condensable material from laminar low pressure benzene/argon/oxygen diffusion flames were collected and analyzed by high-performance liquid chromatography to determine the yields of fullerenes, and by high-resolution transmission electron microscopy (HRTEM) to characterize the fullerenic material, i.e., curved-layer nanostructures, on and within the soot particles. The highest concentration of fullerenes was always detected just above the visible stoichiometric surface of a flame. The percentage of fullerenes in the condensable material increases with decreasing pressure. The overall highest amount of fullerenes was found

  14. Geological occurrence of fullerenes

    SciTech Connect

    Buseck, P.R.; Tsipursky, S.J.; Wang, S. ); Hettich, R. )

    1992-01-01

    Using HRTEM imaging, the authors found C[sub 60] and C[sub 70] fullerenes in shungite, a Precambrian carbon-rich rock from Karelia, Russia. Compositionally, shungite represents coals of the meta-anthracite rank, characterized by low ash and sulfur contents, low volatile yields, and high carbon contents. The shungite occurs within metamorphosed sediments. The overlying rocks consist of gray dolomitized sandstones and poorly sorted silts and clays; the underlying rocks are not exposed. The shungite consists of masses containing up to 99% carbon. Diabase is interstratified with shungite-bearing rocks, and the shungite concentration increases with proximity to the diabase. Their sample comes from inclusions in the diabase. In the HRTEM images the fullerenes appear round (presumably roughly spherical in three dimensions), with white rims and black centers, almost identical to images of synthetic C[sub 60] molecules. Following the HRTEM observations, the fullerene identities were confirmed, first by time-of-flight mass spectrometry and then by more precise laser ablation, laser desorption, and thermal desorption ionization plus Fourier transform (FT) mass spectrometry. These measurements verified that the fullerenes were not generated by the laser ionization event. HRTEM images show that locally they occur in ordered arrays that resemble crystals of synthetic C[sub 60]. FT mass spectra show that the C-13/C-12 isotopic ratios for C[sub 60] and C[sub 70] fall within the normal range of terrestrial isotopic values.

  15. Ion Beam Bombardment of Biological Tissue

    NASA Astrophysics Data System (ADS)

    Sangyuenyongpipat, S.; Yu, L. D.; Vilaithong, T.; Phanchaisri, B.; Anuntalabhochai, S.; Brown, I. G.

    2003-10-01

    While ion implantation has become a well-established technique for the surface modification of inorganic materials, the ion bombardment of cellular tissue has received little research attention. A program in ion beam bioengineering has been initiated at Chiang Mai University, and the ion beam induced transfer of plasmid DNA molecules into bacterial cells (E. coli) has been demonstrated. Subsequent work has been directed toward exploration of ion beam bombardment of plant cells in an effort to understand the possible mechanisms involved in the DNA transfer. In particular, ion beam bombardment of onion cells was carried out and the effects investigated. Among the novel features observed is the formation of "microcraters" - sub-micron surface features that could provide a pathway for the transfer of large molecules into the interior cell region. Here we describe our onion skin ion bombardment investigations.

  16. Autocatalysis during fullerene growth

    SciTech Connect

    Eggen, B.R.; Heggie, M.I.; Jungnickel, G.; Latham, C.D.; Jones, R.; Briddon, P.R.

    1996-04-05

    Total energy calculations with a local spin density functional have been applied to the Stone-Wales transformation in fullerene (C{sub 60}). In the formation of the almost exclusively observed I{sub h} isomer of C{sub 60} with isolated pentagons, the final transformation must be from a C{sub 2v} isomer with two pentagon pairs. It was found that the energy barrier for this rearrangement was substantially reduced in the presence of an extra carbon atom. Such atoms were found to bind loosely, preferentially to regions in which there were paired pentagons. Pentagon rearrangements, which are necessary steps in the growth of fullerenes, may therefore result from autocatalysis by carbon.

  17. NBS-promoted oxidation of fullerene monoradicals leading to regioselective 1,4-difunctional fullerenes.

    PubMed

    Si, Weili; Lu, Shirong; Asao, Naoki; Bao, Ming; Yamamoto, Yoshinori; Jin, Tienan

    2014-12-25

    We have demonstrated that NBS is able to promote the oxidation of fullerene monoradicals to form 1,4-difunctional fullerenes. The singly bonded fullerene dimers were used as fullerene monoradical precursors, which produced various 1,4-fullerenes with a wide range of functional groups in good to high yields with high regioselectivity in terms of cosolvents and nucleophiles.

  18. Residual stress in nano-structured stainless steel (AISI 316L) prompted by Xe+ ion bombardment at different impinging angles

    NASA Astrophysics Data System (ADS)

    Cucatti, S.; Droppa, R.; Figueroa, C. A.; Klaus, M.; Genzel, Ch.; Alvarez, F.

    2016-10-01

    The effect of low energy (<1 keV) xenon (Xe+) ion bombardment on the residual stress of polycrystalline iron alloy (AISI 316L steel) is reported. The results take into account the influence of the ion incident angle maintaining constant all other bombarding parameters (i.e., ion energy and current density, temperature, and doses). The bombarded surface topography shows that ions prompt the formation of nanometric regular patterns on the surface crystalline grains and stressing the structure. The paper focalizes on the study of the surface residual stress state stemming from the ion bombardment studied by means of the "sin2 ψ" and "Universal Plot" methods. The analysis shows the absence of shear stress in the affected material region and the presence of compressive in-plane residual biaxial stress (˜200 MPa) expanding up to ˜1 μm depth for all the studied samples. Samples under oblique bombardment present higher compressive stress values in the direction of the projected ion beam on the bombarded surface. The absolute value of the biaxial surface stress difference (σ11-σ22) increases on ion impinging angles, a phenomenon associated with the momentum transfer by the ions. The highest stress level was measured for ion impinging angles of 45° ( σ 11 = -380 ± 10 MPa and σ 22 = -320 ± 10 MPa). The different stresses obtained in the studied samples do not affect significantly the formation of characteristic surface patterns.

  19. Synthesis and properties of fullerene nanowhiskers and fullerene nanotubes.

    PubMed

    Miyazawa, Kun'ichi

    2009-01-01

    Fine needle-like crystals of C60, "C60 nanowhiskers", were discovered in 2001 in a colloidal solution of PZT ceramics added with C60. Not only the C60 nanowhiskers but also the nanowhiskers composed of C70 and C60 derivatives can be synthesized at room temperature by using the liquid-liquid interfacial precipitation method (LLIP method). Tubular fullerene nanowhiskers, "fullerene nanotubes" composed of C60 and C70 molecules can be synthesized by the LLIP method as well. These fullerene nanofibers are pure carbon semiconductors and have wide potential applications in the fields of electronics, optics, MEMS, catalysts, energy and environment. The fullerene nanofibers are now establishing a new scientific field of nanomaterials for the coming all carbon device age. In this paper, the synthesis and various novel properties of fullerene nanofibers are presented.

  20. Diamond film growth from fullerene precursors

    DOEpatents

    Gruen, Dieter M.; Liu, Shengzhong; Krauss, Alan R.; Pan, Xianzheng

    1997-01-01

    A method and system for manufacturing diamond film. The method involves forming a fullerene vapor, providing a noble gas stream and combining the gas with the fullerene vapor, passing the combined fullerene vapor and noble gas carrier stream into a chamber, forming a plasma in the chamber causing fragmentation of the fullerene and deposition of a diamond film on a substrate.

  1. Erosion and modification of SO2 ice by ion bombardment of the surface of Io

    NASA Technical Reports Server (NTRS)

    Johnson, R. E.; Garrett, J. W.; Boring, J. W.; Barton, L. A.; Brown, W. L.

    1984-01-01

    New measurements on the effect of slow ion bombardment of SO2 ice using Ar(+) in the 15-45 keV range are presented. Total yields for loss of SO2 are given along with the energy spectra of the ejected molecules and molecular fragments and information on the chemical changes induced by the ion bombardment. These data are used to estimate that the direct sputter ejection rate of sulfur into the Jovian plasma is of the order of 10 billion atoms/sq cm/s, that the erosion rate of fresh SO2 deposits due to sputtering is of the order of 0.001 cm/yr, and that a significant and possibly observable column density of SO3 can be produced in an SO2 front only for penetrating ion bombardment. Chemical activity occurs even in rather low-temperature SO2 ice bombardment by ions in the nuclear stopping region, and this activity is likely to increase with increasing temperature.

  2. Geologic constraints on Rhea's bombardment mass

    NASA Astrophysics Data System (ADS)

    Leight, Clarissa; Rivera-Valentin, Edgard G.

    2016-10-01

    The mid-sized moons (MSMs) of Saturn display a peculiar set of properties that indicate the system may have been altered early in its history. The MSMs have a large spread in silicate content and diverse inferred thermal and physical histories that, unlike the Galilean satellites, do not demonstrate a trend with semi-major axis or size, which would indicate orbital evolution was a significant driver of their thermal histories. Rather, these features may indicate a significant role for impact-induced thermal and physical evolution. Geophysical properties along with measured crater counts can be used to constrain the bombardment history of the MSMs. Here we apply a fully three-dimensional Monte Carlo cratering model along with Rhea's measured cratering to provide constraints on the cumulative bombardment mass (Mb) experienced by the moon. The classic Nice model estimates Rhea's cumulative bombardment mass (MNice) to be 8.4x10^19 kg; our preliminary results suggest Rhea experienced a bombardment of 0.05 MNice < Mb < 0.06 MNice. Results agree well with similar constraints from Iapetus and provide further support to the Nice II model, which suggests a reduced bombardment for the outer solar system due to the planetesimals having higher kinetic energies. The inferred Mb and typical impact characteristics suggests Rhea may avoid runaway differentiation.

  3. HEAO 3 upper limits to the expected 1634 KeV line from SS 483

    NASA Technical Reports Server (NTRS)

    Wheaton, W. A.; Ling, J. C.; Mahoney, W. A.; Jacobson, A. S.

    1985-01-01

    A model based on 24 Mg(1369) was developed as the source of the lines in which refractory grains in the jets, containing Mg and 0, are bombarded, by ambient protons in the local ISM. The narrowness of the features results because the recoil Mg nucleus is stopped in the grain before the 1369 keV excited state decays. A consequence of the 24 Mg interpretation is the expected appearance of other emission lines, due to 20 Ne and 20 Na, which are produced by proton bombardment of 24 Mg at the 33 MeV/nucleon energy corresponding to the velocity of the jets. These lines appear at rest energies of 1634 keV and 1636 keV, respectively, and should have essentially the same total flux as that emited at 1369 keV. The HEAO 3 data are examined to search for the 1634 keV (rest) emission. The observation and analysis, the results, and the implications for the understanding of SS 433 are discussed.

  4. In-Situ atomic force microscopic observation of ion beam bombarded plant cell envelopes

    NASA Astrophysics Data System (ADS)

    Sangyuenyongpipat, S.; Yu, L. D.; Brown, I. G.; Seprom, C.; Vilaithong, T.

    2007-04-01

    A program in ion beam bioengineering has been established at Chiang Mai University (CMU), Thailand, and ion beam induced transfer of plasmid DNA molecules into bacterial cells (Escherichia coli) has been demonstrated. However, a good understanding of the fundamental physical processes involved is lacking. In parallel work, onion skin cells have been bombarded with Ar+ ions at energy 25 keV and fluence1-2 × 1015 ions/cm2, revealing the formation of microcrater-like structures on the cell wall that could serve as channels for the transfer of large macromolecules into the cell interior. An in-situ atomic force microscope (AFM) system has been designed and installed in the CMU bio-implantation facility as a tool for the observation of these microcraters during ion beam bombardment. Here we describe some of the features of the in-situ AFM and outline some of the related work.

  5. Mechanisms of pattern formation in grazing-incidence ion bombardment of Pt(111)

    SciTech Connect

    Hansen, Henri; Redinger, Alex; Messlinger, Sebastian; Stoian, Georgiana; Michely, Thomas; Rosandi, Yudi; Urbassek, Herbert M.; Linke, Udo

    2006-06-15

    Ripple patterns forming on Pt(111) due to 5 keV Ar{sup +} grazing-incidence ion bombardment were investigated by scanning tunneling microscopy in a broad temperature range from 100 to 720 K and for ion fluences up to 3x10{sup 20} ions/m{sup 2}. A detailed morphological analysis together with molecular dynamics simulations of single ion impacts allow us to develop atomic scale models for the formation of these patterns. The large difference in step edge versus terrace damage is shown to be crucial for ripple formation under grazing incidence. The importance of distinct diffusion processes--step adatom generation at kinks and adatom lattice gas formation--for temperature dependent transitions in the surface morphology is highlighted. Surprisingly, ion bombardment effects like thermal spike induced adatom production and planar subsurface channeling are important for pattern ordering.

  6. Ion bombardment and disorder in amorphous silicon

    SciTech Connect

    Sidhu, L.S.; Gaspari, F.; Zukotynski, S.

    1997-07-01

    The effect of ion bombardment during growth on the structural and optical properties of amorphous silicon are presented. Two series of films were deposited under electrically grounded and positively biased substrate conditions. The biased samples displayed lower growth rates and increased hydrogen content relative to grounded counterparts. The film structure was examined using Raman spectroscopy. The transverse optic like phonon band position was used as a parameter to characterize network order. Biased samples displayed an increased order of the amorphous network relative to grounded samples. Furthermore, biased samples exhibited a larger optical gap. These results are correlated and attributed to reduced ion bombardment effects.

  7. Fullerene interaction with carbon nanohorns.

    PubMed

    Suarez-Martinez, Irene; Monthioux, Marc; Ewels, Christopher P

    2009-10-01

    The interaction between carbon buckminsterfullerene (C60) and carbon nanohorns (also referred to as nanocones) with different tip angles is investigated theoretically. Attachment of C60 to both the interior and the exterior of the horns are considered. Calculations cover a range of cone angles from flat graphene, through 114 degrees, 84 degrees, 60 degrees, 39 degrees and 20 degrees to fullerene pair interaction. Full DFT/LDA calculations are performed and the influence of dispersion forces are considered independently using a numerical potential. Fullerenes bind weakly to the external nanocone wall with approximately 2.9 angstroms spacing (0.5-0.9 eV binding energy), showing no discernable trend with cone tip angle. Fullerene binding inside cones is significantly stronger (> 3 eV), primarily due to strong dispersion force interactions, with higher (approximately 3.1 angstroms) fullerene-nanohorn spacing. In this case, the binding energy increases with number of pentagons in the tip. In all cases the fullerenes will be freely rotating below liquid nitrogen temperatures. For pristine cones and fullerenes, the fullerenes will experience a driving force towards (away) from the nanohorn tip when inside (outside) the nanohorn.

  8. Postdeposition relaxation of internal stress in sputter-grown thin films caused by ion bombardment

    NASA Astrophysics Data System (ADS)

    Nowak, R.; Yoshida, F.; Morgiel, J.; Major, B.

    1999-01-01

    A hitherto unreported postdeposition method of relaxing ultrahigh internal stresses prevailing in sputter-grown thin films is the subject of the present research. A significant reduction of stress has been confirmed by x-ray diffraction and independent substrate deflection measurements for HfN films treated with Si+ ions of various energies (450 keV, 500 keV, and 1.1 MeV). The particular sequence of the performed experiments has allowed us to deduce the most likely scenario of the resulting stress relaxation. We argue that the observed reduction of internal stress had been caused by structural changes, namely the transport of interstitial defects occurring within the thermal spikes induced by ion bombardment and an increase in vacancy concentration. Simple theoretical considerations proved that the existence of an amorphous silicon interlayer formed right under the HfN film during the bombardment cannot be the cause of the observed stress relaxation. The employed Auger electron spectroscopy, transmission electron microscopy, and x-ray diffraction technique confirmed that the ion bombardment did not seriously affect either the composition, dislocation structure, or texture of nitride films. The relative softening of HfN after ion bombardment was found to be caused by amorphization of the substrate directly under the film. The penetration of incident particles deeper than predicted by a numerical simulation was attributed to a distinct crystallographic texture determined experimentally for HfN films. It was confirmed that modification with Si+ ions does not affect the resistivity of HfN films.

  9. Synthesis and radiation resistance of fullerenes and fullerene derivatives

    NASA Astrophysics Data System (ADS)

    Shilin, V. A.; Lebedev, V. T.; Sedov, V. P.; Szhogina, A. A.

    2016-07-01

    The parameters of an electric-arc facility for the synthesis of fullerenes and endohedral metallofullerenes are optimized. The resistance of C60 and C70 fullerenes and C60(OH)30 and C70(OH)30 fullerenols against neutron irradiation is studied. It is established that the radiation resistance of the fullerenes is higher than that of the fullerenols, but the radiation resistance of the Gd@C2 n endometallofullerenes is lower than that of the corresponding Gd@C2 n (OH)38 fullerenols. The radiation resistance of mixtures of Me@C2 n (OH)38 ( Me = Gd, Tb, Sc, Fe, and Pr) endometallofullerenes with C60(OH)30 is determined. The factors affecting the radiation resistance of the fullerenes and fullerenols are discussed.

  10. Glycofullerenes: Sweet fullerenes vanquish viruses

    NASA Astrophysics Data System (ADS)

    Vidal, Sébastien

    2016-01-01

    Fullerene-based dendritic structures coated with 120 sugars can be made in high yields in a relatively short sequence of reactions. The mannosylated compound is shown to inhibit Ebola infection in cells more efficiently than monofullerene-based glycoclusters.

  11. PVC film behavior under proton bombardment

    NASA Astrophysics Data System (ADS)

    Rickards, J.; Trejo-Luna, R.; Andrade, E.

    1995-04-01

    Thin films of poly(vinyl chloride) (PVC) were bombarded with protons of energies between 0.7 and 3 MeV, and the loss of mass was studied using back- and forward-scattering techniques. The abundances of chlorine, carbon and hydrogen were measured simultaneously during the bombardment. With fluences up to 8 × 10 15 protons/cm 2, the amount of carbon does not change, but chlorine is strongly depleted ( G-value = 3) and hydrogen is reduced to between 70 and 80%. This is consistent with the process of dehydrochlorination. An immediate preference is observed for producing this type of chemical reaction over others, suggesting that excitation energy is deposited in a small region like the monomer unit, and then distributed according to the chemical properties of the region.

  12. Large fullerenes and metallofullerenes: Structure and stability

    SciTech Connect

    Achiba, Y.

    1993-12-31

    Isolation and characterization of large fullerenes up to n=160 is described. The fullerenes were extracted from carbon soot and isolated by a high performance liquid chromatography. Preparative amounts of well-separated large fullerenes were characterized by UV/visible absorption, IR, {sup 13}C NMR in solution, and VUV photoelectron measurements. Isolation and characterization of isomers on some of large fullerenes is also be described. Tentative report on the isolation of metallofullerenes such as LaC82 are presented.

  13. Production Of Fullerenic Soot In Flames

    DOEpatents

    Howard, Jack B.; Vander Sande, John B.; Chowdhury, K. Das

    2000-12-19

    A method for the production of fullerenic nanostructures is described in which unsaturated hydrocarbon fuel and oxygen are combusted in a burner chamber at a sub-atmospheric pressure, thereby establishing a flame. The condensibles of the flame are collected at a post-flame location. The condensibles contain fullerenic nanostructures, such as single and nested nanotubes, single and nested nanoparticles and giant fullerenes. The method of producing fullerenic soot from flames is also described.

  14. Production of fullerenic nanostructures in flames

    DOEpatents

    Howard, Jack B.; Vander Sande, John B.; Chowdhury, K. Das

    1999-01-01

    A method for the production of fullerenic nanostructures is described in which unsaturated hydrocarbon fuel and oxygen are combusted in a burner chamber at a sub-atmospheric pressure, thereby establishing a flame. The condensibles of the flame are collected at a post-flame location. The condensibles contain fullerenic nanostructures, such as single and nested nanotubes, single and nested nanoparticles and giant fullerenes. The method of producing fullerenic soot from flames is also described.

  15. Diamond film growth from fullerene precursors

    DOEpatents

    Gruen, D.M.; Liu, S.; Krauss, A.R.; Pan, X.

    1997-04-15

    A method and system are disclosed for manufacturing diamond film. The method involves forming a fullerene vapor, providing a noble gas stream and combining the gas with the fullerene vapor, passing the combined fullerene vapor and noble gas carrier stream into a chamber, forming a plasma in the chamber causing fragmentation of the fullerene and deposition of a diamond film on a substrate. 10 figs.

  16. Cathode Ion Bombardment in RF Photoguns

    SciTech Connect

    Pozdeyev,E.; Kayran, D.; Litvinenko, V.

    2008-09-01

    In this paper, we use the method of rapid oscillating field to solve the equation of ion motion in an RF gun. We apply the method to the BNL 1/2-cell SRF photogun and demonstrate that a significant portion of ions produced in the gun can reach the cathode if no special precautions are taken. Also, the paper proposes a simple mitigation recipe that can reduce the rate of ion bombardment.

  17. Bond topography and nanostructure of hydrogenated fullerene-like carbon films: A comparative study

    NASA Astrophysics Data System (ADS)

    Wang, Yongfu; Gao, Kaixiong; Shi, Jing; Zhang, Junyan

    2016-09-01

    Fullerene-like nanostructural hydrogenated amorphous carbon (FL-C:H) films were prepared by dc- and pulse- plasma enhanced chemical vapor deposition technique (PECVD). Both the films exhibit relatively stresses (0.63 GPa) in spite of their FL features and nanostructural bonding configurations, especially the pentagonal carbon rings. The creation of pentagonal rings is not fully driven by thermodynamics, but is closely related to compressive stress determined by the ion bombardment at the discharged state of the pulse- and dc- discharged plasmas methods. The dc method leads to FL's basal planes which contain less cross-linkages, and causes amorphous strongly hydrogenated structures.

  18. 30 years of cosmic fullerenes

    NASA Astrophysics Data System (ADS)

    Berné, O.; Montillaud, J.; Mulas, G.; Joblin, C.

    2015-12-01

    In 1985, ``During experiments aimed at understanding the mechanisms by which long-chain carbon molecules are formed in interstellar space and circumstellar shells'', Harry Kroto and his collaborators serendipitously discovered a new form of carbon: fullerenes. The most emblematic fullerene (i.e. C_{60} ``buckminsterfullerene''), contains exactly 60 carbon atoms organized in a cage-like structure similar to a soccer ball. Since their discovery impacted the field of nanotechnologies, Kroto and colleagues received the Nobel prize in 1996. The cage-like structure, common to all fullerene molecules, gives them unique properties, in particular an extraordinary stability. For this reason and since they were discovered in experiments aimed to reproduce conditions in space, fullerenes were sought after by astronomers for over two decades, and it is only recently that they have been firmly identified by spectroscopy, in evolved stars and in the interstellar medium. This identification offered the opportunity to study the molecular physics of fullerenes in the unique physical conditions provided by space, and to make the link with other large carbonaceous molecules thought to be present in space : polycyclic aromatic hydrocarbons.

  19. Electronic structures of endohedral fullerenes

    SciTech Connect

    Jin, Changming; Hettich, R.L.; Puretzky, A.A.; Ying, Z.C.; Haufler, R.E.; Compton, R.N.

    1994-12-31

    Fullerenes with different elements trapped inside the cage have been the subject of active research both experimentally and theoretically ever since the initial discovery of C{sub 60}. La@C{sub n}, were the first endohedral fullerenes produced both in gas phase and in macroscopic quantities. Early electron spin resonance investigation of La@C{sub 82} by R.D. Johnson, et.al indicated that La transfer nearly all of the three valence electrons to the fullerene cage, forming a La{sup 3+}@C{sub 82}{sup 3-} complex. Theoretical calculations also have shown that La transfers its valence electrons to the fullerene cage in molecules of La@C{sub n}. Investigations with ultraviolet photoelectron spectroscopy by L. Wang, et.al. indicated that attaching a potassium atom outside the C{sub 60} cage lowers the electron affinity (EA) while trapping Ca atom inside the C{sub 60} sphere increases the EA compared with parent C{sub 60} molecule. These results indicate that metallofullerenes appear to have substantially lower ionization potentials (IP) and higher EA than empty fullerenes.

  20. Ion bombardment experiments suggesting an origin for organic particles in pre-cometary and cometary ices

    NASA Technical Reports Server (NTRS)

    Wdowiak, Thomas J.; Robinson, Edward L.; Flickinger, Gregory C.; Boyd, David A.

    1989-01-01

    During the Giotto and Vega encounters with Comet Halley both organic particles called CHON and energetic ions were detected. The acceleration of ions to hundreds of keV in the vicinity of the bow shock and near the nucleus may be a demonstration of a situation occurring in the early solar system (perhaps during the T Tauri stage) that led to the formation of organic particles only now released. Utilizing a Van de Graaff accelerator and a target chamber having cryogenic and mass spectrometer capabilities, frozen gases were bombarded at 10 K with 175 keV protons with the result that fluffy solid material remains after sublimation of the ice. Initial experiments were carried out with a gas mixture in parts of 170 carbon monoxide, 170 argon, 25 water, 20 nitrogen, and 15 methane formulated to reflect an interstellar composition in experiments involving the freezing out of the products of a plasma. The plasma experiments resulted in a varnish-like film residue that exhibited luminescence when excited with ultraviolet radiation, while the ion bombardment created particulate material that was not luminescent.

  1. Biological Effects of Low Energy Ar+ Ion Bombardment on Silkworm Eggs: a Novel Animal Model

    NASA Astrophysics Data System (ADS)

    Xu, Jiaping; Wu, Yuejin; Liu, Xuelan; Yuan, Hang; Yu, Zengliang

    2009-06-01

    In this study, we found for the first time that silkworm eggs were able to survive in vacuum for a long period of time. Subsequently, low energy Ar+ ions with different energies and fluences were used to bombard silkworm eggs so as to explore the resulting biological effects. Results showed that (i) the exposure of silkworm eggs to vacuum within 10 min did not cause significant impact on the hatching rates, while the irradiation of silkworm eggs by Ar+ ions of 25 keV or 30 keV with fluences ranging from 2.6×2.6 × 1015 ion/cm2 to 8×2.6 × 1015 ion/cm2 caused a significant impact on the hatching rates, and the hatching rates decreased with the increase in the fluence and energy level; (ii) the irradiation of silkworm eggs by Ar+ ions of 30 keV with a fluence of 8×2.6 × 1015 ion/cm2 or 9×2.6 × 1015 ion/cm2 resulted in a noticeable etching on the egg shell surface which could be observed by a scanning electron microscope; and (iii) the irradiation of silkworm eggs by Ar+ ions of 30 keV with a fluence of 9×2.6 × 1015 ion/cm2 generated several mutant phenotypes which were observed in the 5th instar silkworms and a moth.

  2. Superconductivity in doped fullerenes

    SciTech Connect

    Hebard, A.F. )

    1992-11-01

    While there is not complete agreement on the microscopic mechanism of superconductivity in alkali-metal-doped C[sub 60], further research may well lead to the production of analogous materials that lose resistance at even higher temperatures. Carbon 60 is a fascinating and arrestingly beautiful molecule. With 12 pentagonal and 20 hexagonal faces symmetrically arrayed in a soccer-ball-like structure that belongs to the icosahedral point group, I[sub h], its high symmetry alone invites special attention. The publication in September 1990 of a simple technique for manufacturing and concentrating macroscopic amounts of this new form of carbon announced to the scientific community that enabling technology had arrived. Macroscopic amounts of C[sub 60] (and the higher fullerenes, such as C[sub 70] and C[sub 84]) can now be made with an apparatus as simple as an arc furnace powered with an arc welding supply. Accordingly, chemists, physicists and materials scientists have joined forces in an explosion of effort to explore the properties of this unusual molecular building block. 23 refs., 6 figs.

  3. Fullerene sorting proteins.

    PubMed

    Calvaresi, Matteo; Zerbetto, Francesco

    2011-07-01

    Proteins bind fullerenes. Hydrophobic pockets can accommodate a carbon cage either in full or in part. However, the identification of proteins able to discriminate between different cages is an open issue. Prediction of candidates able to perform this function is desirable and is achieved with an inverse docking procedure that accurately accounts for (i) van der Waals interactions between the cage and the protein surface, (ii) desolvation free energy, (iii) shape complementarity, and (iv) minimization of the number of steric clashes through conformational variations. A set of more than 1000 protein structures is divided into four categories that either select C(60) or C(70) (p-C(60) or p-C(70)) and either accommodate the cages in the same pocket (homosaccic proteins, from σακκoζ meaning pocket) or in different pockets (heterosaccic proteins). In agreement with the experiments, the KcsA Potassium Channel is predicted to have one of the best performances for both cages. Possible ways to exploit the results and efficiently separate the two cages with proteins are also discussed.

  4. Pseudorotation in fullerene anions

    NASA Astrophysics Data System (ADS)

    Dunn, Janette L.; Hands, Ian D.; Bates, Colin A.

    2007-07-01

    Jahn-Teller (JT) problems are often characterised by an adiabatic potential energy surface (APES) containing either a set of isoenergetic wells or a trough of equivalent-energy points, which may be warped by higher-order coupling terms or anisotropic effects. In all three cases, the JT effect will be dynamic. Either tunnelling between the wells or rotation (of a distortion) around the trough will restore the original symmetry of the system. This motion is referred to as pseudorotation. It should be possible to observe a JT system in a distorted geometry if measurements are made on a sufficiently short timescale. In various cubic systems, this timescale has been calculated to be the order of picoseconds. Such timescales are accessible using modern methods of ultrafast spectroscopy. Measurements of pseudorotation rates can lead to important information on the strength and nature of the JT coupling present. We will present analytical calculations that allow the rate of pseudorotation to be determined in terms of the vibronic coupling parameters. We will show how these results can be applied to E ⊗ e systems and then to the more complicated system applicable to C60- anions. This is of particular interest because of the high icosahedral symmetry of fullerene ions and also because of the many potential uses of materials containing these ions. We conclude by outlining experiments that should be capable of measuring pseudorotation in C 60 anions.

  5. Functionalized fullerenes in water: a closer look.

    PubMed

    Snow, Samuel D; Kim, Ki Chul; Moor, Kyle J; Jang, Seung Soon; Kim, Jae-Hong

    2015-02-17

    The excellent photophysical properties of C60 fullerenes have spurred much research on their application to aqueous systems for biological and environmental applications. Spontaneous aggregation of C60 in water and the consequent diminution of photoactivity present a significant challenge to aqueous applications. The mechanisms driving the reduction of photoactivity in fullerene aggregates and the effects of functionalization on these processes, however, are not well understood. Here, we take a closer look at the molecular phenomena of functionalized fullerene interactions in water utilizing simulation and experimental tools. Molecular dynamic simulations were performed to investigate time-evolved molecular interactions in systems containing fullerenes with water, oxygen, and/or neighboring fullerene molecules, complimented by physical and chemical characterizations of the fullerenes pre- and postaggregation. Aggregates with widely different photoactivities exhibit similar fullerene-water interactions as well as surface and aggregation characteristics. Photoactive fullerene aggregates had weaker fullerene-fullerene and fullerene-O2 interactions, suggesting the importance of molecular interactions in the sensitization route.

  6. Ion bombardment in a normal-gate FED

    NASA Astrophysics Data System (ADS)

    Gao, Yingbin; Zhang, Xiaobing; Lei, Wei; Liu, Min; Zhang, Yuning; Engelsen, Daniel den

    2005-04-01

    Due to the electron-gas collision ionization in a FED, positively charged ions bombard the cathode. This can destroy the field emitters and cause instabilities. In this study we have selected a normal-gate sub-cell to calculate the ion bombardment (IB). In the cases of uniform emitting and ring emitting, the process of ion bombardment and cathode damage has been investigated.

  7. Wandering Gas Giants and Lunar Bombardment

    NASA Astrophysics Data System (ADS)

    Taylor, G. J.

    2006-08-01

    There may have been a dramatic event early in the history of the Solar System--the intense bombardment of the inner planets and the Moon by planetesimals during a narrow interval between 3.92 and 3.85 billion years ago, called the late heavy bombardment, but also nicknamed the lunar cataclysm. The evidence for this event comes from Apollo lunar samples and lunar meteorites. While not proven, it makes for an interesting working hypothesis. If correct, what caused it to happen? A group of physicists from the Observatoire de la Côte d'Azur (Nice, France), GEA/OV/Universidade Federal do Rio de Janeiro and Observatorio Nacional/MTC (Rio de Janeiro, Brazil), and the Southwest Research Institute (Boulder, Colorado) conducted a series of studies of the dynamics of the early Solar System. Alessandro Morbidelli, Kleomenis Tsiganis, Rodney Gomes, and Harold Levison simulated the migration of Saturn and Jupiter. When the orbits of these giant planets reached the special condition of Saturn making one trip around the Sun for every two trips by Jupiter (called the 1:2 resonance), violent gravitational shoves made the orbits of Neptune and Uranus unstable, causing them to migrate rapidly and scatter countless planetesimals throughout the Solar System. This dramatic event could have happened in a short interval, anywhere from 200 million years to a billion years after planet formation, causing the lunar cataclysm, which would have affected all the inner planets.

  8. Energetic ion bombarded Fe/Al multilayers

    SciTech Connect

    Al-Busaidy, M.S.; Crapper, M.D.

    2006-05-15

    The utility of ion-assisted deposition is investigated to explore the possibility of counteracting the deficiency of back-reflected current of Ar neutrals in the case of lighter elements such as Al. A range of energetically ion bombarded Fe/Al multilayers sputtered with applied surface bias of 0, -200, or -400 V were deposited onto Si(111) substrates in an argon atmosphere of 4 mTorr using a computer controlled dc magnetron sputtering system. Grazing incidence reflectivity and rocking curve scans by synchrotron x rays of wavelength of 1.38 A were used to investigate the structures of the interfaces produced. Substantial evidence has been gathered to suggest the gradual suppression of interfacial mixing and reduction in interfacial roughness with increases of applied bias. The densification of the Al microstructure was noticeable and may be a consequence of resputtering attributable to the induced ion bombardment. The average interfacial roughnesses were calculated for the 0, -200, and -400 V samples to be 7{+-}0.5, 6{+-}0.5, and 5{+-}0.5 A respectfully demonstrating a 30% improvement in interface quality. Data from rocking curve scans point to improved long-range correlated roughness in energetically deposited samples. The computational code based on the recursive algorithm developed by Parratt [Phys. Rev. 95, 359 (1954)] was successful in the simulation of the specular reflectivity curves.

  9. Callisto: A lunar-like bombardment?

    NASA Technical Reports Server (NTRS)

    Ruzicka, A.

    1984-01-01

    Voyager spacecraft imagery of the Galilean satellites in 1979 revealed Callisto and portions of Ganymede to be densely cratered, but nonetheless deficient in craters larger than 30 km relative to the cratered highlands of the Moon, Mars, and Mercury. This relative deficiency of large craters could have been due to the complete obliteration of large craters through viscous relaxation in the icy surfaces of Ganymede and Callisto at a time when their surfaces were presumably warmer and more mobile or the deficiency could have stemmed from a relative depletion of large impacting bodies in the Jupiter system, compared with the terrestial planets. To test which alternative is correct, and, specifically, to see whether Callisto was subjected to a lunar-like bombardment, two areas on the heavily cratered lunar farside were compared with an area on Callisto. It was concluded that the Moon and Callisto must have bombarded by two different populations and though viscous relaxation could have modified, or even completely obliterated, craters on Callisto's surface, it could not hve been solely responsible for the observed deficiency of large craters on Callisto relative to the moon.

  10. Biomolecular Emission by Swift Heavy Ion Bombardment

    SciTech Connect

    Wakamatsu, Yoshinobu; Yamada, Hideaki; Ninomiya, Satoshi; Matsuo, Jiro; Jones, Brian N.; Webb, Roger; Seki, Toshio; Aoki, Takaaki

    2011-01-07

    Secondary Ion Mass spectrometry (SIMS) has been generally used in the field of material sciences. In recent years, it has also been applied for molecular imaging of biological samples. Nevertheless, molecular ions derived from the large molecules (more than 1 kDa) were detected with very low sensitivity. Plasma desorption mass spectrometry (PDMS) is known as mass spectrometry for large organic molecule. In PDMS, fission fragments bombard samples and the impact induces molecular ionization by electronic excitation. Large organic molecules are detected by using swift heavy ions in SIMS. In this work, 6 MeV Cu{sup 4+} we irradiated angiotensin II, a class of peptides. The intact molecular ions generated by swift heavy ion irradiation were analyzed by time-of-flight (TOF) measurement. The yields are compared with some other probe ions, bismuth or flurane. Swift heavy ion bombardment ionized large organic molecules more effectively than other probes. Therefore, high energy ion can be applied in high resolution molecular imaging.

  11. Inorganic Fullerenes, Onions, and Tubes

    ERIC Educational Resources Information Center

    York, Andrew P. E.

    2004-01-01

    Buckminsterfullerene, which is in the shape of a soccer-ball was first discovered in 1985, has many applications as a good lubricant, or as a new superconductor. The synthesis of these inorganic fullerenes involves a great deal of interdisciplinary research between physicists, material scientists, engineers and chemists from various fields.

  12. Development of Mass Spectrometric Ionization Methods for Fullerenes and Fullerene Derivatives

    EPA Science Inventory

    Currently investigations into the environmental behavior of fullerenes and fullerene derivatives is hampered by the lack of well characterized standards and by the lack of readily available quantitative analytical methods. Reported herein are investigations into the utility of ma...

  13. X-ray diffraction study of stress relaxation in cubic boron nitride films grown with simultaneous medium-energy ion bombardment

    SciTech Connect

    Abendroth, B.; Gago, R.; Eichhorn, F.; Moeller, W.

    2004-12-13

    Relaxation of the intrinsic stress of cubic boron nitride (cBN) thin films has been studied by x-ray diffraction (XRD) using synchrotron light. The stress relaxation has been attained by simultaneous medium-energy ion bombardment (2-10 keV) during magnetron sputter deposition, and was confirmed macroscopically by substrate curvature measurements. In order to investigate the stress-release mechanisms, XRD measurements were performed in in-plane and out-of-plane geometry. The analysis shows a pronounced biaxial state of compressive stress in the cBN films grown without medium-energy ion bombardment. This stress is partially released during the medium-energy ion bombardment. It is suggested that the main path for stress relaxation is the elimination of strain within the cBN grains due to annealing of interstitials.

  14. Synthesis, properties and transformations of fullerene peroxides

    NASA Astrophysics Data System (ADS)

    Bulgakov, R. G.; Galimov, D. I.; Dzhemilev, U. M.

    2014-08-01

    Methods of synthesis, properties and transformations of fullerene peroxides are considered and systematized for the first time. It is shown that the chemistry of fullerene peroxides is a new approach to functionalization of fullerenes, which has been intensively developing since 2002. Methods of synthesis, mechanisms of formation and reactions of C60 and C70 alkyl peroxides with or without epoxide moieties are discussed. Transformations of fullerene peroxides affording a wide range of fullerene derivatives containing, as addends, halogen or sulfur atoms; epoxide, dioxolane, thiirane, crown ether, aziridine and dioxetane rings, as well as hydroxyl, alkoxyl and carbonyl groups, are considered. Special attention is focused on reactions constituting the basis of a new approach — so-called molecular surgery, which enables the synthesis of open-cage fullerene derivatives. It has been demonstrated that such compounds are good candidates for designing photovoltaic cells and carriers of drugs and radionuclides (for radiopharmaceuticals). The bibliography includes 130 references.

  15. Application of fullerenes in nanomedicine: an update.

    PubMed

    Dellinger, Anthony; Zhou, Zhiguo; Connor, James; Madhankumar, A B; Pamujula, Sarala; Sayes, Christie M; Kepley, Christopher L

    2013-07-01

    Fullerenes are carbon spheres presently being pursued globally for a wide range of applications in nanomedicine. These molecules have unique electronic properties that make them attractive candidates for diagnostic, therapeutic and theranostic applications. Herein, the latest research is discussed on developing fullerene-based therapeutics as antioxidants for inflammatory diseases, their potential as antiviral/bacterial agents, utility as a drug delivery device and the promise of endohedral fullerenes as new MRI contrast agents. The recent discovery that certain fullerene derivatives can stabilize immune effector cells to prevent or inhibit the release of proinflammatory mediators makes them potential candidates for several diseases such as asthma, arthritis and multiple sclerosis. Gadolinium-containing endohedral fullerenes are being pursued as diagnostic MRI contrast agents for several diseases. Finally, a new class of fullerene-based theranostics has been developed, which combine therapeutic and diagnostic capabilities to specifically detect and kill cancer cells.

  16. High-resolution spectroscopy of X-rays emitted from electron bombarded surfaces

    NASA Astrophysics Data System (ADS)

    Jabłoński, Ł.; Banaś, D.; Jagodziński, P.; Kubala-Kukuś, A.; Sobota, D.; Pajek, M.

    2015-07-01

    The investigations of a compact 6-crystal Johann/Johansson diffraction X-ray spectrometer, covering a wide range (70 eV-15 keV) of photon energies, applied to observe the X-rays emitted from electron bombarded surfaces are discussed in terms of its focusing properties and achievable energy resolution. In the present study the X-ray spectra of Si-Kα1,2 and Al-Kα1,2 X-ray lines excited by 5 keV electron beam were measured using PET and TAP crystal, respectively, in the "out-of-focus" geometry which will be used to study the electron/ion surface interactions at the electron beam ion source (EBIS) facility. The measured X-ray spectra were interpreted in terms of the performed ray-tracing simulations which demonstrate the key features of the "out-of-focus" geometry. It was demonstrated that in this case the energy resolution in the range 1-3 eV for photon energy 1-2 keV can be achieved with an increased acceptance for the extension of X-ray source, of about 1 mm, which is important feature for practical applications. Additionally, a dependence of the X-ray intensity and energy resolution on slit opening was studied in details. The results are important for investigations of surfaces with electron and ion impact, in particular, for the future high-resolution X-ray spectroscopy experiments at the EBIS facility.

  17. Beyond Bombardment: Subjectivity, Visual Culture, and Art Education

    ERIC Educational Resources Information Center

    Eisenhauer, Jennifer F.

    2006-01-01

    Beginning with an understanding of visual culture as a postmodern discourse, this article argues for more focused attention to how visual culture presents a critical rethinking of subjectivity within art education. Through an analysis of a language of bombardment, a discourse that positions the subject as bombarded by media messages, this article…

  18. Toxicological Effects of Fullerenes on Caenorhabditis elegans

    NASA Astrophysics Data System (ADS)

    Schomaker, Justin; Snook, Renee; Howell, Carina

    2014-03-01

    The nematode species Caenorhabditis elegans is a useful genetic model organism due to its simplicity and the substantial molecular, genetic, and developmental knowledge about the species. In this study, this species was used to test the toxicological effects of C60 fullerene nanoparticles. In previous studies using rats, a solution of C60 fullerenes in olive oil proved to extend the life of the subjects. The purpose of this experiment was to subject C. elegans to varying concentrations of C60 fullerenes and observe their toxicological effects. Initial findings indicate a link between fullerene exposure and enlargement of the vulva as well as the formation of a small nodule at the base of the tail in some individuals. While the fullerenes are not lethally toxic in C. elegans, results will be presented that pertain to changes in life span and progeny of the nematodes exposed to varying concentrations of fullerenes as well as the mechanisms of toxicity. High magnification imaging via SEM and/or AFM will be used to characterize the fullerene nanoparticles. Testing the toxicity of fullerenes in a wide variety of organisms will lead to a more complete understanding of the effects of fullerenes on living organisms to ultimately understand their effects in humans. This work was supported by National Science Foundation grants DUE-1058829, DMR-0923047, DUE-0806660 and Lock Haven FPDC grants.

  19. C(240)-----The most Chemically Inert Fullerene?

    NASA Technical Reports Server (NTRS)

    Haddon, R. C.; Scuseria, G. E.; Smalley, R. E.

    1997-01-01

    The reactivity of the fullerenes is primarily a function of their strain, as measured by the pyramidalization angle or curvature of the conjugated carbon atoms. The development of faceting in the structure of large icosahedral fullerenes leads to a minimum in the value of the maximum fullerene pyramidalization angle that lies in the vicinity of C-240. On this basis it is argued that C-240 will be the most chemically inert fullerene. This observation explains the production of [10,10] single-walled nanotubes because a C-240 hemisphere is required for the nucleation of such tubes.

  20. Extraterrestrial Helium (He@C60) Trapped in Fullerenes in the Sudbury Impact Structure

    NASA Technical Reports Server (NTRS)

    Becker, L.; Bada, J. L.; Poreda, R. J.; Bunch, T. E.

    1997-01-01

    meteorites. Analysis and Results: In order to characterize the noble gas compositions of the Sudbury fullerenes, we undertook a systematic study of acid-resistant residues throughout the C-rich layer (Black member) of the Onaping Formation. Samples were demineralized and extracted using standard techniques. The Onaping extracts were analyzed using several techniques, including UV-Vis adsorption, electro spray mass spectrometry, and laser desorption (linear and reflectron) time-of-flight (TOF) mass spectrometry (LDMS). The Sudbury fullerenes were then separated and purified using HPLC coupled with a photo diode array detector. The HPLC extracts containing the purified fullerenes were loaded into a metal tube furnace within a glove box under a N atmosphere in preparation for noble gas analyses. The 3-He and 4-He content of the fullerene extracts was measured using previously reported standard techniques . Discussion: Fullerenes (C60 and C70) in the Sudbury Impact Structure have been found to contain trapped He with a 3-He/4-He ratio greater than 5 x 10(exp -4). The 3-He/4-He ratio exceeds the accepted solar value by more than 30% and is more than 10x higher than the maximum reported mantle value. Terrestrial nuclear reactions or cosmic-my bombardment are not sufficient to generate such a high ratio. The 3-He/4-He ratios in the Sudbury fullerenes are similar to those determined for interplanetary dust particles. The greater-than-solar ratios of 3-He/4-He in the Sudbury fullerenes may indicate a presolar origin, although alternative mechanisms occurring in the ISM to explain these high ratios (e.g., spallation reactions, selective He implantation, etc.) cannot be entirely ruled out. We are currently attempting to isolate enough fullerene material to measure anomalous Ne (or Kr or Xe) contained within the C60 (e.g., the "pure" 22-Ne component) and thus determine whether the Sudbury fullerenes are indeed presolar in origin.

  1. The quest for inorganic fullerenes

    DOE PAGES

    Pietsch, Susanne; Dollinger, Andreas; Strobel, Christoph H.; Park, Eun Ji; Ganteför, Gerd; Seo, Hyun Ook; Kim, Young Dok; Idrobo, Juan-Carlos; Pennycook, Stephen J.

    2015-10-02

    Experimental results of the search for inorganic fullerenes are presented. Mo nSm - and WnSm - clusters are generated with a pulsed arc cluster ion source equipped with an annealing stage. This is known to enhance fullerene formation in the case of carbon. Analogous to carbon, the mass spectra of the metal chalcogenide clusters produced in this way exhibit a bimodal structure. Moreover, the species in the first maximum at low mass are known to be platelets. The structure of the species in the second maximum is studied by anion photoelectron spectroscopy, scanning transmission electron microscopy, and scanning tunneling microcopy.more » All experimental results indicate a two-dimensional structure of these species and disagree with a three-dimensional fullerene-like geometry. A possible explanation for this preference of two-dimensional structures is the ability of a two-element material to saturate the dangling bonds at the edges of a platelet by excess atoms of one element. A platelet consisting of a single element only cannot do this. Likewise, graphite and boron might be the only materials forming nano-spheres because they are the only single element materials assuming two-dimensional structures.« less

  2. The quest for inorganic fullerenes

    SciTech Connect

    Pietsch, Susanne; Dollinger, Andreas; Strobel, Christoph H.; Park, Eun Ji; Ganteför, Gerd; Seo, Hyun Ook; Kim, Young Dok; Idrobo, Juan-Carlos; Pennycook, Stephen J.

    2015-10-02

    Experimental results of the search for inorganic fullerenes are presented. Mo nSm - and WnSm - clusters are generated with a pulsed arc cluster ion source equipped with an annealing stage. This is known to enhance fullerene formation in the case of carbon. Analogous to carbon, the mass spectra of the metal chalcogenide clusters produced in this way exhibit a bimodal structure. Moreover, the species in the first maximum at low mass are known to be platelets. The structure of the species in the second maximum is studied by anion photoelectron spectroscopy, scanning transmission electron microscopy, and scanning tunneling microcopy. All experimental results indicate a two-dimensional structure of these species and disagree with a three-dimensional fullerene-like geometry. A possible explanation for this preference of two-dimensional structures is the ability of a two-element material to saturate the dangling bonds at the edges of a platelet by excess atoms of one element. A platelet consisting of a single element only cannot do this. Likewise, graphite and boron might be the only materials forming nano-spheres because they are the only single element materials assuming two-dimensional structures.

  3. The quest for inorganic fullerenes

    NASA Astrophysics Data System (ADS)

    Pietsch, Susanne; Dollinger, Andreas; Strobel, Christoph H.; Park, Eun Ji; Ganteför, Gerd; Seo, Hyun Ook; Kim, Young Dok; Idrobo, Juan-Carlos; Pennycook, Stephen J.

    2015-10-01

    Experimental results of the search for inorganic fullerenes are presented. MonSm- and WnSm- clusters are generated with a pulsed arc cluster ion source equipped with an annealing stage. This is known to enhance fullerene formation in the case of carbon. Analogous to carbon, the mass spectra of the metal chalcogenide clusters produced in this way exhibit a bimodal structure. The species in the first maximum at low mass are known to be platelets. Here, the structure of the species in the second maximum is studied by anion photoelectron spectroscopy, scanning transmission electron microscopy, and scanning tunneling microcopy. All experimental results indicate a two-dimensional structure of these species and disagree with a three-dimensional fullerene-like geometry. A possible explanation for this preference of two-dimensional structures is the ability of a two-element material to saturate the dangling bonds at the edges of a platelet by excess atoms of one element. A platelet consisting of a single element only cannot do this. Accordingly, graphite and boron might be the only materials forming nano-spheres because they are the only single element materials assuming two-dimensional structures.

  4. Functionalized Fullerenes in Photodynamic Therapy

    PubMed Central

    Huang, Ying-Ying; Sharma, Sulbha K.; Yin, Rui; Agrawal, Tanupriya; Chiang, Long Y.; Hamblin, Michael R.

    2014-01-01

    Since the discovery of C60 fullerene in 1985, scientists have been searching for biomedical applications of this most fascinating of molecules. The unique photophysical and photochemical properties of C60 suggested that the molecule would function well as a photosensitizer in photodynamic therapy (PDT). PDT uses the combination of non-toxic dyes and harmless visible light to produce reactive oxygen species that kill unwanted cells. However the extreme insolubility and hydrophobicity of pristine C60, mandated that the cage be functionalized with chemical groups that provided water solubility and biological targeting ability. It has been found that cationic quaternary ammonium groups provide both these features, and this review covers work on the use of cationic fullerenes to mediate destruction of cancer cells and pathogenic microorganisms in vitro and describes the treatment of tumors and microbial infections in mouse models. The design, synthesis, and use of simple pyrrolidinium salts, more complex decacationic chains, and light-harvesting antennae that can be attached to C60, C70 and C84 cages are covered. In the case of bacterial wound infections mice can be saved from certain death by fullerene-mediated PDT. PMID:25544837

  5. The quest for inorganic fullerenes

    SciTech Connect

    Pietsch, Susanne; Dollinger, Andreas; Strobel, Christoph H.; Ganteför, Gerd E-mail: ydkim91@skku.edu; Park, Eun Ji; Kim, Young Dok E-mail: ydkim91@skku.edu; Seo, Hyun Ook; Pennycook, Stephen J.

    2015-10-07

    Experimental results of the search for inorganic fullerenes are presented. Mo{sub n}S{sub m}{sup −} and W{sub n}S{sub m}{sup −} clusters are generated with a pulsed arc cluster ion source equipped with an annealing stage. This is known to enhance fullerene formation in the case of carbon. Analogous to carbon, the mass spectra of the metal chalcogenide clusters produced in this way exhibit a bimodal structure. The species in the first maximum at low mass are known to be platelets. Here, the structure of the species in the second maximum is studied by anion photoelectron spectroscopy, scanning transmission electron microscopy, and scanning tunneling microcopy. All experimental results indicate a two-dimensional structure of these species and disagree with a three-dimensional fullerene-like geometry. A possible explanation for this preference of two-dimensional structures is the ability of a two-element material to saturate the dangling bonds at the edges of a platelet by excess atoms of one element. A platelet consisting of a single element only cannot do this. Accordingly, graphite and boron might be the only materials forming nano-spheres because they are the only single element materials assuming two-dimensional structures.

  6. Effective defect diffusion lengths in Ar-ion bombarded 3C-SiC

    DOE PAGES

    Bayu Aji, L. B.; Wallace, J. B.; Shao, L.; Kucheyev, S. O.

    2016-04-14

    Above room temperature, SiC exhibits pronounced processes of diffusion and interaction of radiation-generated point defects. Here, we use the recently developed pulsed ion beam method to measure effective defect diffusion lengths in 3C-SiC bombarded in the temperature range of 25–200 °C with 500 keV Ar ions. Results reveal a diffusion length of ~10 nm, which exhibits a weak temperature dependence, changing from 9 to 13 nm with increasing temperature. Lastly, these results have important implications for understanding and predicting radiation damage in SiC and for the development of radiation-resistant materials via interface-mediated defect reactions.

  7. Stability of EUV multilayer coatings to low energy alpha particles bombardment.

    PubMed

    Nardello, M; Zuppella, Paola; Polito, V; Corso, Alain Jody; Zuccon, Sara; Pelizzo, M G

    2013-11-18

    Future solar missions will investigate the Sun from very close distances and optical components are constantly exposed to low energy ions irradiation. In this work we present the results of a new experiment related to low energy alpha particles bombardments on Mo/Si multilayer optical coatings. Different multilayer samples, with and without a protecting capping layer, have been exposed to low energy alpha particles (4keV), fixing the ions fluency and varying the time of exposure in order to change the total dose accumulated. The experimental parameters have been selected considering the potential application of the coatings to future solar missions. Results show that the physical processes occurred at the uppermost interfaces can strongly damage the structure. PMID:24514344

  8. Effective defect diffusion lengths in Ar-ion bombarded 3C-SiC

    NASA Astrophysics Data System (ADS)

    Bayu Aji, L. B.; Wallace, J. B.; Shao, L.; Kucheyev, S. O.

    2016-05-01

    Above room temperature, SiC exhibits pronounced processes of diffusion and interaction of radiation-generated point defects. Here, we use the recently developed pulsed ion beam method to measure effective defect diffusion lengths in 3C-SiC bombarded in the temperature range of 25–200 °C with 500 keV Ar ions. Results reveal a diffusion length of  ∼10 nm, which exhibits a weak temperature dependence, changing from 9 to 13 nm with increasing temperature. These results have important implications for understanding and predicting radiation damage in SiC and for the development of radiation-resistant materials via interface-mediated defect reactions.

  9. Ultrabroadband terahertz field detection by proton-bombarded InP photoconductive antennas.

    PubMed

    Liu, Tze-An; Tani, Masahiko; Nakajima, Makoto; Hangyo, Masanori; Sakai, Kiyomi; Nakashima, Shin-Ichi; Pan, Ci-Ling

    2004-06-28

    Photoconductive (PC) antennas fabricated on InP bombarded with 180 keV protons of different dosages (InP:H+) all exhibit a useful bandwidth of about 30 THz, comparable to that of the LT-GaAs PC antenna. The peak signal current of the best InP: H+ device (dosage of 10;15 ions/cm;2) is slightly higher than that of the LT-GaAs one, while the signal-to-noise ratio (SNR) of the former is about half of that of the latter due to lower resistivity. This suggests that InP: H+ can be a good substrate for THz PC antennas with proper annealing and/or implantation recipe. PMID:19483812

  10. Theory of Spontaneous Polarization of Endohedral Fullerenes

    NASA Astrophysics Data System (ADS)

    Clougherty, D. P.; Anderson, F. G.

    1998-04-01

    A pseudo-Jahn-Teller model describing central atom distortions is proposed for endohedral fullerenes of the form A@C60 where A is either a rare gas or a metal atom. A critical (dimensionless) coupling gc is found, below which the symmetric configuration is stable and above which inversion symmetry is broken. Vibronic parameters are given for selected endohedral fullerenes.

  11. Production of fullerenes with concentrated solar flux

    NASA Astrophysics Data System (ADS)

    Hale, M. J.; Fields, C.; Lewandowski, A.; Bingham, C.; Pitts, R.

    1994-01-01

    Research at the National Renewable Energy Laboratory (NREL) has demonstrated that fullerenes can be produced using highly concentrated sunlight from a solar furnace. Since they were first synthesized in 1989, fullerenes have been the subject of intense research. They show considerable commercial potential in advanced materials and have potential applications that include semiconductors, superconductors, high-performance metals, and medical technologies. The most common fullerene is C60, which is a molecule with a geometry resembling a soccer ball. Graphite vaporization methods such as pulsed-laser vaporization, resistive heating, and carbon arc have been used to produce fullerenes. None of these, however, seems capable of producing fullerenes economically on a large scale. The use of concentrated sunlight may help avoid the scale-up limitations inherent in more established production processes. Recently, researchers at NREL made fullerenes in NREL's 10 kW high flux solar furnace (HFSF) with a vacuum reaction chamber designed to deliver a solar flux of 1200 W/sq cm to a graphite pellet. Analysis of the resulting carbon soot by mass spectrometry and high pressure liquid chromatography confirmed the existence of fullerenes. This paper presents the method, experimental apparatus, and results of fullerene production research performed with the HFSF.

  12. Fullerenic structures and such structures tethered to carbon materials

    DOEpatents

    Goel, Anish; Howard, Jack B.; Vander Sande, John B.

    2012-10-09

    The fullerenic structures include fullerenes having molecular weights less than that of C.sub.60 with the exception of C.sub.36 and fullerenes having molecular weights greater than C.sub.60. Examples include fullerenes C.sub.50, C.sub.58, C.sub.130, and C.sub.176. Fullerenic structure chemically bonded to a carbon surface is also disclosed along with a method for tethering fullerenes to a carbon material. The method includes adding functionalized fullerene to a liquid suspension containing carbon material, drying the suspension to produce a powder, and heat treating the powder.

  13. Fullerenic structures and such structures tethered to carbon materials

    DOEpatents

    Goel, Anish; Howard, Jack B.; Vander Sande, John B.

    2010-01-05

    The fullerenic structures include fullerenes having molecular weights less than that of C.sub.60 with the exception of C.sub.36 and fullerenes having molecular weights greater than C.sub.60. Examples include fullerenes C.sub.50, C.sub.58, C.sub.130, and C.sub.176. Fullerenic structure chemically bonded to a carbon surface is also disclosed along with a method for tethering fullerenes to a carbon material. The method includes adding functionalized fullerene to a liquid suspension containing carbon material, drying the suspension to produce a powder, and heat treating the powder.

  14. Modification of Polymer Materials by Ion Bombardment: Case Studies

    SciTech Connect

    Bielinski, D. M.; Jagielski, J.; Piatkowska, A.

    2009-03-10

    The paper discusses possibility of application of ion beam bombardment for modification of polymers. Changes to composition, structure and morphology of the surface layer produced by the treatment and their influence on engineering and functional properties of wide range of polymer materials are presented. Special attention has been devoted to modification of tribological properties. Ion bombardment results in significant reduction of friction, which can be explained by increase of hardness and wettability of polymer materials. Hard but thin enough skin does not result in cracking but improves their abrasion resistance. Contrary to conventional chemical treatment ion beam bombardment works even for polymers hardly susceptible to modification like silicone rubber or polyolefines.

  15. Gas storage using fullerene based adsorbents

    NASA Technical Reports Server (NTRS)

    Loutfy, Raouf O. (Inventor); Lu, Xiao-Chun (Inventor); Li, Weijiong (Inventor); Mikhael, Michael G. (Inventor)

    2000-01-01

    This invention is directed to the synthesis of high bulk density high gas absorption capacity adsorbents for gas storage applications. Specifically, this invention is concerned with novel gas absorbents with high gravimetric and volumetric gas adsorption capacities which are made from fullerene-based materials. By pressing fullerene powder into pellet form using a conventional press, then polymerizing it by subjecting the fullerene to high temperature and high inert gas pressure, the resulting fullerene-based materials have high bulk densities and high gas adsorption capacities. By pre-chemical modification or post-polymerization activation processes, the gas adsorption capacities of the fullerene-based adsorbents can be further enhanced. These materials are suitable for low pressure gas storage applications, such as oxygen storage for home oxygen therapy uses or on-board vehicle natural gas storage. They are also suitable for storing gases and vapors such as hydrogen, nitrogen, carbon dioxide, and water vapor.

  16. Fullerene-biomolecule conjugates and their biomedicinal applications.

    PubMed

    Yang, Xinlin; Ebrahimi, Ali; Li, Jie; Cui, Quanjun

    2014-01-01

    Fullerenes are among the strongest antioxidants and are characterized as "radical sponges." The research on biomedicinal applications of fullerenes has achieved significant progress since the landmark publication by Friedman et al in 1993. Fullerene-biomolecule conjugates have become an important area of research during the past 2 decades. By a thorough literature search, we attempt to update the information about the synthesis of different types of fullerene-biomolecule conjugates, including fullerene-containing amino acids and peptides, oligonucleotides, sugars, and esters. Moreover, we also discuss in this review recently reported data on the biological and pharmaceutical utilities of these compounds and some other fullerene derivatives of biomedical importance. While within the fullerene-biomolecule conjugates, in which fullerene may act as both an antioxidant and a carrier, specific targeting biomolecules conjugated to fullerene will undoubtedly strengthen the delivery of functional fullerenes to sites of clinical interest.

  17. Genetic transformation of wheat via particle bombardment.

    PubMed

    Sparks, Caroline A; Jones, Huw D

    2014-01-01

    Since its first invention in the late 1980s the particle gun has evolved from a basic gunpowder driven machine firing tungsten particles to one more refined which uses helium gas as the propellant to launch alternative heavy metal particles such as gold and silver. The simple principle is that DNA-coated microscopic particles (microcarriers) are accelerated at high speed by helium gas within a vacuum and travel at such a velocity as to penetrate target cells. However, the process itself involves a range of parameters which are open to variation: microparticle type and size, gun settings (rupture pressure, target distance, vacuum drawn, etc.), preparation of components (e.g., gold coating), and preparation of plant tissues. Here is presented a method optimized for transformation of wheat immature embryos using the Bio-Rad PDS-1000/He particle gun to deliver gold particles coated with a gene of interest and the selectable marker gene bar at 650 psi rupture pressure. Following bombardment, various tissue culture phases are used to encourage embryogenic callus formation and regeneration of plantlets and subsequent selection using glufosinate ammonium causes suppression of non-transformed tissues, thus assisting the detection of transformed plants. This protocol has been used successfully to generate transgenic plants for a wide range of wheat varieties, both spring and winter bread wheats (T. aestivum L.) and durum wheats (T. turgidum L.).

  18. Production of Endohedral Fullerenes by Ion Implantation

    SciTech Connect

    Diener, M.D.; Alford, J. M.; Mirzadeh, S.

    2007-05-31

    The empty interior cavity of fullerenes has long been touted for containment of radionuclides during in vivo transport, during radioimmunotherapy (RIT) and radioimaging for example. As the chemistry required to open a hole in fullerene is complex and exceedingly unlikely to occur in vivo, and conformational stability of the fullerene cage is absolute, atoms trapped within fullerenes can only be released during extremely energetic events. Encapsulating radionuclides in fullerenes could therefore potentially eliminate undesired toxicity resulting from leakage and catabolism of radionuclides administered with other techniques. At the start of this project however, methods for production of transition metal and p-electron metal endohedral fullerenes were completely unknown, and only one method for production of endohedral radiofullerenes was known. They therefore investigated three different methods for the production of therapeutically useful endohedral metallofullerenes: (1) implantation of ions using the high intensity ion beam at the Oak Ridge National Laboratory (ORNL) Surface Modification and Characterization Research Center (SMAC) and fullerenes as the target; (2) implantation of ions using the recoil energy following alpha decay; and (3) implantation of ions using the recoil energy following neutron capture, using ORNL's High Flux Isotope Reactor (HFIR) as a thermal neutron source. While they were unable to obtain evidence of successful implantation using the ion beam at SMAC, recoil following alpha decay and neutron capture were both found to be economically viable methods for the production of therapeutically useful radiofullerenes. In this report, the procedures for preparing fullerenes containing the isotopes {sup 212}Pb, {sup 212}Bi, {sup 213}Bi, and {sup 177}Lu are described. None of these endohedral fullerenes had ever previously been prepared, and all of these radioisotopes are actively under investigation for RIT. Additionally, the chemistry for

  19. Inhibition of inflammatory arthritis using fullerene nanomaterials.

    PubMed

    Dellinger, Anthony L; Cunin, Pierre; Lee, David; Kung, Andrew L; Brooks, D Bradford; Zhou, Zhiguo; Nigrovic, Peter A; Kepley, Christopher L

    2015-01-01

    Inflammatory arthritis (e.g. rheumatoid arthritis; RA) is a complex disease driven by the interplay of multiple cellular lineages. Fullerene derivatives have previously been shown to have anti-inflammatory capabilities mediated, in part, by their ability to prevent inflammatory mediator release by mast cells (MC). Recognizing that MC can serve as a cellular link between autoantibodies, soluble mediators, and other effector populations in inflammatory arthritis, it was hypothesized that fullerene derivatives might be used to target this inflammatory disease. A panel of fullerene derivatives was tested for their ability to affect the function of human skin-derived MC as well as other lineages implicated in arthritis, synovial fibroblasts and osteoclasts. It is shown that certain fullerene derivatives blocked FcγR- and TNF-α-induced mediator release from MC; TNF-α-induced mediator release from RA synovial fibroblasts; and maturation of human osteoclasts. MC inhibition by fullerene derivatives was mediated through the reduction of mitochondrial membrane potential and FcγR-mediated increases in cellular reactive oxygen species and NF-κB activation. Based on these in vitro data, two fullerene derivatives (ALM and TGA) were selected for in vivo studies using K/BxN serum transfer arthritis in C57BL/6 mice and collagen-induced arthritis (CIA) in DBA/1 mice. Dye-conjugated fullerenes confirmed localization to affected joints in arthritic animals but not in healthy controls. In the K/BxN moldel, fullerenes attenuated arthritis, an effect accompanied by reduced histologic inflammation, cartilage/bone erosion, and serum levels of TNF-α. Fullerenes remained capable of attenuating K/BxN arthritis in mast cell-deficient mice Cre-Master mice, suggesting that lineages beyond the MC represent relevant targets in this system. These studies suggest that fullerene derivatives may hold promise both as an assessment tool and as anti-inflammatory therapy of arthritis.

  20. Inhibition of Inflammatory Arthritis Using Fullerene Nanomaterials

    PubMed Central

    Dellinger, Anthony L.; Cunin, Pierre; Lee, David; Kung, Andrew L.; Brooks, D. Bradford; Zhou, Zhiguo; Nigrovic, Peter A.; Kepley, Christopher L.

    2015-01-01

    Inflammatory arthritis (e.g. rheumatoid arthritis; RA) is a complex disease driven by the interplay of multiple cellular lineages. Fullerene derivatives have previously been shown to have anti-inflammatory capabilities mediated, in part, by their ability to prevent inflammatory mediator release by mast cells (MC). Recognizing that MC can serve as a cellular link between autoantibodies, soluble mediators, and other effector populations in inflammatory arthritis, it was hypothesized that fullerene derivatives might be used to target this inflammatory disease. A panel of fullerene derivatives was tested for their ability to affect the function of human skin-derived MC as well as other lineages implicated in arthritis, synovial fibroblasts and osteoclasts. It is shown that certain fullerene derivatives blocked FcγR- and TNF-α-induced mediator release from MC; TNF-α-induced mediator release from RA synovial fibroblasts; and maturation of human osteoclasts. MC inhibition by fullerene derivatives was mediated through the reduction of mitochondrial membrane potential and FcγR-mediated increases in cellular reactive oxygen species and NF-κB activation. Based on these in vitro data, two fullerene derivatives (ALM and TGA) were selected for in vivo studies using K/BxN serum transfer arthritis in C57BL/6 mice and collagen-induced arthritis (CIA) in DBA/1 mice. Dye-conjugated fullerenes confirmed localization to affected joints in arthritic animals but not in healthy controls. In the K/BxN moldel, fullerenes attenuated arthritis, an effect accompanied by reduced histologic inflammation, cartilage/bone erosion, and serum levels of TNF-α. Fullerenes remained capable of attenuating K/BxN arthritis in mast cell-deficient mice Cre-Master mice, suggesting that lineages beyond the MC represent relevant targets in this system. These studies suggest that fullerene derivatives may hold promise both as an assessment tool and as anti-inflammatory therapy of arthritis. PMID:25879437

  1. Prevention of cathode damage from positive ion bombardment

    NASA Technical Reports Server (NTRS)

    Bennett, W. H.

    1972-01-01

    Mixed alkaline earth oxide compounds deposited into hole at cathode surface center prevent ion back bombardment damage to cathode by reducing oxide layer and by creating metallic diffusion along sides of hole for enhanced electron emission.

  2. Production of Mg and Al Auger electrons by noble gas ion bombardment of Mg and Al surfaces

    NASA Technical Reports Server (NTRS)

    Ferrante, J.; Pepper, S. V.

    1976-01-01

    Relative production efficiencies of Mg and Al Auger electrons by He, Ne, Ar, Kr, and Xe ion bombardment are reported as a function of ion energy for energies not exceeding 3 keV. The experimental apparatus employed consisted of a LEED-Auger system equipped with an ion gun and a four-grid retarding-potential analyzer. It is found that: (1) the shape of the ion-excited Auger signal was independent of the rare gas and quite symmetric; (2) the Al signal was about an order of magnitude smaller than the Mg signal for a given bombarding species and ion-gun voltage; (3) no signal was observed for He(+) bombardment under any of the experimental conditions; (4) signal strengths were independent of temperature and ion dose; (5) the Auger production efficiencies differed by no more than a factor of two among the different gases - except for He(+) - on a given metal; (6) all the signal strengths increased with increasing ion-gun voltage, with no maximum exhibited; and (7) the apparent threshold energy for the Al signal was higher than that for the Mg signal. The differences between the results for the two metals are attributed to the fact that the Al 2p orbital lies deeper in energy and closer to the nucleus than the corresponding Mg orbital.

  3. Machine Phase Fullerene Nanotechnology: 1996

    NASA Technical Reports Server (NTRS)

    Globus, Al; Chancellor, Marisa K. (Technical Monitor)

    1997-01-01

    NASA has used exotic materials for spacecraft and experimental aircraft to good effect for many decades. In spite of many advances, transportation to space still costs about $10,000 per pound. Drexler has proposed a hypothetical nanotechnology based on diamond and investigated the properties of such molecular systems. These studies and others suggest enormous potential for aerospace systems. Unfortunately, methods to realize diamonoid nanotechnology are at best highly speculative. Recent computational efforts at NASA Ames Research Center and computation and experiment elsewhere suggest that a nanotechnology of machine phase functionalized fullerenes may be synthetically relatively accessible and of great aerospace interest. Machine phase materials are (hypothetical) materials consisting entirely or in large part of microscopic machines. In a sense, most living matter fits this definition. To begin investigation of fullerene nanotechnology, we used molecular dynamics to study the properties of carbon nanotube based gears and gear/shaft configurations. Experiments on C60 and quantum calculations suggest that benzyne may react with carbon nanotubes to form gear teeth. Han has computationally demonstrated that molecular gears fashioned from (14,0) single-walled carbon nanotubes and benzyne teeth should operate well at 50-100 gigahertz. Results suggest that rotation can be converted to rotating or linear motion, and linear motion may be converted into rotation. Preliminary results suggest that these mechanical systems can be cooled by a helium atmosphere. Furthermore, Deepak has successfully simulated using helical electric fields generated by a laser to power fullerene gears once a positive and negative charge have been added to form a dipole. Even with mechanical motion, cooling, and power; creating a viable nanotechnology requires support structures, computer control, a system architecture, a variety of components, and some approach to manufacture. Additional

  4. Interstellar fullerene compounds and diffuse interstellar bands

    NASA Astrophysics Data System (ADS)

    Omont, Alain

    2016-05-01

    Recently, the presence of fullerenes in the interstellar medium (ISM) has been confirmed and new findings suggest that these fullerenes may possibly form from polycyclic aromatic hydrocarbons (PAHs) in the ISM. Moreover, the first confirmed identification of two strong diffuse interstellar bands (DIBs) with the fullerene, C60+, connects the long standing suggestion that various fullerenes could be DIB carriers. These new discoveries justify reassessing the overall importance of interstellar fullerene compounds, including fullerenes of various sizes with endohedral or exohedral inclusions and heterofullerenes (EEHFs). The phenomenology of fullerene compounds is complex. In addition to fullerene formation in grain shattering, fullerene formation from fully dehydrogenated PAHs in diffuse interstellar clouds could perhaps transform a significant percentage of the tail of low-mass PAH distribution into fullerenes including EEHFs. But many uncertain processes make it extremely difficult to assess their expected abundance, composition and size distribution, except for the substantial abundance measured for C60+. EEHFs share many properties with pure fullerenes, such as C60, as regards stability, formation/destruction and chemical processes, as well as many basic spectral features. Because DIBs are ubiquitous in all lines of sight in the ISM, we address several questions about the interstellar importance of various EEHFs, especially as possible carriers of diffuse interstellar bands. Specifically, we discuss basic interstellar properties and the likely contributions of fullerenes of various sizes and their charged counterparts such as C60+, and then in turn: 1) metallofullerenes; 2) heterofullerenes; 3) fulleranes; 4) fullerene-PAH compounds; 5) H2@C60. From this reassessment of the literature and from combining it with known DIB line identifications, we conclude that the general landscape of interstellar fullerene compounds is probably much richer than heretofore realized

  5. Metallosupramolecular receptors for fullerene binding and release.

    PubMed

    García-Simón, Cristina; Costas, Miquel; Ribas, Xavi

    2016-01-01

    Fullerene extracts are easily available from fullerene soot, but finding an efficient strategy to obtain them in pure form remains elusive, especially for higher fullerenes (Cx, x > 70). The properties of the latter remain unclear and their potential application to multiple research fields has not been developed mainly due to their purification difficulties. In this Tutorial Review we cover the use of molecular receptors for the separation of fullerenes by means of host-guest interactions. This strategy allows gaining selectivity, no specialized equipment is required and, ideally, recyclable systems can be designed. We focus on the metallosupramolecular receptors using the metal-ligand coordination approach, which offers a controlled and versatile strategy to design fullerene hosts, and the latest strategies to release the fullerene guest will be described. The field is probably in its beginnings but it is rapidly evolving and we are confident that this tutorial review will help researchers to rapidly gain a general overview of the main works and concepts that are leading this promising strategy and that may lead towards a useful methodology to purify fullerenes.

  6. Observation of an all-boron fullerene

    NASA Astrophysics Data System (ADS)

    Zhai, Hua-Jin; Zhao, Ya-Fan; Li, Wei-Li; Chen, Qiang; Bai, Hui; Hu, Han-Shi; Piazza, Zachary A.; Tian, Wen-Juan; Lu, Hai-Gang; Wu, Yan-Bo; Mu, Yue-Wen; Wei, Guang-Feng; Liu, Zhi-Pan; Li, Jun; Li, Si-Dian; Wang, Lai-Sheng

    2014-08-01

    After the discovery of fullerene-C60, it took almost two decades for the possibility of boron-based fullerene structures to be considered. So far, there has been no experimental evidence for these nanostructures, in spite of the progress made in theoretical investigations of their structure and bonding. Here we report the observation, by photoelectron spectroscopy, of an all-boron fullerene-like cage cluster at B40- with an extremely low electron-binding energy. Theoretical calculations show that this arises from a cage structure with a large energy gap, but that a quasi-planar isomer of B40- with two adjacent hexagonal holes is slightly more stable than the fullerene structure. In contrast, for neutral B40 the fullerene-like cage is calculated to be the most stable structure. The surface of the all-boron fullerene, bonded uniformly via delocalized σ and π bonds, is not perfectly smooth and exhibits unusual heptagonal faces, in contrast to C60 fullerene.

  7. Observation of an all-boron fullerene.

    PubMed

    Zhai, Hua-Jin; Zhao, Ya-Fan; Li, Wei-Li; Chen, Qiang; Bai, Hui; Hu, Han-Shi; Piazza, Zachary A; Tian, Wen-Juan; Lu, Hai-Gang; Wu, Yan-Bo; Mu, Yue-Wen; Wei, Guang-Feng; Liu, Zhi-Pan; Li, Jun; Li, Si-Dian; Wang, Lai-Sheng

    2014-08-01

    After the discovery of fullerene-C60, it took almost two decades for the possibility of boron-based fullerene structures to be considered. So far, there has been no experimental evidence for these nanostructures, in spite of the progress made in theoretical investigations of their structure and bonding. Here we report the observation, by photoelectron spectroscopy, of an all-boron fullerene-like cage cluster at B40(-) with an extremely low electron-binding energy. Theoretical calculations show that this arises from a cage structure with a large energy gap, but that a quasi-planar isomer of B40(-) with two adjacent hexagonal holes is slightly more stable than the fullerene structure. In contrast, for neutral B40 the fullerene-like cage is calculated to be the most stable structure. The surface of the all-boron fullerene, bonded uniformly via delocalized σ and π bonds, is not perfectly smooth and exhibits unusual heptagonal faces, in contrast to C60 fullerene.

  8. Material and energy intensity of fullerene production.

    PubMed

    Anctil, Annick; Babbitt, Callie W; Raffaelle, Ryne P; Landi, Brian J

    2011-03-15

    Fullerenes are increasingly being used in medical, environmental, and electronic applications due to their unique structural and electronic properties. However, the energy and environmental impacts associated with their commercial-scale production have not yet been fully investigated. In this work, the life cycle embodied energy of C(60) and C(70) fullerenes has been quantified from cradle-to-gate, including the relative contributions from synthesis, separation, purification, and functionalization processes, representing a more comprehensive scope than used in previous fullerene life cycle studies. Comparison of two prevalent production methods (plasma and pyrolysis) has shown that pyrolysis of 1,4-tetrahydronaphthalene emerges as the method with the lowest embodied energy (12.7 GJ/kg of C(60)). In comparison, plasma methods require a large amount of electricity, resulting in a factor of 7-10× higher embodied energy in the fullerene product. In many practical applications, fullerenes are required at a purity >98% by weight, which necessitates multiple purification steps and increases embodied energy by at least a factor of 5, depending on the desired purity. For applications such as organic solar cells, the purified fullerenes need to be chemically modified to [6,6]-phenyl-C(61)-butyric acid methyl ester (PCBM), thus increasing the embodied energy to 64.7 GJ/kg C(60)-PCBM for the specified pyrolysis, purification, and functionalization conditions. Such synthesis and processing effects are even more significant for the embodied energy of larger fullerenes, such as C(70), which are produced in smaller quantities and are more difficult to purify. Overall, the inventory analysis shows that the embodied energy of all fullerenes are an order of magnitude higher than most bulk chemicals, and, therefore, traditional cutoff rules by weight during life cycle assessment of fullerene-based products should be avoided.

  9. Partial separation of fullerenes by gradient sublimation

    SciTech Connect

    Yeretzian, C.; Wiley, J.B.; Holczer, K.; Su, T.; Nguyen, S.; Kaner, R.B.; Whetten, R.L. )

    1993-09-30

    An experimental technique is investigated to separate/enrich fullerenes of metallofullerenes, exploiting differences in sublimation temperatures without the use of solvents. Fullerenes are sublimed out of the soot and deposited on a quartz rod along a temperature gradient (gradient sublimation). In a position-sensitive experiment the composition of the deposit on the rod is monitored by laser-desorption mass spectrometry. Strongly enriched regions containing specific fullerene molecules (i.e., C[sub 84] or LaC[sub 82]) are observed. Furthermore, C[sub 74], which could not be extracted from the soot by organic solvents, sublimes out of the soot. 26 refs., 6 figs.

  10. Corner states of topological fullerenes

    NASA Astrophysics Data System (ADS)

    Rüegg, Andreas; Coh, Sinisa; Moore, Joel E.

    2013-10-01

    The unusual electronic properties of the quantum spin Hall or Chern insulator become manifest in the form of robust edge states when samples with boundaries are studied. In this work, we ask if and how the topologically nontrivial electronic structure of these two-dimensional systems can be passed on to their zero-dimensional relatives, namely, fullerenes or other closed-cage molecules. To address this question, we study Haldane's honeycomb lattice model on polyhedral nanosurfaces. We find that for sufficiently large surfaces, characteristic corner states appear for parameters for which the planar model displays a quantized Hall effect. In the electronic structure, these corner states show up as in-gap modes which are well separated from the quasicontinuum of states. We discuss the role of finite-size effects and how the coupling between the corner states lifts the degeneracy in a characteristic way determined by the combined Berry phases which leads to an effective magnetic monopole of charge 2 at the center of the nanosurface. Experimental implications for fullerenes in the large spin-orbit regime are also pointed out.

  11. Photoinduced biochemical activity of fullerene carboxylic acid

    SciTech Connect

    Tokuyama, Hidetoshi; Yamago, Shigeru; Nakamura, Eiichi; Shiraki, Takashi; Sugiura, Yukio

    1993-08-25

    Here we report the preparation of a water-miscible fullerene carboxylic acid (2) and its biological activity-cytotoxicity and G-selective DNA cleaving ability. What is truly remarkable is that the biological activity of C{sub 60} was observed only under irradiation with visible light and not in the dark, suggesting that fullerenes may serve as useful photosensitive biochemical probes. We have found, for the first time, that even low-energy visible light is surfficient to induce biological activity in fullerene derivatives. Among the numerous implications of the present findings, the most exciting prospect includes the use of fullerene derivatives for photodynamic therapy. 18 refs., 2 figs., 1 tab.

  12. Nanosystems of Polymerized Fullerenes and Carbon Nanotubes

    NASA Astrophysics Data System (ADS)

    Scharff, Peter; Cui, Shen

    Nanosystems based on polymerized fullerenes and carbon-nanotubes begin to play an important role in the field of nanotechnology. Nanotubes can be used as molecular wires, and can even figure as building elements for molecular electronics. Furthermore nanotubes can be used as amplifiers in composite materials, as a result of their unique mechanical properties. Many other applications, as for example as electron emitters for flat screens, are currently under development. Fullerens are known to be strong electron acceptors, which enables them to support the electron-hole pair separation in polymer based photovoltaic cells. The use of fulleren chains instead of fullerenes could improve the anisotropic electronic conductivity in the contained polymer layer, and therefore enhance their performance.

  13. Fullerenes and fulleranes in circumstellar envelopes

    NASA Astrophysics Data System (ADS)

    Zhang, Yong; Kwok, Sun; Sadjadi, SeyedAbdolreza

    2016-07-01

    Three decades of search have recently led to convincing discoveries of cosmic fullerenes. The presence of C60 and C+ 60 in both circumstellar and interstellar environments suggests that these molecules and their derivatives can be efficiently formed in circumstellar envelopes and survive in harsh conditions. Detailed analysis of the infrared bands from fullerenes and their connections with the local properties can provide valuable information on the physical conditions and chemical processes that occurred in the late stages of stellar evolution. The identification of C+ 60 as the carrier of four diffuse interstellar bands (DIBs) suggests that fullerene- related compounds are abundant in interstellar space and are essential for resolving the DIB mystery. Experiments have revealed a high hydrogenation rate when C60 is exposed to atomic hydrogen, motivating the attempt to search for cosmic fulleranes. In this paper, we present a short review of current knowledge of cosmic fullerenes and fulleranes and briefly discuss the implications on circumstellar chemistry.

  14. Recent advances in fullerene science (Invited)

    SciTech Connect

    Dunk, P. W.; Marshall, A. G.; Mulet-Gas, M.; Rodriguez-Fortea, A.; Poblet, J. M.

    2014-12-09

    The development of very high resolution FT-ICR mass spectrometers (Marshall et al, 1998) has made a wide range of new measurements possible and by combining this new technology with laser vaporization supersonic beam methods of producing carbon species (chains, rings and fullerenes), new advances in understanding of the fullerene creation mechanisms and their reactivity have been possible. In this overview, new understanding has been developed with regard to: a) closed-network growth of fullerenes (Dunk et al, 2012a); b) small endohedral species such as MαC{sub 28} (Dunk et al., 2012b); c) metallofullerene and fullerene formation under conditions in stellar outflows with relevance to stardust (Dunk et al., 2013a) and d) The formation of heterofullerenes by direct exposure of C{sub 60} toboron vapor (Dunk et al., 2013b)

  15. Transmission electron microscopy: Visualizing fullerene chemistry

    NASA Astrophysics Data System (ADS)

    Terrones, Mauricio

    2010-02-01

    Chemical reactions of fullerenes and metallofullerenes lined up inside single-walled carbon nanotubes can be monitored at the atomic scale inside an aberration-corrected transmission electron microscope.

  16. Electron Transport Through Single Fullerene Molecules (abstract)

    NASA Astrophysics Data System (ADS)

    Stróżecka, Anna; Muthukumar, Kaliappan; Larsson, J. Andreas; Voigtländer, Bert

    2009-04-01

    Fullerenes show potential for applications in nanotechnology due to the possibility of tuning their properties by doping or functionalization. In particular, the endohedral doping of the hollow carbon cage with metal atoms allows changing the electronic and magnetic properties of the molecule without distorting the geometry of the outer shell. Here we present a low temperature scanning tunneling microscopy (STM) and spectroscopy study of the vibrational and transport properties of Ce2atC80 metallofullerenes. We observe that electron transport through the endohedral fullerene is strongly mediated by excitation of molecular vibrations, especially the dynamics of encapsulated atoms. We measure the conductance of the single-molecule junction upon contact between the molecule and the STM tip. To determine the role of doping atoms we compare the results obtained for the endohedrally doped species with those for a hollow fullerene. Analysis shows that localization of electron density on encapsulated atoms hinders the conduction process through the fullerene.

  17. Applications of Functionalized Fullerenes in Tumor Theranostics

    PubMed Central

    Chen, Zhiyun; Ma, Lijing; Liu, Ying; Chen, Chunying

    2012-01-01

    Functionalized fullerenes with specific physicochemical properties have been developed for cancer diagnosis and therapy. Notably, metallofullerene is a new class of magnetic resonance imaging (MRI) contrast-enhancing agent, and may have promising applications for clinical diagnosis. Polyhydroxylated and carboxyl fullerenes have been applied to photoacoustic imaging. Moreover, in recent years, functionalized fullerenes have shown potential in tumor therapies, such as photodynamic therapy, photothermal treatment, radiotherapy and chemotherapeutics. Their antitumor effects may be associated with the modulation of oxidative stress, anti-angiogenesis, and immunostimulatory activity. While various types of novel nanoparticle agents have been exploited in tumor theranostics, their distribution, metabolism and toxicity in organisms have also been a source of concern among researchers. The present review summarizes the potential of fullerenes as tumor theranostics agents and their possible underlying mechanisms are discussed. PMID:22509193

  18. First-Principle Calculations of Large Fullerenes.

    PubMed

    Calaminici, Patrizia; Geudtner, Gerald; Köster, Andreas M

    2009-01-13

    State of-the-art density functional theory calculations have been performed for the large fullerenes C180, C240, C320, and C540 using the linear combination of Gaussian-type orbitals density functional theory (LCGTO-DFT) approach. For the calculations all-electron basis sets were employed. All fullerene structures were fully optimized without symmetry constrains. The analysis of the obtained structures as well as a study on the evolution of the bond lengths and calculated binding energies are presented. The fullerene results are compared to diamond and graphene which were calculated at the same level of theory. This represents the first systematic study on these large fullerenes based on nonsymmetry adapted first-principle calculations, and it demonstrates the capability of DFT calculations for energy and structure computations of large scale structures without any symmetry constraint.

  19. Cage Destruction in Metal-Fullerene Clusters

    SciTech Connect

    Tast, F.; Malinowski, N.; Frank, S.; Heinebrodt, M.; Billas, I.M.; Martin, T.P.

    1996-10-01

    Mass spectrometric studies on free clusters composed of single fullerene molecules and transition metal atoms (C{sub 60}{ital M}{sub {ital x}} and C{sub 70}{ital M}{sub {ital x}}; {ital x}=0.150, {ital M}{element_of}{l_brace}Ti,V,Nb,Ta{r_brace}) reveal that they undergo a laser induced transformation from metal-fullerene clusters to metal carbide and metallo-carbohedrene clusters. Two types of fragmentation behavior are observed. Fullerenes doped with titanium or vanadium seem to be stable at low laser intensities, whereas tantalum and niobium severely destabilize the fullerene cage. Photofragmentation spectra of preselected C{sub 60}Ta{sub {ital x}} indicate that the C{sub 60} cage is destroyed for {ital x}{ge}3. {copyright} {ital 1996 The American Physical Society.}

  20. Characterizing Fullerene Nanoparticles in Aqueous Suspensions

    EPA Science Inventory

    Studies have indicated that fullerenes can form stable colloidal suspensions in water when introduced to the aqueous phase through solvent exchange, sonication, or extended mixing. The colloidal suspensions created using these techniques have effective aqueous phase concentratio...

  1. Adsorption of amino acids by fullerenes and fullerene nanowhiskers

    NASA Astrophysics Data System (ADS)

    Hashizume, Hideo; Hirata, Chika; Fujii, Kazuko; Miyazawa, Kun'ichi

    2015-12-01

    We have investigated the adsorption of some amino acids and an oligopeptide by fullerene (C60) and fullerene nanowhiskers (FNWs). C60 and FNWs hardly adsorbed amino acids. Most of the amino acids used have a hydrophobic side chain. Ala and Val, with an alkyl chain, were not adsorbed by the C60 or FNWs. Trp, Phe and Pro, with a cyclic structure, were not adsorbed by them either. The aromatic group of C60 did not interact with the side chain. The carboxyl or amino group, with the frame structure of an amino acid, has a positive or negative charge in solution. It is likely that the C60 and FNWs would not prefer the charged carboxyl or amino group. Tri-Ala was adsorbed slightly by the C60 and FNWs. The carboxyl or amino group is not close to the center of the methyl group of Tri-Ala. One of the methyl groups in Tri-Ala would interact with the aromatic structure of the C60 and FNWs. We compared our results with the theoretical interaction of 20 bio-amino acids with C60. The theoretical simulations showed the bonding distance between C60 and an amino acid and the dissociation energy. The dissociation energy was shown to increase in the order, Val < Phe < Pro < Asp < Ala < Trp < Tyr < Arg < Leu. However, the simulation was not consistent with our experimental results. The adsorption of albumin (a protein) by C60 showed the effect on the side chains of Try and Trp. The structure of albumin was changed a little by C60. In our study Try and Tyr were hardly adsorbed by C60 and FNWs. These amino acids did not show a different adsorption behavior compared with other amino acids. The adsorptive behavior of mono-amino acids might be different from that of polypeptides.

  2. Genetic transformation of sweet potato by particle bombardment.

    PubMed

    Prakash, C S; Varadarajan, U

    1992-03-01

    Transient and stable expression of foreign genes has been achieved in sweet potato using the particle bombardment system of gene delivery. Callus and root isolates of two genotypes (Jewel and TIS-70357) with positive signs of transformation have been recovered. Tungsten microcarriers coated with plasmid DNA (pBI 221 containing the gusA gene) were accelerated at high velocity using a biolistic device into sweet potato target tissues. Histochemical examination of bombarded leaf and petiole explants revealed that most had cells expressing the gusA gene. When explants were cultured, calli and roots developed in most bombarded tissues. Similar results but with a lower frequency of transformation were observed when the plasmid pBI 121 (with gusA and antibiotic resistance npt II genes) was employed and bombarded explants cultured on an antibiotic selection medium. Subcultured roots and calli were positive for gusA expression when tested even after one year of in vitro culture, and thus the expression of the foreign gene is fairly stable. The particle bombardment approach of gene delivery appears to have a potential for generating transgenic sweet potatoes with useful agronomic traits.

  3. Carbon nanomaterials: Biologically active fullerene derivatives.

    PubMed

    Bogdanović, Gordana; Djordjević, Aleksandar

    2016-01-01

    Since their discovery, fullerenes, carbon nanotubes, and graphene attract significant attention of researches in various scientific fields including biomedicine. Nano-scale size and a possibility for diverse surface modifications allow carbon nanoallotropes to become an indispensable nanostructured material in nanotechnologies, including nanomedicine. Manipulation of surface chemistry has created diverse populations of water-soluble derivatives of fullerenes, which exhibit different behaviors. Both non-derivatized and derivatized fullerenes show various biological activities. Cellular processes that underline their toxicity are oxidative, genotoxic, and cytotoxic responses.The antioxidant/cytoprotective properties of fullerenes and derivatives have been considered in the prevention of organ oxidative damage and treatment. The same unique physiochemical properties of nanomaterials may also be associated with potential health hazards. Non-biodegradability and toxicity of carbon nanoparticles still remain a great concern in the area of biomedical application. In this review, we report on basic physical and chemical properties of carbon nano-clusters--fullerenes, nanotubes, and grapheme--their specificities, activities, and potential application in biological systems. Special emphasis is given to our most important results obtained in vitro and in vivo using polyhydroxylated fullerene derivative C₆₀(OH)₂₄.

  4. Fullerenes in electron cyclotron resonance ion sources

    SciTech Connect

    Biri, S.; Fekete, E.; Kitagawa, A.; Muramatsu, M.; Janossy, A.; Palinkas, J.

    2006-03-15

    Fullerene plasmas and beams have been produced in our electron cyclotron resonance ion sources (ECRIS) originally designed for other purposes. The ATOMKI-ECRIS is a traditional ion source with solenoid mirror coils to generate highly charged ions. The variable frequencies NIRS-KEI-1 and NIRS-KEI-2 are ECR ion sources built from permanent magnets and specialized for the production of carbon beams. The paper summarizes the experiments and results obtained by these facilities with fullerenes. Continuous effort has been made to get the highest C{sub 60} beam intensities. Surprisingly, the best result was obtained by moving the C{sub 60} oven deep inside the plasma chamber, very close to the resonance zone. Record intensity singly and doubly charged fullerene beams were obtained (600 and 1600 nA, respectively) at lower C{sub 60} material consumption. Fullerene derivatives were also produced. We mixed fullerenes with other plasmas (N, Fe) with the aim of making new materials. Nitrogen encapsulated fullerenes (mass: 720+14=734) were successfully produced. In the case of iron, two methods (ferrocene, oven) were tested. Molecules with mass of 720+56=776 were detected in the extracted beam spectra.

  5. Carbon nanomaterials: Biologically active fullerene derivatives.

    PubMed

    Bogdanović, Gordana; Djordjević, Aleksandar

    2016-01-01

    Since their discovery, fullerenes, carbon nanotubes, and graphene attract significant attention of researches in various scientific fields including biomedicine. Nano-scale size and a possibility for diverse surface modifications allow carbon nanoallotropes to become an indispensable nanostructured material in nanotechnologies, including nanomedicine. Manipulation of surface chemistry has created diverse populations of water-soluble derivatives of fullerenes, which exhibit different behaviors. Both non-derivatized and derivatized fullerenes show various biological activities. Cellular processes that underline their toxicity are oxidative, genotoxic, and cytotoxic responses.The antioxidant/cytoprotective properties of fullerenes and derivatives have been considered in the prevention of organ oxidative damage and treatment. The same unique physiochemical properties of nanomaterials may also be associated with potential health hazards. Non-biodegradability and toxicity of carbon nanoparticles still remain a great concern in the area of biomedical application. In this review, we report on basic physical and chemical properties of carbon nano-clusters--fullerenes, nanotubes, and grapheme--their specificities, activities, and potential application in biological systems. Special emphasis is given to our most important results obtained in vitro and in vivo using polyhydroxylated fullerene derivative C₆₀(OH)₂₄. PMID:27483572

  6. Formation dynamics of fullerene dimers C118+, C119+, and C120+

    NASA Astrophysics Data System (ADS)

    Wang, Y.; Zettergren, H.; Rousseau, P.; Chen, T.; Gatchell, M.; Stockett, M. H.; Domaracka, A.; Adoui, L.; Huber, B. A.; Cederquist, H.; Alcamí, M.; Martín, F.

    2014-06-01

    Dumbbell-shaped fullerene dimers C118+ and C119+ have recently been observed in mass spectra resulting from collisions between clusters of C60 molecules and keV He2+ or Ar2+ ions [H. Zettergren et al., Phys. Rev. Lett. 110, 185501 (2013), 10.1103/PhysRevLett.110.185501 and F. Seitz et al., J. Chem. Phys. 139, 034309 (2013), 10.1063/1.4812790]. To unveil the formation mechanisms of these fullerene dimers, systematic molecular dynamics (MD) simulations based on the self-consistent charge density functional tight-binding method have been performed for Cn+ + C60 (n =58,59,60) collisions following prompt atom knockouts by the fast ions. The statistics from the MD simulations indicate a much higher reactivity of C59+ and C58+ fragments compared to that of C60+. It is found that the covalently bonded dumbbell-shaped fullerene dimers C118+ and C119+ can be formed at very low-collision energies within 1 ps and are stable enough to survive on the microsecond time scale of the experiment. The thermodynamic and kinetic stabilities, as well as the bonding features, have been investigated for the most stable dumbbell dimers C118+, C119+, and C120+.

  7. Oxidation of nickel surfaces by low energy ion bombardment

    NASA Astrophysics Data System (ADS)

    Saric, Iva; Peter, Robert; Kavre, Ivna; Badovinac, Ivana Jelovica; Petravic, Mladen

    2016-03-01

    We have studied formation of oxides on Ni surfaces by low energy oxygen bombardment using X-ray photoemission spectroscopy (XPS) and secondary ion mass spectrometry (SIMS). Different oxidation states of Ni ions have been identified in XPS spectra measured around Ni 2p and O 1s core-levels. We have compared our results with thermal oxidation of Ni and shown that ion bombardment is more efficient in creating thin oxide films on Ni surfaces. The dominant Ni-oxide in both oxidation processes is NiO (Ni2+ oxidation state), while some Ni2O3 contributions (Ni3+ oxidation state) are still present in all oxidised samples. The oxide thickness of bombarded Ni samples, as determined by SIMS, was shown to be related to the penetration depth of oxygen ions in Ni.

  8. Program fullerene: a software package for constructing and analyzing structures of regular fullerenes.

    PubMed

    Schwerdtfeger, Peter; Wirz, Lukas; Avery, James

    2013-06-30

    Fullerene (Version 4.4) is a general purpose open-source program that can generate any fullerene isomer, perform topological and graph theoretical analysis, as well as calculate a number of physical and chemical properties. The program creates symmetric planar drawings of the fullerene graph and generates accurate molecular 3D geometries by way of force-field optimization, serving as a good starting point for further quantum theoretical treatments. It includes a number of fullerene-to-fullerene transformations, such as Goldberg-Coxeter transforms, Stone-Wales transforms, Endo-Kroto, Yoshida-Fowler, and Brinkmann-Fowler vertex insertions. The program is written in standard Fortran and C++ and can easily be installed in a Linux or UNIX environment. PMID:23559399

  9. Thermal effects of impact bombardments on Noachian Mars

    NASA Astrophysics Data System (ADS)

    Abramov, Oleg; Mojzsis, Stephen J.

    2016-05-01

    Noachian (prior to ca. 3700 Ma) terranes are the oldest and most heavily cratered landscapes on Mars, with crater densities comparable to the ancient highlands of the Moon and Mercury. Intense early cratering affected Mars by melting and fracturing its crust, draping large areas in impact ejecta, generating regional-scale hydrothermal systems, and increasing atmospheric pressure (and thereby, temperature) to periodically re-start an otherwise moribund hydrological cycle. Post primary-accretionary bombardment scenarios that shaped early Mars can be imagined in two ways: either as a simple exponential decay with an approximately 100 Myr half-life, or as a "sawtooth" timeline characterized by both faster-than-exponential decay from primary accretion and relatively lower total delivered mass. Indications are that a late bombardment spike was superposed on an otherwise broadly monotonic decline subsequent to primary accretion, of which two types are investigated: a classical "Late Heavy Bombardment" (LHB) peak of impactors centered at ca. 3900 Ma that lasted 100 Myr, and a protracted bombardment typified by a sudden increase in impactor flux at ca. 4100-4200 Ma with a correspondingly longer decay time (≤400 Myr). Numerical models for each of the four bombardment scenarios cited above show that the martian crust mostly escaped exogenic melting from bombardment. We find that depending on the chosen scenario, other physical effects of impacts were more important than melt generation. Model output shows that between 10 and 100% of the Noachian surface was covered by impact craters and blanketed in resultant (hot) ejecta. If early Mars was generally arid and cold, impact-induced heating punctuated this surface state by intermittently destabilizing the near-subsurface cryosphere to generate regional-scale hydrothermal systems. Rather than being deleterious to the proclivity of Noachian Mars to host an emergent biosphere, this intense early impact environment instead

  10. Fullerene surfactants and their use in polymer solar cells

    SciTech Connect

    Jen, Kwan-Yue; Yip, Hin-Lap; Li, Chang-Zhi

    2015-12-15

    Fullerene surfactant compounds useful as interfacial layer in polymer solar cells to enhance solar cell efficiency. Polymer solar cell including a fullerene surfactant-containing interfacial layer intermediate cathode and active layer.

  11. Paper Models for Fullerenes C60-C84.

    ERIC Educational Resources Information Center

    Beaton, John M.

    1995-01-01

    Describes a system to construct paper models of all 51 of the possible fullerene isomers from C60 through C84. Provides students, teachers, and specialists with an inexpensive mechanism to follow the literature interplay on fullerene structures. (JRH)

  12. Tuning the hopping conductivity of WO3 films by ion bombardment at different temperatures

    NASA Astrophysics Data System (ADS)

    Heinz, B.; Merz, M.; Widmayer, P.; Ziemann, P.

    2001-10-01

    WO3 films, either prepared by sputtering or evaporation under high or ultrahigh vacuum conditions, were irradiated with He+ and Ar+ ions (energy range 300-350 keV) at ambient and low temperatures (77-100 K). The resulting ion induced changes of the optical absorption as well as of the electrical conductivity could be determined on one and the same sample, which enables the variable range hopping (VRH) model to be tested under the assumption that the density of irradiation induced color centers is proportional to the electronic density of states contributing to the hopping conductivity. It is found that the data obtained at 300 K for He+ and Ar+ bombardment can be described within the VRH model by one common conductivity versus absorption curve, even though the effectiveness per projectile of the heavier ion for coloration as well as for increasing the conductivity is much higher. This is different at low temperatures. While the ion induced coloration is practically independent of the irradiation temperature for both projectiles, the effectiveness per projectile to enhance the conductivity is interchanged. This is attributed to the additional damage produced by the heavier ion at low temperatures resulting in strongly impeded hopping processes. Consistent with the VRH model, the temperature dependence of the conductivity of ion bombarded WO3 films follow the Mott "T-1/4" law, if the ion induced conductivity is not too high. For very high ion fluences clear deviations from the VRH model are observed for the conductivity versus absorption curves accompanied by a shift of the above power laws from T-1/4 towards T-1/2.

  13. Constructing I[subscript h] Symmetrical Fullerenes from Pentagons

    ERIC Educational Resources Information Center

    Gan, Li-Hua

    2008-01-01

    Twelve pentagons are sufficient and necessary to form a fullerene cage. According to this structural feature of fullerenes, we propose a simple and efficient method for the construction of I[subscript h] symmetrical fullerenes from pentagons. This method does not require complicated mathematical knowledge; yet it provides an excellent paradigm for…

  14. Preparation of magnetite-fullerene nanocomposite with enzyme immobilization.

    PubMed

    Kalska-Szostko, B; Rogowska, M

    2012-09-01

    This study presents modification of magnetite nanoparticles and fullerene for biocompatibility. It show also specific fabrication of magnetite-carbon nanocomposite with immobilized biomolecule. The composites were created by joining individual components step-by-step manner (fullerene to magnetite and glucose oxidase or glucose oxidase to magnetite and fullerene). The resulting nanocomposites were characterized by infrared spectroscopy (IR) and transmission electron microscopy (TEM).

  15. Stability of carbonaceous dust analogues and glycine under UV irradiation and electron bombardment.

    PubMed

    Maté, Belén; Tanarro, Isabel; Moreno, Miguel A; Jiménez-Redondo, Miguel; Escribano, Rafael; Herrero, Víctor J

    2014-01-01

    The effect of UV photon (120-200 nm) and electron (2 keV) irradiation of analogues of interstellar carbonaceous dust and of glycine were investigated by means of IR spectroscopy. Films of hydrogenated amorphous carbon (HAC), taken as dust analogues, were found to be stable under UV photon and electron bombardment. High fluences of photons and electrons, of the order of 10(19) cm(-2), were needed for a film depletion of a few percent. UV photons were energetically more effective than electrons for depletion and led to a certain dehydrogenation of the HAC samples, whereas electrons led seemingly to a gradual erosion with no appreciable changes in the hydrocarbon structure. The rates of change observed may be relevant over the lifetime of a diffuse cloud, but cannot account for the rapid changes in hydrocarbon IR bands during the evolution of some proto-planetary nebulae. Glycine samples under the same photon and electron fluxes decay at a much faster rate, but tend usually to an equilibrium value different from zero, especially at low temperatures. Reversible reactions re-forming glycine, or the build-up of less transparent products, could explain this behavior. CO2 and methylamine were identified as UV photoproducts. Electron irradiation led to a gradual disappearance of the glycine layers, also with formation of CO2. No other reaction products were clearly identified. The thicker glycine layers (a few hundred nm) were not wholly depleted, but a film of the order of the electron penetration depth (80 nm), was totally destroyed with an electron fluence of -1 x 10(18) cm(-2). A 60 nm ice layer on top of glycine provided only partial shielding from the 2 keV electrons. From an energetic point of view, 2 keV electrons are less efficient than UV photons and, according to literature data, much less efficient than MeV protons for the destruction of glycine. The use of keV electrons to simulate effects of cosmic rays on analogues of interstellar grains should be taken with

  16. 200 keV Xe+ ions irradiation effects on Zr-Ti binary films

    NASA Astrophysics Data System (ADS)

    Wang, Weipeng; Chai, Maosheng; Feng, Wei; Li, Zhengcao; Zhang, Zhengjun

    2015-05-01

    200 keV Xenon irradiation experiments were performed on magnetron sputtered Zr-Ti films under different doses up to 9 * 1015 ions/cm2. XRD, FE-SEM, AFM, HRTEM, nano-indentation and white light interferometer characterizations were applied to study the structural and mechanical properties modification introduced by the bombardment. Upon Xenon irradiation, structure of film matrix kept stable while the crystallinity of the top surface degraded significantly. Meanwhile, properties of irradiated films such as hardness, modulus and sheet resistance evolved with the same tendency, i.e. increased firstly and decrease with further increasing the irradiation dose. By selective area irradiation, competition between the surface sputtering and swelling was revealed, by which surface defects evolution was highlighted. The micro-defects evolution during Xenon irradiation was believed to be responsible for the macro-properties' modification.

  17. Mechanisms of O2 Sputtering from Water Ice by keV Ions

    NASA Technical Reports Server (NTRS)

    Teolis, B. D.; Vidal, R. A.; Shi, J.; Baragiola, R. A.

    2005-01-01

    We have conducted experiments on the sputtering of water ice by 100 keV Ar(+) between 20 and 150 K. Our findings indicate that the temperature dependence of the total sputtering yield is heavily influenced by the thermal and irradiation history of the ice, showing a complex dependence on irradiation fluence that is correlated to the ejection of O2 molecules. The results suggest that O2 produced by the ions inside the ice diffuses to the surface where it is trapped and then ejected via sputtering or thermal desorption. A high concentration of O2 can trap in a subsurface layer during bombardment at 130 K, which we relate to the formation of hydrogen and its escape from that region. A simple model allows us to determine the depth profile of the absolute concentration of O2 trapped in the ice.

  18. INFRARED STUDY OF FULLERENE PLANETARY NEBULAE

    SciTech Connect

    Garcia-Hernandez, D. A.; Acosta-Pulido, J. A.; Manchado, A.; Garcia-Lario, P.; Stanghellini, L.; Shaw, R. A.; Cataldo, F. E-mail: amt@iac.es E-mail: Pedro.Garcia-Lario@sciops.esa.int E-mail: letizia@noao.edu

    2012-12-01

    We present a study of 16 planetary nebulae (PNe) where fullerenes have been detected in their Spitzer Space Telescope spectra. This large sample of objects offers a unique opportunity to test conditions of fullerene formation and survival under different metallicity environments because we are analyzing five sources in our own Galaxy, four in the Large Magellanic Cloud (LMC), and seven in the Small Magellanic Cloud (SMC). Among the 16 PNe studied, we present the first detection of C{sub 60} (and possibly also C{sub 70}) fullerenes in the PN M 1-60 as well as of the unusual {approx}6.6, 9.8, and 20 {mu}m features (attributed to possible planar C{sub 24}) in the PN K 3-54. Although selection effects in the original samples of PNe observed with Spitzer may play a potentially significant role in the statistics, we find that the detection rate of fullerenes in C-rich PNe increases with decreasing metallicity ({approx}5% in the Galaxy, {approx}20% in the LMC, and {approx}44% in the SMC) and we interpret this as a possible consequence of the limited dust processing occurring in Magellanic Cloud (MC) PNe. CLOUDY photoionization modeling matches the observed IR fluxes with central stars that display a rather narrow range in effective temperature ({approx}30,000-45,000 K), suggesting a common evolutionary status of the objects and similar fullerene formation conditions. Furthermore, the data suggest that fullerene PNe likely evolve from low-mass progenitors and are usually of low excitation. We do not find a metallicity dependence on the estimated fullerene abundances. The observed C{sub 60} intensity ratios in the Galactic sources confirm our previous finding in the MCs that the fullerene emission is not excited by the UV radiation from the central star. CLOUDY models also show that line- and wind-blanketed model atmospheres can explain many of the observed [Ne III]/[Ne II] ratios using photoionization, suggesting that possibly the UV radiation from the central star, and

  19. Dating Howardite Melt Clasts: Evidence for an Extended Vestan Bombardment?

    NASA Technical Reports Server (NTRS)

    Cartwright, J. A.; Hodges, K. V.; Wadhwa, M.; Mittlefehldt, D. W.

    2016-01-01

    Howardites are polymict breccias that, together with eucrites and diogenites (HED), likely originate from the vestan surface (regolith/ megaregolith), and display a heterogeneous distribution of eucritic and diogenitic material. Melt clasts are also present alongside other regolithic features within howardites, and are noteworthy for their compositional variability and appearance. Melt clasts formed by impact events provide a snapshot of the timings and conditions of surface gardening and bombardment on the vestan surface. By dating such clasts, we aim to better constrain the timings of impact events on Vesta, and to establish whether the impact flux in the asteroid belt was similar to that on the Moon. As the Moon is used as the basis for characterising impact models of the inner solar system, it is necessary to verify that apparent wide-scale events are seen in other planetary bodies. In particular, the observed clustering of Apollo melt clast ages between 3.8-4.0 Ga has led to two hypotheses: 1) The Moon was subjected to a sudden event - 'Lunar Cataclysm' or period of 'Late Heavy Bombardment' (LHB), 2) The age cluster represents the end of an epoch of declining bombardment or 'Heavy Bombardment. No consensus has emerged regarding one or other hypothesis. We are testing these hypotheses by seeking evidence for such events in materials other than those derived from the Moon.

  20. JOVIAN EARLY BOMBARDMENT: PLANETESIMAL EROSION IN THE INNER ASTEROID BELT

    SciTech Connect

    Turrini, D.; Coradini, A.; Magni, G.

    2012-05-01

    The asteroid belt is an open window on the history of the solar system, as it preserves records of both its formation process and its secular evolution. The progenitors of the present-day asteroids formed in the Solar Nebula almost contemporary to the giant planets. The actual process producing the first generation of asteroids is uncertain, strongly depending on the physical characteristics of the Solar Nebula, and the different scenarios produce very diverse initial size-frequency distributions (SFDs). In this work, we investigate the implications of the formation of Jupiter, plausibly the first giant planet to form, on the evolution of the primordial asteroid belt. The formation of Jupiter triggered a short but intense period of primordial bombardment, previously unaccounted for, which caused an early phase of enhanced collisional evolution in the asteroid belt. Our results indicate that this Jovian Early Bombardment caused the erosion or the disruption of bodies smaller than a threshold size, which strongly depends on the SFD of the primordial planetesimals. If the asteroid belt was dominated by planetesimals less than 100 km in diameter, the primordial bombardment would have caused the erosion of bodies smaller than 200 km in diameter. If the asteroid belt was instead dominated by larger planetesimals, the bombardment would have resulted in the destruction of bodies as big as 500 km.

  1. Jovian Early Bombardment: Planetesimal Erosion in the Inner Asteroid Belt

    NASA Astrophysics Data System (ADS)

    Turrini, D.; Coradini, A.; Magni, G.

    2012-05-01

    The asteroid belt is an open window on the history of the solar system, as it preserves records of both its formation process and its secular evolution. The progenitors of the present-day asteroids formed in the Solar Nebula almost contemporary to the giant planets. The actual process producing the first generation of asteroids is uncertain, strongly depending on the physical characteristics of the Solar Nebula, and the different scenarios produce very diverse initial size-frequency distributions (SFDs). In this work, we investigate the implications of the formation of Jupiter, plausibly the first giant planet to form, on the evolution of the primordial asteroid belt. The formation of Jupiter triggered a short but intense period of primordial bombardment, previously unaccounted for, which caused an early phase of enhanced collisional evolution in the asteroid belt. Our results indicate that this Jovian Early Bombardment caused the erosion or the disruption of bodies smaller than a threshold size, which strongly depends on the SFD of the primordial planetesimals. If the asteroid belt was dominated by planetesimals less than 100 km in diameter, the primordial bombardment would have caused the erosion of bodies smaller than 200 km in diameter. If the asteroid belt was instead dominated by larger planetesimals, the bombardment would have resulted in the destruction of bodies as big as 500 km.

  2. Advances in fast-atom-bombardment mass spectroscopy

    SciTech Connect

    Hemling, M.E.

    1986-01-01

    A comparison of fast atom bombardment and field desorption mass spectrometry was made to determine relative sensitivity and applicability. A series of glycosphingolipids and a series of protected oligonucleotides of known structure were analyzed to ascertain the potential utility of fast atom bombardment mass spectrometry in the structural elucidation of novel compounds in these classes. Negative ion mass markers were also developed. Fast atom bombardment was found to be one-to-two orders of magnitude more sensitive than field desorption based on the analysis of a limited number of compounds from several classes. Superior sensitivity was not universal and field desorption was clearly better in certain cases. In the negative ion mode in particular, fast atom bombardment was found to be a useful tool for the determination of the primary structure of glycosphingolipids and oligonucleotides. Carbohydrate sequence and branching information, and a fatty acid and lipid base composition were readily obtained from the mass spectra of glycosphingolipids while bidirectional nucleotide sequence, nucleotide base, and protecting group assignments were obtained for oligonucleotides. Based on this knowledge, a tentative structure of a human peripheral nervous system glycosphingolipid implicated in certain cases of disorders such as amyotrophic lateral sclerosis, Lou Gehrig's Disease, was proposed. Suitable negative ion mass markers were found in dispersions of poly(ethylene) and poly(propylene)glycols in a triethylenetetramine matrix, a matrix which also proved useful in the analysis of glycosphingolipids. These polyglycol dispersions provided ions for calibration to 2300 daltons.

  3. Fullerene (C60) films for solid lubrication

    SciTech Connect

    Bhushan, B.; Gupta, B.K.; Van Cleef, G.W.; Capp, C.E.; Coe, J.V. )

    1993-10-01

    The advent of techniques for producing gram quantities of a new form of stable, pure, solid carbon, designated as fullerene, opens a profusion of possibilities to be explored in many disciplines including tribology. Fullerenes take the form of hollow geodesic domes, which are formed from a network of pentagons and hexagons with covalently bonded carbon atoms. The C60 molecule has the highest possible symmetry (icosahedral) and assumes the shape of a soccer ball. At room temperature, fullerene molecules pack in an fcc lattice bonded with weak van der Waals attractions. Fullerenes can be dissolved in solvents such as toluene and benzene and are easily sublimed. The low surface energy, high chemical stability, spherical shape, weak intermolecular bonding, and high load bearing capacity of C60 molecules offer potential for various mechanical and tribological applications. This paper describes the crystal structure and properties of fullerenes and proposes a mechanism for self-lubricating action. Sublimed films of C60 have been produced and friction and wear performance of these films in various operating environments are the subject of this paper. The results of this study indicate that C60, owing to its unique crystal structure and bonding, may be a promising solid lubricant. 31 refs.

  4. Energetics of water permeation through fullerene membrane

    PubMed Central

    Isobe, Hiroyuki; Homma, Tatsuya; Nakamura, Eiichi

    2007-01-01

    Lipid bilayer membranes are important as fundamental structures in biology and possess characteristic water-permeability, stability, and mechanical properties. Water permeation through a lipid bilayer membrane occurs readily, and more readily at higher temperature, which is largely due to an enthalpy cost of the liquid-to-gas phase transition of water. A fullerene bilayer membrane formed by dissolution of a water-soluble fullerene, Ph5C60K, has now been shown to possess properties entirely different from those of the lipid membranes. The fullerene membrane is several orders of magnitude less permeable to water than a lipid membrane, and the permeability decreases at higher temperature. Water permeation is burdened by a very large entropy loss and may be favored slightly by an enthalpy gain, which is contrary to the energetics observed for the lipid membrane. We ascribe this energetics to favorable interactions of water molecules to the surface of the fullerene molecules as they pass through the clefts of the rigid fullerene bilayer. The findings provide possibilities of membrane design in science and technology. PMID:17846427

  5. Polymeric templating and alignment of fullerenes

    NASA Astrophysics Data System (ADS)

    Kincer, Matthew Ryan

    Fullerene research has advanced to elevated levels in a short period of time due to the unique chemical and physical properties of the caged molecule that have been utilized in numerous applications. Due to the spherical shape of the fullerene molecule which allows for a hollow cavity, encapsulation of atoms or small molecules can occur within the ball structure. This encapsulation creates an endohedral component that is limited from interacting with other molecules which creates potential of control over electronic information of the isolated molecule. Endohedral fullerenes have the potential as serving as the base unit in a quantum computer if control over global alignment is attained. Thus, by using the inherent self-assembling capabilities of some organic materials, ordered endohedral fullerenes can be achieved. This dissertation investigates the ability to use self-assembling strategies to obtain alignment which include ordering within a morphologically controlled copolymer matrix, forming a supramolecular polymer complex with cyclodextrin, and encapsulation within the helical wrap of polymer chains. The ultimate goal is to understand the dynamics that control association and orientation of varying fullerene-based molecules in each strategy in order to maximize control over the final alignment of endohedral elements.

  6. Kinetic Stability of Non-IPR Fullerene Molecular Ions.

    PubMed

    Aihara, Jun-ichi; Nakagami, Yuto; Sekine, Rika

    2015-06-18

    Many fullerenes that violate the isolated pentagon rule (IPR) form stable metallofullerenes. In general, a fullerene cage is kinetically stabilized by acquiring a given number of electrons. Kinetic stability of negatively charged non-IPR fullerenes, including the recently isolated endohedral metallofullerene with a heptagonal face, was rationalized in terms of bond resonance energy (BRE). Interestingly, molecular anions of conventional fullerenes found in most isolated metallofullerenes are kinetically stable with large positive BREs for all CC bonds. As we pointed out in 1993, the IPR does not apply to charged fullerenes because π-bonds shared by two five-membered rings are aromatized to varying extents. PMID:26020361

  7. Production of fullerenes using concentrated solar flux

    DOEpatents

    Fields, Clark L.; Pitts, John Roland; King, David E.; Hale, Mary Jane; Bingham, Carl E.; Lewandowski, Allan A.

    2000-01-01

    A method of producing soot containing high amounts of fullerenes comprising: providing a primary concentrator capable of impingement of a concentrated beam of sunlight onto a carbon source to cause vaporization of carbon and subsequent formation of fullerenes, or providing a solar furnace having a primary concentrator with a focal point that concentrates a solar beam of sunlight; providing a reflective secondary concentrator having an entrance aperture and an exit aperture at the focal point of the solar furnace; providing a carbon source at the exit aperture of the secondary concentrator; supplying an inert gas over the carbon source to keep the secondary concentrator free from vaporized carbon; and impinging a concentrated beam of sunlight from the secondary concentrator on the carbon source to vaporize the carbon source into a soot containing high amounts of fullerenes.

  8. Nanostructural magnetism of polymeric fullerene crystals

    SciTech Connect

    Sheka, E. F. Zaets, V. A.; Ginzburg, I. Ya.

    2006-11-15

    The nature of magnetism in all-carbon crystals composed of polymeric layers of covalently bound fullerene (C{sub 60}) molecules is considered. The results of quantum-chemical calculations performed using the unrestricted Hartree-Fock approximation and the semiempirical AM1 method are presented. It is shown that the exchange integrals J of both a free C{sub 60} molecule and a monomer unit of the polymer are too large ensure the required magnetic susceptibility of the fullerene crystal. However, the J value exhibits an approximately n-fold decrease for an oligomer molecule consisting of n C{sub 60} units. Therefore, in the case of large n, the exchange integral can be reduced to a low level sufficient to provide for a significant magnetic susceptibility. A nanosize (scaly) model of the observed magnetism is proposed that is consistent with recent experimental data, which are indicative of a nanostructural character of magnetic fullerene samples.

  9. Comparing Fullerenes by Spectral Moments.

    PubMed

    Taghvaee, F; Ashrafi, A R

    2016-03-01

    Suppose G is a graph, A(G) its adjacency matrix, and μ1(G)≤(G)μ2(G)≤ ... ≤ μ(n)(G)are eigenvalues of A(G). The numbers S(k)(G) = Σ(i) n = 1 μ(i)k (G), 0 ≤ k ≤ n -1 are said to be the k-th spectral moment of G and the sequence S(G) = (S0(G), S1 (G),..., S(n-1)(G)is called the spectral moments sequence of G. Suppose G1 and G2 are graphs. If there exists an integer k, 1 ≤ k ≤ n - 1, such that for each i, 0 ≤ i ≤ k - 1, S(i) (G1) = S(i)(G2) and S(k)(G1) < S(k)(G2) then we write G1 -<(s) G2. The aim of this paper is order some classes of fullerene graphs with respect to the S-order.

  10. 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.

  11. 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.

  12. Fullerenes in an impact crater on the LDEF spacecraft.

    PubMed

    Radicati di Brozolo, F; Bunch, T E; Fleming, R H; Macklin, J

    1994-05-01

    The fullerenes C60 and C70 have been found to occur naturally on Earth and have also been invoked to explain features in the absorption spectra of interstellar clouds. But no definitive spectroscopic evidence exists for fullerenes in space and attempts to find fullerenes in carbonaceous chondrites have been unsuccessful. Here we report the observation of fullerenes associated with carbonaceous impact residue in a crater on the Long Duration Exposure Facility (LDEF) spacecraft. Laser ionization mass spectrometry and Raman spectroscopy indicate the presence of fullerenes in the crater and in adjacent ejecta. Man-made fullerenes survive experimental hypervelocity (approximately 6.1 km s-1) impacts into aluminium targets, suggesting that space fullerenes contained in a carbonaceous micrometeorite could have survived the LDEF impact at velocities towards the lower end of the natural particle encounter range (<13 km s-1). We also demonstrate that the fullerenes were unlikely to have formed as instrumental artefacts, nor are they present as contaminants. Although we cannot specify the origin of the fullerenes with certainty, the most plausible source is the chondritic impactor. If, alternatively, the impact produced the fullerenes in situ on LDEF, then this suggests a viable mechanism for fullerene production in space.

  13. Fullerenes in an impact crater on the LDEF spacecraft

    NASA Technical Reports Server (NTRS)

    Radicati di Brozolo, F.; Bunch, T. E.; Fleming, R. H.; Macklin, J.

    1994-01-01

    The fullerenes C60 and C70 have been found to occur naturally on Earth and have also been invoked to explain features in the absorption spectra of interstellar clouds. But no definitive spectroscopic evidence exists for fullerenes in space and attempts to find fullerenes in carbonaceous chondrites have been unsuccessful. Here we report the observation of fullerenes associated with carbonaceous impact residue in a crater on the Long Duration Exposure Facility (LDEF) spacecraft. Laser ionization mass spectrometry and Raman spectroscopy indicate the presence of fullerenes in the crater and in adjacent ejecta. Man-made fullerenes survive experimental hypervelocity (approximately 6.1 km s-1) impacts into aluminium targets, suggesting that space fullerenes contained in a carbonaceous micrometeorite could have survived the LDEF impact at velocities towards the lower end of the natural particle encounter range (<13 km s-1). We also demonstrate that the fullerenes were unlikely to have formed as instrumental artefacts, nor are they present as contaminants. Although we cannot specify the origin of the fullerenes with certainty, the most plausible source is the chondritic impactor. If, alternatively, the impact produced the fullerenes in situ on LDEF, then this suggests a viable mechanism for fullerene production in space.

  14. Fe embedded in ice: The impacts of sublimation and energetic particle bombardment

    NASA Astrophysics Data System (ADS)

    Frankland, Victoria L.; Plane, John M. C.

    2015-05-01

    Icy particles containing a variety of Fe compounds are present in the upper atmospheres of planets such as the Earth and Saturn. In order to explore the role of ice sublimation and energetic ion bombardment in releasing Fe species into the gas phase, Fe-dosed ice films were prepared under UHV conditions in the laboratory. Temperature-programmed desorption studies of Fe/H2O films revealed that no Fe atoms or Fe-containing species co-desorbed along with the H2O molecules. This implies that when noctilucent ice cloud particles sublimate in the terrestrial mesosphere, the metallic species embedded in them will coalesce to form residual particles. Sputtering of the Fe-ice films by energetic Ar+ ions was shown to be an efficient mechanism for releasing Fe into the gas phase, with a yield of 0.08 (Ar+ energy=600 eV). Extrapolating with a semi-empirical sputtering model to the conditions of a proton aurora indicates that sputtering by energetic protons (>100 keV) should also be efficient. However, the proton flux in even an intense aurora will be too low for the resulting injection of Fe species into the gas phase to compete with that from meteoric ablation. In contrast, sputtering of the icy particles in the main rings of Saturn by energetic O+ ions may be the source of recently observed Fe+ in the Saturnian magnetosphere. Electron sputtering (9.5 keV) produced no detectable Fe atoms or Fe-containing species. Finally, it was observed that Fe(OH)2 was produced when Fe was dosed onto an ice film at 140 K (but not at 95 K). Electronic structure theory shows that the reaction which forms this hydroxide from adsorbed Fe has a large barrier of about 0.7 eV, from which we conclude that the reaction requires both translationally hot Fe atoms and mobile H2O molecules on the ice surface.

  15. Repulsive interatomic potentials for noble gas bombardment of Cu and Ni targets

    NASA Astrophysics Data System (ADS)

    Karolewski, M. A.

    2006-01-01

    Interatomic potentials that are relevant for noble gas bombardment of Cu and Ni targets have been calculated in the energy region below 10 keV. Potentials are calculated for the diatomic species: NeCu, ArCu, KrCu, Cu2, ArNi, Ni2 and NiCu. The calculations primarily employ density functional theory (with the B3LYP exchange-correlation functional). Potential curves derived from Hartree-Fock theory calculations are also discussed. Scalar relativistic effects have been included via the second-order Douglas-Kroll-Hess (DKH2) method. On the basis of a variational argument, it can be shown that the predicted potential curves represent an upper limit to the true potential curves. The potentials provide a basis for assessing corrections required to the ZBL and Molière screened Coulombic potentials, which are typically found to be too repulsive below 1-2 keV. These corrections significantly improve the accuracy of the sputter yield predicted by molecular dynamics for Ni(1 0 0), whereas the sputter yield predicted for Cu(1 0 0) is negligibly affected. The validity of the pair potential approximation in the repulsive region of the potential is tested by direct calculation of the potentials arising from the interaction of either an Ar or Cu atom with a Cu3 cluster. The pairwise approximation represents the Ar-Cu3 potential energy function with an error <3 eV at all Ar-Cu3 separations. For Cu-Cu3, the pairwise approximation underestimates the potential by ca. 10 eV when the interstitial atom is located near the centre of the cluster.

  16. A Highly-Ordered 3D Covalent Fullerene Framework**

    PubMed Central

    Minar, Norma K; Hou, Kun; Westermeier, Christian; Döblinger, Markus; Schuster, Jörg; Hanusch, Fabian C; Nickel, Bert; Ozin, Geoffrey A; Bein, Thomas

    2015-01-01

    A highly-ordered 3D covalent fullerene framework is presented with a structure based on octahedrally functionalized fullerene building blocks in which every fullerene is separated from the next by six functional groups and whose mesoporosity is controlled by cooperative self-assembly with a liquid-crystalline block copolymer. The new fullerene-framework material was obtained in the form of supported films by spin coating the synthesis solution directly on glass or silicon substrates, followed by a heat treatment. The fullerene building blocks coassemble with a liquid-crystalline block copolymer to produce a highly ordered covalent fullerene framework with orthorhombic Fmmm symmetry, accessible 7.5 nm pores, and high surface area, as revealed by gas adsorption, NMR spectroscopy, small-angle X-ray scattering (SAXS), and TEM. We also note that the 3D covalent fullerene framework exhibits a dielectric constant significantly lower than that of the nonporous precursor material. PMID:25958846

  17. Distributed curvature and stability of fullerenes.

    PubMed

    Fowler, Patrick W; Nikolić, Sonja; De Los Reyes, Rasthy; Myrvold, Wendy

    2015-09-21

    Energies of non-planar conjugated π systems are typically described qualitatively in terms of the balance of π stabilisation and the steric strain associated with geometric curvature. Curvature also has a purely graph-theoretical description: combinatorial curvature at a vertex of a polyhedral graph is defined as one minus half the vertex degree plus the sum of reciprocal sizes of the faces meeting at that vertex. Prisms and antiprisms have positive combinatorial vertex curvature at every vertex. Excluding these two infinite families, we call any other polyhedron with everywhere positive combinatorial curvature a PCC polyhedron. Cubic PCC polyhedra are initially common, but must eventually die out with increasing vertex count; the largest example constructed so far has 132 vertices. The fullerenes Cn have cubic polyhedral molecular graphs with n vertices, 12 pentagonal and (n/2 - 10) hexagonal faces. We show that there are exactly 39 PCC fullerenes, all in the range 20 ≤n≤ 60. In this range, there is only partial correlation between PCC status and stability as defined by minimum pentagon adjacency. The sum of vertex curvatures is 2 for any polyhedron; for fullerenes the sum of squared vertex curvatures is linearly related to the number of pentagon adjacencies and hence is a direct measure of relative stability of the lower (n≤ 60) fullerenes. For n≥ 62, non-PCC fullerenes with a minimum number of pentagon adjacencies minimise mean-square curvature. For n≥ 70, minimum mean-square curvature implies isolation of pentagons, which is the strongest indicator of stability for a bare fullerene. PMID:26283188

  18. Laser controlled magnetism in hydrogenated fullerene films

    SciTech Connect

    Makarova, Tatiana L.; Shelankov, Andrei L.; Kvyatkovskii, Oleg E.; Zakharova, Irina B.; Buga, Sergei G.; Volkov, Aleksandr P.

    2011-04-15

    Room temperature ferromagnetic-like behavior in fullerene photopolymerized films treated with monatomic hydrogen is reported. The hydrogen treatment controllably varies the paramagnetic spin concentration and laser induced polymerization transforms the paramagnetic phase to a ferromagnetic-like one. Excess laser irradiation destroys magnetic ordering, presumably due to structural changes, which was continuously monitored by Raman spectroscopy. We suggest an interpretation of the data based on first-principles density-functional spin-unrestricted calculations which show that the excess spin from mono-atomic hydrogen is delocalized within the host fullerene and the laser-induced polymerization promotes spin exchange interaction and spin alignment in the polymerized phase.

  19. Model-independent test of the truncated crater function theory of surface morphology evolution during ion bombardment

    NASA Astrophysics Data System (ADS)

    Perkinson, Joy C.; Anzenberg, Eitan; Aziz, Michael J.; Ludwig, Karl F.

    2014-03-01

    A broad class of "local response" theories seeks to predict morphology evolution during energetic particle irradiation in terms of average surface height response to individual impacts—an approach that has been generalized by the crater function formalism of Norris et al. [J. Phys.: Condens. Matter 21, 224017 (2009), 10.1088/0953-8984/21/22/224017; Nat. Commun. 2, 276 (2011), 10.1038/ncomms1280]. Keeping only the terms in the crater function formalism associated with the response of a flat surface has facilitated the use of molecular dynamics simulations of individual ion impacts to predict the stability or instability of a flat surface to ion bombardment. Here we report a sensitive experimental test of this truncated crater function theory that is independent of any a priori knowledge of the crater function itself. Existing measurements for 1 keV Ar+/Si and Kr+/Ge are inconsistent with the predictions of truncated crater function theory, for any conceivable crater function, at high bombardment angles. The failure of the theory suggests that the prediction of surface evolution from simulations of single-ion impacts will be more challenging than had been assumed.

  20. ENHANCEMENT OF THE 6.4 keV LINE IN THE INNER GALACTIC RIDGE: PROTON-INDUCED FLUORESCENCE?

    SciTech Connect

    Nobukawa, K. K.; Nobukawa, M.; Tsuru, T. G.; Tanaka, T.; Koyama, K.; Uchiyama, H.; Torii, K.; Fukui, Y.; Chernyshov, D. O.; Dogiel, V. A.

    2015-07-01

    A common idea for the origin of the Galactic diffuse X-ray emission, particularly that of the iron lines from neutral and highly ionized atoms, is a superposition of many cataclysmic variables and coronally active binaries. In this scenario, the flux should symmetrically distribute between the east and west on the plane with respect to Sagittarius A* because the stellar mass distribution determined by infrared observations is nearly symmetric. This symmetry is confirmed for the highly ionized iron line as well as the continuum emission. However, a clear excess of the neutral iron line in the near east of the Galactic center compared to the near-west side is found. The flux distribution of the excess emission well correlates with the molecular column density. The X-ray spectrum of the excess emission is described by a power-law continuum plus a 6.4 keV line with a large equivalent width of ∼1.3 keV, which is hardly explained by the low-energy electron bombardment scenario. The longitudinal and latitudinal distribution of the excess emission disfavors the X-ray irradiation, either by Sagittarius A* or by nearby X-ray binaries. Then, the low-energy proton bombardment is the most probable origin, although the high-energy density ∼80 eV cm{sup −3} in 0.1–1000 MeV is required and there is no conventional proton source in the vicinity.

  1. Influence of particle bombardment on microstructure and internal stresses of refractory metal suicides on silicon

    NASA Astrophysics Data System (ADS)

    Hardtke, Ch.; Schilling, W.; Ullmaier, H.

    1991-07-01

    First results on microstructural changes and stress relaxation in thin refractory metal suicide films (TaSi 2 and MoSi 2) caused by particle bombardment are reported. The polycrystalline films had initial tensile stresses of some 10 9 Pa. Exposed to irradiation with Ge ions of 400 keV, both suicides showed a similar stress relaxation behaviour as a function of dose. During room-temperature implantation the initial tensile stress rapidly decreased and turned into compressive stress. Continuous irradiation partly relaxed the compressive stress and resulted in a saturation value of some -10 8 Pa. With increasing implantation temperature, the buildup of compressive stress gradually vanished, leaving only the initial decrease of tensile stress which finally approached zero. Based on microstructural investigations (TEM and X-ray diffraction) it is proposed to explain this behaviour by the combined action of two processes: relaxation of tensile stress by a volume increase due to irradiation-induced amorphization, and Frenkel defect production and relaxation of compressive stress by irradiation-induced densification of amorphous regions and/or Frenkel defect elimination.

  2. Stress relaxation in unirradiated and in helium ion bombarded glass plates: Dimensional stability

    SciTech Connect

    Primak, W.

    1984-02-15

    The deformation of thin glass plates during bombardment with 140-keV He/sup +/ ions was measured with an external capacitor. The contour of the plates was determined interferometrically before irradiation, after irradiation, and after aging for several years. These results showed that the calibration of the capacitor equipment by dead-weight loading a silica plate was faulty. The deflection of a vitreous silica free cantilever on dead-weight loading was measured interferometrically, and the results showed that deformation occurred within the clamp. It was confirmed that placing a ground shield about the electrode of the capacitor increases the calculated deflections. Data for the permanent deformation of a stressed plate of vitreous silica are analyzed, and it is concluded that stress relaxation by a bulk viscoelastic deformation cannot be detected by a change in plate contour because the maximum precision for such a determination could not detect apparent viscosities greater than approx.10/sup 29/ P. The stress relaxation of the irradiated vitreous silica plates was about 10% in three years corresponding to an apparent post-irradiation viscosity of approx.10/sup 20/ P. The stress relaxations observed for the other glasses, Pyrex, BK7, and LF2 were much greater, and it is uncertain to what extent they were a viscoelastic effect or an annealing effect. The behavior of a sample of a facsimile radioactive waste storage glass, 76--68 indicated it was not a uniform product; the contour became irregular; hence, these techniques were not appropriate for it.

  3. Intravenous coronary angiography utilizing K-emission and bremsstrahlung X-rays produced by electron bombardment

    SciTech Connect

    1992-12-31

    The screening of the general population for coronary artery disease would be practical if a method existed for visualizing the extent of occlusion after an intravenous injection of contrast agent. Measurements performed with synchrotron radiation at SSRL and NSLS have shown that such an intravenous angiography procedure would be possible with an intense source of monochromatic X-rays. Because of the high cost of an electron synchrotron, theoretical analysis and experiments using inanimate phantoms has been undertaken to demonstrate the feasibility of using the spectrum produced by two appropriately chosen anode materials when bombarded with electrons in the 100--500 keV energy range for angiography. By using the X-rays emitted at 120{degree} to the incident electron direction, about 20--30% of the X-ray intensity would be due to K-emission lines. Calculations using the TIGERP Monte Carlo Code, have shown that high quality angiograms of human coronary arteries should be possible with a contrast agent containing ytterbium, if an electron beam pulses of 16 kJ were used for each anode target. The experimental program supported in part by the DOE has consisted of these theoretical calculations and experiments at the Dynamitron Electron Accelerator Facility at BNL.

  4. Generation of singlet oxygen with the use of optically excited fullerenes and fullerene-like nanoparticles

    NASA Astrophysics Data System (ADS)

    Danilov, O. B.; Belousova, I. M.; Mak, A. A.; Belousov, V. P.; Grenishin, A. S.; Kiselev, V. M.; Kris'ko, A. V.; Ponomarev, A. N.; Sosnov, E. N.

    2003-12-01

    Experimental results and a kinetic model of generation of singlet oxygen during the interaction of oxygen molecules with optically pumped (lamp or laser radiation) fullerenes or fullerene-like nanoclusters in solutions, suspensions, and the form of various solid-phase membranes (surfaces) are presented. The experimental data on the photoluminescence of singlet oxygen in solutions of fullerenes are compared with the results of numerical simulation on the basis of the kinetic model with specified constants of photochemical processes. On the basis of the experimental results, it is shown that evaporation of a solution caused by pumping radiation yields long-lived gas-phase singlet oxygen. Release of gas-phase singlet oxygen from solid-phase fullerene-containing membranes (surfaces) is also demonstrated; however, this process is hindered by adsorption of singlet oxygen on the membrane surface. The prospects for creation of a singlet-oxygen generator on the basis of photoexcited fullerene molecules and fullerene-like nanoclusters are discussed.

  5. O+ bombardment of an O and O2 Thermosphere

    NASA Astrophysics Data System (ADS)

    McKeown, M.; Johnson, R. E.

    2000-10-01

    Ejection of atoms and molecules from the atmosphere of Mars is caused by energetic O+ pickup-ion bombardment [Luhmann et al, 1992; Jakosky et al.,1994], a process referred to as atmospheric sputtering. This process also occurs on other bodies which have molecules at the exobase such as Europa and Titan. Using a Monte Carlo procedure we calculate the rate of ejection of particles from a model thermosphere composed of O and O2 which is bombarded by energetic O+. To allow for dissociation of O2, collisions between high energy O atoms and O2 molecules are treated using classical molecular dynamics with semi-empirical interaction potentials. O + O collisions are treated with the magic formula method of Zeigler et al.,1985. The effect of molecular binding on the atmospheric sputtering yield is examined.

  6. Miniature electron bombardment evaporation source: evaporation rate measurement

    NASA Astrophysics Data System (ADS)

    Nehasil, V.; Mašek, K.; Moreau, O.; Matolín, V.

    1997-03-01

    Miniature electron beam evaporation sources which operate on the principle of vaporization of source material, in the form of a tip, by electron bombardment are produced by several companies specialised in UHV equipment. These sources are used primarily for materials that are normally difficult to deposit due to their high evaporation temperature. They are appropriate for special applications, like heteroepitaxial thin films growth that require very low and well controlled deposition rate. We propose a simple and easily applicable method of evaporation rate control. The method is based on the measurement of ion current produced by electron bombardment of evaporated atoms. In order to be able to determine the ion current - evaporation flux calibration curves we measured the absolute values of evaporation flux by means of Bayard-Alpert ion gauge.

  7. Hydrogen recycling control by helium ion bombardment onto carbonized surfaces

    NASA Astrophysics Data System (ADS)

    Sugai, H.; Toyoda, H.; Ohshita, S.; Yoshida, S.; Sagara, A.

    1989-04-01

    A strong pumping effect was observed in a hydrogen recycling simulation experiment in a carbonized toroidal device at room temperature. The pumping effect was induced by conditioning the carbon-thin-film deposited wall with a short (~10 min) helium glow discharge. A large amount of hydrogen (~10 16cm-2) was desorbed from carbon films with helium ion bombardment at 200 eV. After conditioning, the recycling coefficient was drastically reduced from about 2 to a value close to zero. Furthermore, an advanced (multilayer) coating was developed with use of helium ion induced desorption, where a short burst of methane was admixed at regular intervals in a helium glow discharge. A fairly large wall pumping was realized by the multilayer coating when the thickness of each layer and the helium bombarding time were optimized.

  8. Monitoring of Aqueous Fullerene Dispersions by Thermal-Lens Spectrometry

    NASA Astrophysics Data System (ADS)

    Mikheev, I. V.; Volkov, D. S.; Proskurnin, M. A.; Korobov, M. V.

    2015-06-01

    Aqueous fullerene solutions (dispersions) are very promising materials of biomedicine and biotechnology. Of importance are the traceability of their production and characterization of their optical and colloidal properties. Thermal-lens spectrometry, as a method suitable for both optical and thermophysical studies, was used to elucidate the forms of non-modified fullerenes in their aqueous dispersions and to determine low concentrations of and fullerenes. It was shown that the residual amounts of toluene in aqueous fullerene dispersions made according to the solvent-exchange protocol could be detected by thermal lensing. As a result, the technique for the production of aqueous fullerene dispersions was improved compared to the existing data providing higher fullerene concentrations. The limits of detection of and fullerenes are approximately , which are 20-fold lower compared to conventional spectrophotometry. The distinction between aqueous fullerene dispersions in comparison with organic solutions of fullerenes caused by the formation of large clusters is shown by the comparison of transient and steady-state calibration curves for aqueous and organic fullerene solutions and model reference systems under various thermal-lens excitation conditions. The advantages of thermal lensing for such colloidal systems are discussed.

  9. Photodynamics of nonlinear fullerene-containing media

    NASA Astrophysics Data System (ADS)

    Belousova, Inna M.; Belousov, Vlidilen P.; Danilov, Oleg B.; Grigor'ev, Vladimir A.; Kalintsev, Alexander G.; Zgonnik, V. N.; Kamanina, Natalia V.; Zhevlakov, Aleksandr P.; Kris'ko, A. V.; Mironova, N. G.; Sosnov, Eugene N.; Gavronskaya, E. A.; Smirnov, V. A.; Yur'ev, Michail S.; Ponomarev, Alexander N.; Yashin, Vladimir E.

    2001-03-01

    The results of theoretical and experimental studies on photodynamics and mechanism of nonlinear optical processes, responsible for optical limiting of power radiation in the wavelength range from 0.3 to 1.3 microns, are presented. Peculiarities in the mechanisms of optical limiting for different fullerene-containing matrices, including solutions, solid-state and polymer systems, are shown.

  10. Manipulation of fullerene molecules on graphene

    NASA Astrophysics Data System (ADS)

    Glukhova, O. E.; Mitrofanov, V. V.; Slepchenkov, M. M.; Shunaev, V. V.

    2015-03-01

    Due to the increasing demand for functionalization of graphene and its application as a functional element of real electronic and / or mechanical devices, as well as due to its unique adhesive and sensory abilities the actual problem is the use of graphene as a substrate on which the assembly of supramolecular structures. Elements of such structures can be different molecules driven by external factors, and can be easily transported on graphene. These molecules primarily include miniature spheroidal fullerenes easy to navigate on the surface of graphene, in particular icosahedral C60. The aim of this work was to find an effective method of manipulation of fullerene C60 on graphene. As such method we proposed to introduce in graphene sheet structural defect of the atomic framework namely defect Stone-Wales (pentagon-heptagon pairs). Another structural defect studied in this paper is adsorbed on the Stone-Wales defect hydrogen atom. Molecular dynamics and tight binding method were applied to calculate the location of the molecule C60 on graphene sheet and its movement. To identify the regulatities of behavior of fullerene on graphene sheet we carried out a series of numerical experiments at different temperatures. In this paper we calculated the energy profile of interaction between fullerene and graphene sheet. Obtained results showed that forming on the surface of the graphene sheet defects in a certain way, one can control the trajectory of molecules on graphene.

  11. C60 fullerene binding to DNA

    NASA Astrophysics Data System (ADS)

    Alshehri, Mansoor H.; Cox, Barry J.; Hill, James M.

    2014-09-01

    Fullerenes have attracted considerable attention in various areas of science and technology. Owing to their exceptional physical, chemical, and biological properties, they have many applications, particularly in cosmetic and medical products. Using the Lennard-Jones 6-12 potential function and the continuum approximation, which assumes that intermolecular interactions can be approximated by average atomic surface densities, we determine the binding energies of a C60 fullerene with respect to both single-strand and double-strand DNA molecules. We assume that all configurations are in a vacuum and that the C60 fullerene is initially at rest. Double integrals are performed to determine the interaction energy of the system. We find that the C60 fullerene binds to the double-strand DNA molecule, at either the major or minor grooves, with binding energies of -4.7 eV or -2.3 eV, respectively, and that the C60 molecule binds to the single-strand DNA molecule with a binding energy of -1.6 eV. Our results suggest that the C60 molecule is most likely to be linked to the major groove of the dsDNA molecule.

  12. Fullerenes and Fulleranes in Meteorites Revisited

    NASA Astrophysics Data System (ADS)

    Heymann, Dieter

    1997-11-01

    Fullerenes C60 and C70 and the fullerane C60H2 were not found in the toluene extract from 200 g of the C3V carbonaceous chondrite Allende by high-performance liquid chromatography (HPLC). Two distinct substances in the HPLC chromatogram of the extract, called Aα and Aβ, were found to have absorption spectra in the wavelength range 300-650 nm similar in shape to that of C60. The HPLC chromatograms of Aα and Aβ show conclusively that Aα and Aβ are not C60, C70, C60O, or C60H2. The mass spectrometric analysis shows that Aα and Aβ do not contain any fullerene derivatives in the mass range 722 to 800. However, Aβ may contain corannulene (C20H10), a suggested precursor in the formation of C60 by condensation of carbon vapor. The discrepancy between the results of Becker et al. and Heymann remains essentially unresolved, but the probability of finding fullerenes or fulleranes in samples of the Allende, or other meteorites, has now become very small. The implications of the new results for theories of fullerene and fullerane formation in stellar and interstellar media are that these substances, if they formed in such environments, apparently were destroyed in the interstellar cloud from which the solar system formed, did not survive the formation of the solar system, or did not survive the formation of meteorites.

  13. COANP-fullerenes system for optical modulation

    NASA Astrophysics Data System (ADS)

    Likhomanova, S. V.; Kamanina, N. V.

    2016-08-01

    The advanced investigations of ϕ-conjugated organic molecule COANP sensitized with fullerenes have been revealed to consider this system as an affective medium for optical limiting and phase modulation. The special accent has been given to influence of the nanostructured relief at the interface on the spectral and photoconductive features.

  14. Synthetic chemistry with fullerenes. Photooxygenation of olefins

    SciTech Connect

    Tokuyama, Hidetoshi; Nakamura, Eiichi

    1994-03-11

    Under irradiation with visible or UV (>290 nm) light in the presence of molecular oxygen and a minute amount of fullerenes, olefins and dienes undergo ene and Diels-Alder reactions with singlet oxygen to give photooxygenation products. The regio-and stereoselectives of the photooxygenation of {beta}-myrcene, (+)-pulegone, 4-methylpent-3-en-2-ol, and (+)-limonene were very similiar to those observed in known singlet oxygen reactions, indicating that the fullerene-sensitized reaction generates free singlet oxygen. The efficiency of fullerenes and conventional sensitizers was qualitively examined by using the Diels-Alder reaction between {sup 1}O{sub 2} and furan-2-carboxylic acid as a probe. Among those examined, C{sub 70} was found to be the most effective. The reaction was the fastest and completed with as little as 0.0001 equiv of C{sub 70}. C{sub 60} and hematoporphyrin were found to be of similiar efficiency. The methanofullerene 13, which lacks one olefinic conjunction in the C{sub 60} core, was as good as C{sub 60} itself, but the aminofullerene 14, lacking six double bonds, was quite inferior. The fullerene carboxylic acid 15, which was previously shown to show considerable biochemical activity, was found to be capable of generating singlet oxygen in aqueous DMSO. 25 refs., 1 tab.

  15. Arranging pseudorotaxanes octahedrally around 60 fullerene

    SciTech Connect

    Dey, Sanjeev K.; Beurele, Florian; Olson, Mark A.; Stoddart, J. Fraser

    2010-01-01

    The formation of both [2]- and [7]pseudorotaxanes, which are obtained by mixing of a dibenzylammonium derivative with mono- and hexakis-adducts of [60]fullerene bearing malonato-benzo[25]crown-8 rings, has been monitored in dichloromethane by both 1D and 2D ¹H NMR spectroscopies.

  16. Fullerene nanoarchitectonics: from zero to higher dimensions.

    PubMed

    Shrestha, Lok Kumar; Ji, Qingmin; Mori, Taizo; Miyazawa, Kun'ichi; Yamauchi, Yusuke; Hill, Jonathan P; Ariga, Katsuhiko

    2013-08-01

    The strategic design of nanostructured materials, the properties of which could be controlled across different length scales and which, at the same time, could be used as building blocks for the construction of devices and functional systems into new technological platforms that are based on sustainable processes, is an important issue in bottom-up nanotechnology.Such strategic design has enabled the fabrication of materials by using convergent bottom-up and top-down strategies. Recent developments in the assembly of functional fullerene (C60) molecules, either in bulk or at interfaces, have allowed the production of shape-controlled nano-to-microsized objects that possess excellent optoelectronic properties, thus enabling the fabrication of optoelectronic devices. Because fullerene molecules can be regarded as an ideal zero-dimensional (0D) building units with attractive functions, the construction of higher-dimensional objects, that is, 1D, 2D, and 3D nanomaterials may realize important aspects of nanoarchitectonics. This Focus Review summarizes the recent developments in the production of nanostructured fullerenes and techniques for the elaboration of fullerene nanomaterials into hierarchic structures.

  17. Lifetime measurement of the 167.1 keV state in {sup 41}Ar

    SciTech Connect

    White, E. R.; Mach, H.; Fraile, L. M.; Koester, U.; Arndt, O.; Blazhev, A.; Braun, N.; Fransen, C.; Jolie, J.; Boelaert, N.; Borge, M. J. G.; Boutami, R.; Reillo, E.-M.; Tengblad, O.; Bradley, H.; Dlouhy, Z.; Ugryumov, V.; Fynbo, H. O. U.; Hinke, Ch.; Kroell, T.

    2007-11-15

    The Advanced-Time-Delayed method was used to measure lifetimes of the states in {sup 41}Ar populated in the {beta} decay of {sup 41}Cl. The nuclei {sup 41}Cl were produced at ISOLDE by 1.4-GeV proton bombardment of a thick UC{sub x} target and mass-separated as molecular ions, XeCl{sup +}. Our measured half-life of the 167.1-keV state, T{sub 1/2}=315(15) ps, is significantly lower than the previously measured value of 410(30) ps. We have also determined T{sub 1/2}=260(80) ps and T{sub 1/2}{<=}46 ps for the 515.9- and 1867.7-keV states, respectively. These are the shortest lifetimes measured so far with the ultrafast timing method using the new LaBr{sub 3}(Ce) crystals for {gamma}-ray detection.

  18. Estimation of sputtering rate by bombardment with argon gas ions

    NASA Astrophysics Data System (ADS)

    Okajima, Yoshiaki

    1980-01-01

    The sputtering rates of single-crystal Si and polycrystalline Ag, Cu, Ni, Ti, and Al were measured. These target materials were bombarded with argon ions accelerated at 10 kV. The sputtered depth after a given interval of bombardment was greatest for Ag, and decreased for the other materials in the following order: Cu, Ni, Ti, Si, and Al. The difference in the sputtering rates of these target materials was investigated on the basis of their binding energies, and the following expression for sputtering rate was obtained experimentally, Sr=K (I/D)(M/Ec)k, where Sr is the sputtering rate, I is the current density of incident argon ions, and D, M, and Ec are the atomic concentration, mass number, and cohesive energy of a target material, respectively. K and k are constants. Sputtering yield (Sy) can be written Sy=K' (M/Ec)k. The result was compared with experimental data of many target materials already reported. These results were used to estimate the sputtered depth after a given interval in the practical analyses using ion bombardment.

  19. Gene transfer into mammalian cells by particle bombardment.

    PubMed

    Heiser, W C

    1994-03-01

    Using COS-7 and Chinese hamster ovary cells as model systems, I have examined the efficiency of gene transfer into mammalian cells by particle bombardment. The most important parameters affecting transformation efficiency are the size of the particles, the target distance, and the extent of chamber vacuum. The size of the cell culture plate also affects transformation efficiency. Factors which have little effect on transformation efficiency are the helium pressure, the gap distance, and the macrocarrier travel distance. Compared to several other gene transfer techniques, particle bombardment has the advantage of requiring a low amount of DNA and a low number of cells for successful expression, measured as either transient or stable. I also describe transformation of several murine cell lines which have not been successfully transformed, or have been transformed at only low levels using other methods. These cell lines include preadipocytes (BMS-2), macrophages (J774), and transformed pre-B cells (38B9 and 70Z/3). Compared to transformation by electroporation, lipofection, and diethylaminoethyl dextran, particle bombardment was found to give 50- to 240-fold higher levels of transient expression as measured by luciferase activity in cell extracts. PMID:8203746

  20. Search for fullerenes in stone meteorites

    NASA Astrophysics Data System (ADS)

    Oester, M. Y.; Kuechl, D.; Sipiera, P. P.; Welch, C. J.

    1994-07-01

    The possibility of identifying fullerenes in stony meteorites became apparent from a paper given by Radicati de Brozolo. In this paper it was reported that fullerenes were present in the debris resulting from a collision between a micrometeoroid and an orbiting satellite. This fact generated sufficient curiosity to initiate a search for the presence of fullerenes in various stone meteorites. In the present study seven ordinary chondrites (al-Ghanim L6 (find), Dimmitt H4 (find), Lazbuddie LL5 (find), New Concord H5 (fall), Silverton H4 (find), Springlake L6 (find), and Umbarger L3/6 (find)). Four carbonaceous chondrites (ALH 83100 C2 (find), ALH 83108 C30 (find), Allende CV3 (fall), and Murchison CM2 (fall), and one achondrite (Monticello How (find)) were analyzed for the presence of fullerenes. The analytical procedure employed was as follows: 100 mg of meteorite was ground up with a mortar and pestle; 10 mL of toluene was then added and the mixture was refluxed for 90 min; this mixture was then filtered through a short column of silica; a 50 microliter sample was then analyzed by high pressure liquid chromatography (HPLC) using a Buckyclutcher I column with a mobile phase consisting of equal volumes of toluene and hexane at a flow rate of 1.00 mg per minute, with detection at 330 and 600 nm. Three of the meteorites, Allende, Murchison, and al-Ghanim, gave HPLC traces containing peaks with similar retention times to the HPLC trace of an authentic fullerene C60. However, further analysis using an HPLC instrument equipped with a diode-array detector failed to confirm any of the substances detected in the three meteorites as C60. Additional analyses will be conducted to identify what the HPLC traces actually represent.

  1. Nanoscale surface structuring during ion bombardment of elemental semiconductors

    NASA Astrophysics Data System (ADS)

    Anzenberg, Eitan

    2013-01-01

    Nano-patterning of surfaces with uniform ion bombardment yields a rich phase-space of topographic patterns. Particle irradiation can cause surface ultra-smoothing or self-organized nanoscale pattern formation in surface topography. Topographic pattern formation has previously been attributed to the effects of the removal of target atoms by sputter erosion. In this thesis, the surface morphology evolution of Si(100) and Ge(100) during low energy ion bombardment of Ar+ and Kr+ ions, respectively, is studied. Our facilities for studies of surface processes at the National Synchrotron Light Source (NSLS) allow in-situ characterization of surface morphology evolution during ion bombardment using grazing incidence small angle x-ray scattering (GISAXS). This technique is used to measure in reciprocal space the kinetics of formation or decay of correlated nanostructures on the surface, effectively measuring the height-height correlations. A linear model is used to characterize the early time kinetic behavior during ion bombardment as a function of ion beam incidence angle. The curvature coefficients predicted by the widely used erosive model of Bradley and Harper are quantitatively negligible and of the wrong sign when compared to the observed effect in both Si and Ge. A mass-redistribution model explains the observed ultra-smoothing at low angles, exhibits an instability at higher angles, and predicts the observed 45° critical angle separating these two regimes in Si. The Ge surface evolution during Kr+ irradiation is qualitatively similar to that observed for Ar+ irradiation of Si at the same ion energy. However, the critical angle for Ge cannot be quantitatively reproduced by the simple mass redistribution model. Crater function theory, as developed by Norris et al., incorporates both mass redistributive and erosive effects, and predicts constraining relationships between curvature coefficients. These constraints are compared to experimental data of both Si and Ge

  2. Fullerenes: An extraterrestrial carbon carrier phase for noble gases

    PubMed Central

    Becker, Luann; Poreda, Robert J.; Bunch, Ted E.

    2000-01-01

    In this work, we report on the discovery of naturally occurring fullerenes (C60 to C400) in the Allende and Murchison meteorites and some sediment samples from the 65 million-year-old Cretaceous/Tertiary boundary layer (KTB). Unlike the other pure forms of carbon (diamond and graphite), fullerenes are extractable in an organic solvent (e.g., toluene or 1,2,4-trichlorobenzene). The recognition of this unique property led to the detection and isolation of the higher fullerenes in the Kratschmer/Huffmann arc evaporated graphite soot and in the carbon material in the meteorite and impact deposits. By further exploiting the unique ability of the fullerene cage structure to encapsulate and retain noble gases, we have determined that both the Allende and Murchison fullerenes and the KTB fullerenes contain trapped noble gases with ratios that can only be described as extraterrestrial in origin. PMID:10725367

  3. Fullerenes: an extraterrestrial carbon carrier phase for noble gases.

    PubMed

    Becker, L; Poreda, R J; Bunch, T E

    2000-03-28

    In this work, we report on the discovery of naturally occurring fullerenes (C60 to C400) in the Allende and Murchison meteorites and some sediment samples from the 65 million-year-old Cretaceous/Tertiary boundary layer (KTB). Unlike the other pure forms of carbon (diamond and graphite), fullerenes are extractable in an organic solvent (e.g., toluene or 1,2,4-trichlorobenzene). The recognition of this unique property led to the detection and isolation of the higher fullerenes in the Kratschmer/Huffmann arc evaporated graphite soot and in the carbon material in the meteorite and impact deposits. By further exploiting the unique ability of the fullerene cage structure to encapsulate and retain noble gases, we have determined that both the Allende and Murchison fullerenes and the KTB fullerenes contain trapped noble gases with ratios that can only be described as extraterrestrial in origin.

  4. Structure property relationships for the nonlinear optical response of fullerenes

    NASA Astrophysics Data System (ADS)

    Rustagi, Kailash C.; Ramaniah, Lavanya M.; Nair, Selvakumar V.

    1994-11-01

    We present a phenomenological theory of nonlinear optical response of fullerenes. An empirical tight-binding model is used in conjunction with a classical electromagnetic picture for the screening. Since in bulk media such a picture of screening corresponds to the self- consistent field approach, the only additional approximation involved in our approach is the neglect of nonlocality. We obtain reliable estimates for the linear and nonlinear susceptibilities of C60, C70, C76 and other pure carbon fullerenes and also substituted fullerenes. The relatively large values of (beta) that we obtain for C76 and substituted fullerenes appear promising for the development of fullerene-based nonlinear optical materials. Our phenomenological picture of screening provides a good understanding of the linear absorption spectra of higher fullerenes and predicts that a comparison of the one-photon and multi-photon spectra will provide an insight into screening effects in these systems.

  5. Biological activities of water-soluble fullerene derivatives

    NASA Astrophysics Data System (ADS)

    Nakamura, S.; Mashino, T.

    2009-04-01

    Three types of water-soluble fullerene derivatives were synthesized and their biological activities were investigated. C60-dimalonic acid, an anionic fullerene derivative, showed antioxidant activity such as quenching of superoxide and relief from growth inhibition of E. coli by paraquat. C60-bis(7V,7V-dimethylpyrrolidinium iodide), a cationic fullerene derivative, has antibacterial activity and antiproliferative effect on cancer cell lines. The mechanism is suggested to be respiratory chain inhibition by reactive oxygen species produced by the cationic fullerene derivative. Proline-type fullerene derivatives showed strong inhibition activities on HIV-reverse transcriptase. The IC50 values were remarkably lower than nevirapine, a clinically used anti-HIV drug. Fullerene derivatives have a big potential for a new type of lead compound to be used as medicine.

  6. Fullerene-based materials research and development. LDRD final report

    SciTech Connect

    Cahill, P A; Henderson, C C; Rohlfing, C M; Loy, D A; Assink, R A; Gillen, K T; Jacobs, S J; Dugger, M T

    1995-05-01

    The chemistry and physical properties of fullerenes, the third, molecular allotrope of carbon, have been studied using both experimental and computational techniques. Early computational work investigated the stability of fullerene isomers and oxides, which was followed by extensive work on hydrogenated fullerenes. Our work led to the first synthesis of a polymer containing C{sub 60} and the synthesis of the simplest hydrocarbon derivatives of C{sub 60} and C{sub 70}. The excellent agreement between theory and experiment ({plus_minus} 0.1 kcal/mol in the relative stability of isomers) has provided insight into the chemical nature of fullerenes and has yielded a sound basis for prediction of the structure of derivatized fullerenes. Such derivatives are the key to the preparation of fullerene-based materials.

  7. Memory operation mechanism of fullerene-containing polymer memory

    SciTech Connect

    Nakajima, Anri Fujii, Daiki

    2015-03-09

    The memory operation mechanism in fullerene-containing nanocomposite gate insulators was investigated while varying the kind of fullerene in a polymer gate insulator. It was cleared what kind of traps and which positions in the nanocomposite the injected electrons or holes are stored in. The reason for the difference in the easiness of programming was clarified taking the role of the charging energy of an injected electron into account. The dependence of the carrier dynamics on the kind of fullerene molecule was investigated. A nonuniform distribution of injected carriers occurred after application of a large magnitude programming voltage due to the width distribution of the polystyrene barrier between adjacent fullerene molecules. Through the investigations, we demonstrated a nanocomposite gate with fullerene molecules having excellent retention characteristics and a programming capability. This will lead to the realization of practical organic memories with fullerene-containing polymer nanocomposites.

  8. Electron Flux Models at GEO: 30 keV - 600 keV

    NASA Astrophysics Data System (ADS)

    Boynton, R.; Balikhin, M. A.; Sibeck, D. G.; Walker, S. N.; Ganushkina, N. Y.

    2015-12-01

    Forecast models are developed for the electron fluxes measured by the Magnetospheric Electron Detector (MagED) onboard the Geostationary Operational Environmental Satellite (GOES) 13. The models employ solar wind and geomagnetic indices as inputs to produce a forecast of the electron flux at Geostationary Earth Orbit (GEO) for five energy ranges from 30 keV - 600 keV. All of these models will be implemented in real time to forecast the electron fluxes on the PROGRESS project website (https://ssg.group.shef.ac.uk/progress2/html/index.phtml).

  9. Super-atom molecular orbital excited states of fullerenes.

    PubMed

    Johansson, J Olof; Bohl, Elvira; Campbell, Eleanor E B

    2016-09-13

    Super-atom molecular orbitals are orbitals that form diffuse hydrogenic excited electronic states of fullerenes with their electron density centred at the centre of the hollow carbon cage and a significant electron density inside the cage. This is a consequence of the high symmetry and hollow structure of the molecules and distinguishes them from typical low-lying molecular Rydberg states. This review summarizes the current experimental and theoretical studies related to these exotic excited electronic states with emphasis on femtosecond photoelectron spectroscopy experiments on gas-phase fullerenes.This article is part of the themed issue 'Fullerenes: past, present and future, celebrating the 30th anniversary of Buckminster Fullerene'.

  10. Protective Fullerene (C60) Packaging System for Microelectromechanical Systems Applications

    NASA Technical Reports Server (NTRS)

    Olivas, John D. (Inventor)

    2001-01-01

    The invention involves a method for locating the probe of a scanning tunneling micrograph a predetermined distance from its conducting surface, and specifically the deposition of a monolayer of fullerene C60 onto the conducting plate. The Fullerene C60 molecule is approximately spherical and a monolayer of fullerene has a thickness of one nanometer. By providing a monolayer of fullerene on the conducting surface and locating the probe on the surface of the monolayer, a distance of one nanometer can be established between the probe tip and the conducting surface.

  11. Higher fullerenes: Compositional analysis by EDXD and molecular dynamics

    SciTech Connect

    Carbone, Marilena; Gontrani, Lorenzo

    2014-06-19

    A carbon soot of higher fullerenes was studied by Energy Dispersive X-ray Diffraction (EDXD) aiming at defining the overall structure as accurately as possible to define the overall structure, without lengthy separation and purification procedures. EDXD pattern was compared with model curves obtained for single homogeneous fullerenes already crystallized and for the hypothesized C180. All fullerenes contribute to the overall experimental curve to different extents, with C96 giving the best agreement. The presence of even higher fullerenes is very likely, since the hypothesized C180 gives a very good match as well.

  12. Cyclobuteno[60]fullerenes as Efficient n-Type Organic Semiconductors.

    PubMed

    Reboredo, Silvia; Girón, Rosa M; Filippone, Salvatore; Mikie, Tsubasa; Sakurai, Tsuneaki; Seki, Shu; Martín, Nazario

    2016-09-12

    Cyclobuteno[3,4:1,2][60]fullerenes have been prepared in a straightforward manner by a simple reaction between [60]fullerene and readily available allenoates or alkynoates as organic reagents under basic and mild conditions. The chemical structure of the new modified fullerenes has been determined by standard spectroscopic techniques and confirmed by X-ray diffraction analysis. Some of these new fullerene derivatives exhibit a remarkable intrinsic electron mobility (determined by using flash-photolysis time-resolved microwave conductivity (FP-TRMC) measurements), which surpasses that of the well-known phenyl-C61-butyric acid methyl ester, thus behaving as promising n-type organic semiconductors. PMID:27554067

  13. Fullerene sugar balls: a new class of biologically active fullerene derivatives.

    PubMed

    Nierengarten, Iwona; Nierengarten, Jean-François

    2014-06-01

    Among the large variety of bioactive C60 derivatives, fullerene derivatives substituted with sugar residues, that is, glycofullerenes, are of particular interest. The sugar residues are not only solubilizing groups; their intrinsic biological properties also provide additional appealing features to the conjugates. The most recent advances in the synthesis and the biological applications of glycofullerenes are summarized in the present review article with special emphasis on globular glycofullerenes, that is, fullerene sugar balls, constructed on a hexa-substituted fullerene scaffold. The high local concentration of carbohydrates around the C60 core in fullerene sugar balls is perfectly suited to the binding of lectins through the "glycoside cluster effect", and these compounds are potential anti-adhesive agents against bacterial infection. Moreover, mannosylated fullerene sugar balls have shown antiviral activity in an Ebola pseudotyped infection model. Finally, when substituted with peripheral iminosugars, dramatic multivalent effects have been observed for glycosidase inhibition. These unexpected observations have been rationalized by the interplay of interactions involving the catalytic site of the enzyme and non-glycone binding sites with lectin-like abilities.

  14. A search for hydrogenated fullerenes in fullerene-containing planetary nebulae

    NASA Astrophysics Data System (ADS)

    Díaz-Luis, J. J.; García-Hernández, D. A.; Manchado, A.; Cataldo, F.

    2016-07-01

    Detections of C60 and C70 fullerenes in planetary nebulae (PNe) of the Magellanic Clouds and of our own Galaxy have raised the idea that other forms of carbon such as hydrogenated fullerenes (fulleranes like C60H36 and C60H18), buckyonions, and carbon nanotubes, may be widespread in the Universe. Here we present VLT/ISAAC spectra (R ∼⃒600) in the 2.9-4.1 µm spectral region for the Galactic PNe Tc 1 and M 1-20, which have been used to search for fullerene-based molecules in their fullerene-rich circumstellar environments. We report the non-detection of the most intense infrared bands of several fulleranes around ∼⃒3.4-3.6 μm in both PNe. We conclude that if fulleranes are present in the fullerene-containing circumstellar environments of these PNe, then they seem to be by far less abundant than C60 and C70. Our non-detections together with the (tentative) fulleranes detection in the proto-PN IRAS 01005+7910 suggest that fulleranes may be formed in the short transition phase between AGB stars and PNe but they are quickly destroyed by the UV radiation field from the central star.

  15. A search for hydrogenated fullerenes in fullerene-containing planetary nebulae

    NASA Astrophysics Data System (ADS)

    Díaz-Luis, J. J.; García-Hernández, D. A.; Manchado, A.; Cataldo, F.

    2016-05-01

    Detections of C60 and C70 fullerenes in planetary nebulae (PNe) of the Magellanic Clouds and of our own Galaxy have raised the idea that other forms of carbon, such as hydrogenated fullerenes (fulleranes like C60H36 and C60H18), buckyonions, and carbon nanotubes, may be widespread in the Universe. Here we present VLT/ISAAC spectra (R ~ 600) in the 2.9-4.1 μm spectral region for the Galactic PNe Tc 1 and M 1-20, which have been used to search for fullerene-based molecules in their fullerene-rich circumstellar environments. We report the non-detection of the most intense infrared bands of several fulleranes around ~3.4-3.6 μm in both PNe. We conclude that if fulleranes are present in the fullerene-containing circumstellar environments of these PNe, then they seem to be much less abundant than C60 and C70. Our non-detections, together with the (tentative) fulleranes detection in the proto-PN IRAS 01005+7910, suggest that fulleranes may be formed in the short transition phase between AGB stars and PNe, but they are quickly destroyed by the UV radiation field from the central star.

  16. Smoothening of internal phase boundaries by ion bombardment

    SciTech Connect

    Petersen, J.; Mayr, S.G.

    2005-08-01

    The impact of heavy-ion irradiation on the morphology of bilayers, which are composed of two immiscible metals, is investigated with the help of experiments and molecular-dynamics computer simulations. Using the model system Ag/Ni, our main focus lies on the interface roughness of the Ag/Ni phase boundary and its evolution in the course of ion bombardment. The mechanism which underlies these structural changes is identified as radiation-induced viscous flow--in combination with thermodynamic driving forces due to interface stress.

  17. Single impact crater functions for ion bombardment of silicon

    SciTech Connect

    Kalyanasundaram, N.; Ghazisaeidi, M.; Freund, J. B.; Johnson, H. T.

    2008-03-31

    The average effect of a single 500 eV incident argon ion on a silicon surface is studied using molecular dynamics simulations. More than 10{sup 3} ion impacts at random surface points are averaged for each of seven incidence angles, from 0 deg. to 28 deg. off normal, to determine a local surface height change function, or a crater function. The crater shapes are mostly determined by mass rearrangement; sputtering has a relatively small effect. Analytical fitting functions are provided for several cases, and may serve as input into kinetic Monte Carlo calculations or stability analyses for surfaces subjected to ion bombardment.

  18. Exploring the Early Bombardment of the Inner Solar System

    NASA Astrophysics Data System (ADS)

    Bottke, W.

    2014-04-01

    The early bombardment history of the Inner Solar System is recorded in a number of interesting places (e.g., the surprisingly high abundance of highly siderophile abundances found in the Earth, Moon, and Mars, the observed impact basins found on Mercury, the Moon and Mars, various properties of main belt asteroids and meteorites, etc.). To date, two dominant scenarios have been used to explain these constraints: (i) most impacts came from the tail end of a monotonically-decreasing impactor population created by planet formation processes, and (ii) most impacts were produced by a terminal cataclysm that caused a spike in the impactor flux starting ~4 Gy ago. Interestingly, using numerical studies linked to the available constraints, we find that both scenarios are needed to explain observations. For (i), we will show that leftover planetesimals from the terrestrial planet region were long-lived enough to hit various worlds long after the end of core formation. The record left behind can be used in interesting ways to probe the nature of terrestrial planet formation. For (ii), we will explore new applications of the so-called Nice model, which provides a plausible dynamical mechanism capable of creating a spike of comets/asteroid impactors. Our results suggest that many "late heavy bombardment" impactors came from an unexpected source, and that they possibly continued to hit Earth, Venus, and Mars well after basin formation terminated on the Moon. Interestingly, the history of the Hadean Earth (ca. 4.0-4.5 billion years ago) may be closely linked to this bombardment. With few known rocks older than ~3.8 Ga, the main constraints from this era come from ancient submillimeter zircon grains. Using our bombardment model, we will argue that the surface of the Hadean Earth was widely reprocessed by impacts through mixing and heating of its uppermost layers. This model not only may explains the Pb-Pb age distribution of ancient zircons but also the absence of most early

  19. Electron-bombarded CCD detectors for ultraviolet atmospheric remote sensing

    NASA Technical Reports Server (NTRS)

    Carruthers, G. R.; Opal, C. B.

    1983-01-01

    Electronic image sensors based on charge coupled devices operated in electron-bombarded mode, yielding real-time, remote-readout, photon-limited UV imaging capability are being developed. The sensors also incorporate fast-focal-ratio Schmidt optics and opaque photocathodes, giving nearly the ultimate possible diffuse-source sensitivity. They can be used for direct imagery of atmospheric emission phenomena, and for imaging spectrography with moderate spatial and spectral resolution. The current state of instrument development, laboratory results, planned future developments and proposed applications of the sensors in space flight instrumentation is described.

  20. Analysis of glycolipids by fast atom bombardment mass spectrometry.

    PubMed

    Bosch, M P; Parra, J L; Manresa, M A; Ventura, F; Rivera, J

    1989-12-01

    The positive and negative ion fast atom bombardment (FAB) mass spectra of four glycolipids obtained from microbial cultures are reported. The spectra of the glycolipids in the positive ion mode are characterized by abundant [M + Na]+, [M + Na + matrix]+ and [M + 2Na - H]+ species. In negative FAB conditions the molecules yield [M - H]-. Our understanding of the FAB behaviour of glycolipids in both positive and negative modes has been considerably aided in the structure elucidation, without any derivatization or degradation reaction of the compounds studied. The technique allows unambiguous molecular weight determination of low-microgram amounts of these glycolipids purified from biological sources and provides useful fragmentation information.

  1. Calix[4]arene-linked bisporphyrin hosts for fullerenes: binding strength, solvation effects, and porphyrin-fullerene charge transfer bands.

    PubMed

    Hosseini, Ali; Taylor, Steven; Accorsi, Gianluca; Armaroli, Nicola; Reed, Christopher A; Boyd, Peter D W

    2006-12-13

    A calix[4]arene scaffolding has been used to construct bisporphyrin ("jaws" porphyrin) hosts for supramolecular binding of fullerene guests. Fullerene affinities were optimized by varying the nature of the covalent linkage of the porphyrins to the calixarenes. Binding constants for C60 and C70 in toluene were explored as a function of substituents at the periphery of the porphyrin, and 3,5-di-tert-butylphenyl groups gave rise to the highest fullerene affinities (26,000 M(-1) for C60). The origin of this high fullerene affinity has been traced to differential solvation effects rather than to electronic effects. Studies of binding constants as a function of solvent (toluene < benzonitrile < dichloromethane < cyclohexane) correlate inversely with fullerene solubility, indicating that desolvation of the fullerene is a major factor determining the magnitude of binding constants. The energetics of fullerene binding have been determined in terms of DelatH and DeltaS and are consistent with an enthalpy-driven, solvation-dependent process. A direct relationship between supramolecular binding of a fullerene guest to a bisporphyrin host and the appearance of a broad NIR absorption band have been established. The energy of this band moves in a predictable manner as a function of the electronic structure of the porphyrin, thereby establishing its origin in porphyrin-to-fullerene charge transfer.

  2. Preparation of fullerene/glass composites

    DOEpatents

    Mattes, B.R.; McBranch, D.W.; Robinson, J.M.; Koskelo, A.C.; Love, S.P.

    1995-05-30

    Synthesis of fullerene/glass composites is described. A direct method for preparing solid solutions of C{sub 60} in silicon dioxide (SiO{sub 2}) glass matrices by means of sol-gel chemistry is described. In order to produce highly concentrated fullerene-sol-gel-composites it is necessary to increase the solubility of these ``guests`` in a delivery solvent which is compatible with the starter sol (receiving solvent). Sonication results in aggregate disruption by treatment with high frequency sound waves, thereby accelerating the rate of hydrolysis of the alkoxide precursor, and the solution process for the C{sub 60}. Depending upon the preparative procedure, C{sub 60} dispersed within the glass matrix as microcrystalline domains, or dispersed as true molecular solutions of C{sub 60} in a solid glass matrix, is generated by the present method.

  3. Preparation of fullerene/glass composites

    DOEpatents

    Mattes, Benjamin R.; McBranch, Duncan W.; Robinson, Jeanne M.; Koskelo, Aaron C.; Love, Steven P.

    1995-01-01

    Synthesis of fullerene/glass composites. A direct method for preparing solid solutions of C.sub.60 in silicon dioxide (SiO.sub.2) glass matrices by means of sol-gel chemistry is described. In order to produce highly concentrated fullerene-sol-gel-composites it is necessary to increase the solubility of these "guests" in a delivery solvent which is compatible with the starter sol (receiving solvent). Sonication results in aggregate disruption by treatment with high frequency sound waves, thereby accelerating the rate of hydrolysis of the alkoxide precursor, and the solution process for the C.sub.60. Depending upon the preparative procedure, C.sub.60 dispersed within the glass matrix as microcrystalline domains, or dispersed as true molecular solutions of C.sub.60 in a solid glass matrix, is generated by the present method.

  4. Transport of fullerene molecules along graphene nanoribbons

    PubMed Central

    Savin, Alexander V.; Kivshar, Yuri S.

    2012-01-01

    We study the motion of C60 fullerene molecules and short-length carbon nanotubes on graphene nanoribbons. We reveal that the character of the motion of C60 depends on temperature: for T < 150 K the main type of motion is sliding along the surface, but for higher temperatures the sliding is replaced by rocking and rolling. Modeling of the buckyball with an included metal ion demonstrates that this molecular complex undergoes a rolling motion along the nanoribbon with the constant velocity under the action of a constant electric field. The similar effect is observed in the presence of the heat gradient applied to the nanoribbon, but mobility of carbon structures in this case depends largely on their size and symmetry, such that larger and more asymmetric structures demonstrate much lower mobility. Our results suggest that both electorphoresis and thermophoresis can be employed to control the motion of carbon molecules and fullerenes. PMID:23259049

  5. Carbon and fullerene nanomaterials in plant system

    PubMed Central

    2014-01-01

    Both the functionalized and non functionalized carbon nanomaterials influence fruit and crop production in edible plants and vegetables. The fullerene, C60 and carbon nanotubes have been shown to increase the water retaining capacity, biomass and fruit yield in plants up to ~118% which is a remarkable achievement of nanotechnology in recent years. The fullerene treated bitter melon seeds also increase the phytomedicine contents such as cucurbitacin-B (74%), lycopene (82%), charantin (20%) and insulin (91%). Since as little as 50 μg mL−1 of carbon nanotubes increase the tomato production by about 200%, they may be exploited to enhance the agriculture production in future. It has been observed that, in certain cases, non functionalized multi-wall carbon nanotubes are toxic to both plants and animals but the toxicity can be drastically reduced if they are functionalized. PMID:24766786

  6. Thermoelectricity in fullerene-metal heterojunctions.

    PubMed

    Yee, Shannon K; Malen, Jonathan A; Majumdar, Arun; Segalman, Rachel A

    2011-10-12

    Thermoelectricty in heterojunctions, where a single-molecule is trapped between metal electrodes, has been used to understand transport properties at organic-inorganic interfaces. (1) The transport in these systems is highly dependent on the energy level alignment between the molecular orbitals and the Fermi level (or work function) of the metal contacts. To date, the majority of single-molecule measurements have focused on simple small molecules where transport is dominated through the highest occupied molecular orbital. (2, 3) In these systems, energy level alignment is limited by the absence of electrode materials with low Fermi levels (i.e., large work functions). Alternatively, more controllable alignment between molecular orbitals and the Fermi level can be achieved with molecules whose transport is dominated by the lowest unoccupied molecular orbital (LUMO) because of readily available metals with lower work functions. Herein, we report molecular junction thermoelectric measurements of fullerene molecules (i.e., C(60), PCBM, and C(70)) trapped between metallic electrodes (i.e., Pt, Au, Ag). Fullerene junctions demonstrate the first strongly n-type molecular thermopower corresponding to transport through the LUMO, and the highest measured magnitude of molecular thermopower to date. While the electronic conductance of fullerenes is highly variable, due to fullerene's variable bonding geometries with the electrodes, the thermopower shows predictable trends based on the alignment of the LUMO with the work function of the electrodes. Both the magnitude and trend of the thermopower suggest that heterostructuring organic and inorganic materials at the nanoscale can further enhance thermoelectric performance, therein providing a new pathway for designing thermoelectric materials. PMID:21882860

  7. Diamond films grown from fullerene precursors

    SciTech Connect

    Gruen, D.M.; Zuiker, C.D.; Krauss, A.R.

    1995-07-01

    Fullerene precursors have been shown to result in the growth of diamond films from argon microwave plasmas. In contradistinction to most diamond films grown using conventional methane-hydrogen mixtures, the fullerene-generated films are nanocrystalline and smooth on the nanometer scale. They have recently been shown to have friction coefficients approaching the values of natural diamond. It is clearly important to understand the development of surface morphology during film growth from fullerene precursors and to elucidate the factors leading to surface roughness when hydrogen is present in the chemical vapor deposition (CVD) gas mixtures. To achieve these goals, we are measuring surface reflectivity of diamond films growing on silicon substrates over a wide range of plasma processing conditions. A model for the interpretation of the laser interferometric data has been developed, which allows one to determine film growth rate, rms surface roughness, and bulk losses due to scattering and absorption. The rms roughness values determined by reflectivity are in good agreement with atomic force microscope (AFM) measurements. A number of techniques, including high-resolution transmission electron microscopy (HRTEM) and near-edge x-ray absorption find structure (NEXAFS) measurements, have been used to characterize the films. A mechanism for diamond-film growth involving the C{sub 2} molecule as a growth species will be presented. The mechanism is based on (1) the observation that the optical emission spectra of the fullerene- containing plasmas are dominated by the Swan bands of C{sub 2} and (2) the ability of C{sub 2} to insert directly into C-H and C-C bonds with low activation barriers, as shown by recent theoretical calculations of reactions of C{sub 2} with carbon clusters.

  8. PREFACE: Fullerene Nano Materials (Symposium of IUMRS-ICA2008)

    NASA Astrophysics Data System (ADS)

    Miyazawa, Kun'ichi; Fujita, Daisuke; Wakahara, Takatsugu; Kizuka, Tokushi; Matsuishi, Kiyoto; Ochiai, Yuichi; Tachibana, Masaru; Ogata, Hironori; Mashino, Tadahiko; Kumashiro, Ryotaro; Oikawa, Hidetoshi

    2009-07-01

    This volume contains peer-reviewed invited and contributed papers that were presented in Symposium N 'Fullerene Nano Materials' at the IUMRS International Conference in Asia 2008 (IUMRS-ICA 2008), which was held on 9-13 December 2008, at Nagoya Congress Center, Nagoya, Japan. Over twenty years have passed since the discovery of C60 in 1985. The discovery of superconductivity of C60 in 1991 suggested infinite possibilities for fullerenes. On the other hand, a new field of nanocarbon has been developed recently, based on novel functions of the low-dimensional fullerene nanomaterials that include fullerene nanowhiskers, fullerene nanotubes, fullerene nanosheets, chemically modified fullerenes, endohedral fullerenes, thin films of fullerenes and so forth. Electrical, electrochemical, optical, thermal, mechanical and various other properties of fullerene nanomaterials have been investigated and their novel and anomalous nature has been reported. Biological properties of fullerene nanomaterials also have been investigated both in medical applications and toxicity aspects. The recent research developments of fullerene nanomaterials cover a variety of categories owing to their functional diversity. This symposium aimed to review the progress in the state-of-the-art technology based on fullerenes and to offer the forum for active interdisciplinary discussions. 24 oral papers containing 8 invited papers and 22 poster papers were presented at the two-day symposium. Topics on the social acceptance of nanomaterials including fullerene were presented on the first day of the symposium. Biological impacts of nanomaterials and the importance of standardization of nanomaterials characterization were also shown. On the second day, the synthesis, properties, functions and applications of various fullerene nanomaterials were shown in both the oral and poster presentations. We are grateful to all invited speakers and many participants for valuable contributions and active discussions

  9. Synthesis of fullerene-acene dyads

    NASA Astrophysics Data System (ADS)

    Cho, Claire Eunhye

    Organic photovoltaic (OPV) cells present potential for industrial use because of their possible low cost production. However, their relatively low efficiencies render them impractical for implementation. A comprehensive understanding of the photophysical process is necessary for eventual development of high efficiency OPV cells. Studying photophysical processes of well-defined structures such as dyad or triad molecules may give insight into their photophysical processes. In this study, we selected pentacene derivatives as electron donors and fullerenes as electron acceptors for dyad and triad molecules with well-defined structures. Several new types of organothiosubstituted 6,13-dihydropentacenes with terminal functionality including carboxylic acid, alcohol and amine groups were synthesized. A sterically hindered pentacene derivative was also prepared in order to prevent cycloaddition between C60 and pentacene. Functionalized fullerenes were synthesized for use as electron acceptors. Numerous reaction methods were attempted toward the synthesis of a donor/acceptor dyad with pentacene and fullerene derivatives. However, hydroamination of pristine C 60 using a diamino dihydropentacene derivative was the only successful method demonstrated to link C60 and dihydropentacene derivatives.

  10. Structural motifs and the stability of fullerenes

    SciTech Connect

    Austin, S.J.; Fowler, P.W.; Manolopoulos, D.E.; Orlandi, G.; Zerbetto, F.

    1995-05-18

    Full geometry optimization has been performed within the semiempirical QCFF/PI model for the 1812 fullerene structural isomers of C{sub 60} formed by 12 pentagons and 20 hexagons. All are local minima on the potential energy hypersurface. Correlations of total energy with many structural motifs yield highly scattered diagrams, but some exhibit linear trends. Penalty and merit functions can be assigned to certain motifs: inclusion of a fused pentagon pair entails an average penalty of 111 kJ mol{sup -1}; a generic hexagon triple costs 23 kJ mol{sup -1}; a triple (open or fused) comprising a pentagon between two hexagonal neighbors gives a stabilization of 19 kJ mol{sup -1}. These results can be understood in terms of the curved nature of fullerene molecules: pentagons should be isolated to avoid sharp local curvature, hexagon triples are costly because they enforce local planarity and hence imply high curvature in another part of the fullerene surface, but hexagon-pentagon-hexagon triples allow the surface to distribute steric strain by warping. The best linear fit is found for H, the second moment of the hexagon-neighbor-index signature, which fits the total energies with a standard deviation of only 53 kJ mol{sup -1} and must be minimized for stability; this index too can be interpreted in terms of curvature. 26 refs., 5 figs.

  11. Dynamical Structures in Phase-Separated Films Deposited under Ion Bombardment

    SciTech Connect

    He, J. H.; Carosella, C. A.; Hubler, G. K.; Knies, D. L.; Qadri, S. B.; Grabowski, K. S.

    2009-03-10

    We report our experimental observation of ion bombardment effect on the film structures generated by co-evaporation of Au and silica. Three states are identified depending on the incident ion energy and beam current. Moderate ion bombardment creates nanoscale compositional modulations along the film growth direction. Strong ion bombardment induces disappearance of the compositional modulations. At still higher energy and flux, energetic ions sputter away all deposited atoms. The observed phenomena reflect synergistic effects of ion bombardment on the film growth in phase separated systems. Our observations suggest that ion beams can be employed to control the film structures in the deposition of phase-separated films.

  12. ETFE polymer bombarded with 1 MeV proton

    NASA Astrophysics Data System (ADS)

    Parada, M. A.; de Almeida, A.; Muntele, I.; Muntele, C.; Delalez, N.; Ila, D.

    2005-12-01

    The ethylenetetrafluoroethylene (ETFE) is a polymer formed by alternating ethylene and tetrafluoroethylene segments. It has high impact resistance and useful mechanical properties. ETFE can be used as components of pumps, valves, tie wraps, and electrical components. It can also be applied in the field of medical physics as intra venous catheters and as radiation dosimeter. When a material is exposed to the ionizing radiation, it suffers damage that depends on the type, energy and intensity of the radiation. In order to determine the radiation damage mechanism, ETFE films were bombarded with 1 MeV protons to the fluence between 1 × 1011 and 1 × 1016 protons/cm2 and the chemical species emitted during the bombardment were measured with residual gas analysis (RGA) and show that HF gas is the entity preferentially emitted. Optical absorption photospectrometry (OAP) and attenuated total reflectometry fourier transform infrared (ATR-FTIR) shows quantitative chemical evidence of the damage. Our results show that damage is detectable at low proton fluence, but damage that can compromise the application in dosimetry occurs only for fluence greater than 1014 protons/cm2.

  13. DDT_dgarciah_3: Searching for complex fullerene-based molecules in the prototype fullerene Planetary Nebula IC 418

    NASA Astrophysics Data System (ADS)

    García-Hernández, D. A.

    2013-02-01

    The recent and unexpected detection of the most common fullerenes (C60 and C70) and proto-graphene in some Planetary Nebulae (PNe) raises the exciting possibility that other more complex fullerene-based molecules (e.g., carbon onions or multishell fullerenes, fullerene-adducts) might be ubiquitous in the Universe and continue to be serious candidates to explain many astrophysical phenomena. The presence of complex fullerene-based molecules such as carbon onions in the circumstellar shells of fullerene-containing PNe is strongly suggested by our recent analysis of the unusual diffuse interstellar bands detected towards two PNe where C60 had already been found. If complex fullerene-based molecules such as carbon onions are present in this peculiar class of stars, they could easily be detected in the far-IR range. Fullerene-containing PNe are usually very faint in the far-IR but our very recent detection of C60 fullerenes in PN IC 418 can now mitigate this unfortunate situation. Surprisingly, Herschel has not observed this very bright source - now considered the prototype fullerene-containing PN - as part of any approved program in previous cycles. Thus, a comprehensive far-IR study of the complex circumstellar environment where fullerenes and fullerene-based molecules may form is at present lacking. With this DDT proposal we aim at obtaining full range, high S/N, Herschel/PACS far-IR spectra of PN IC 418 to search for the spectral signatures of complex fullerene-based molecules such as multishell fullerenes (e.g., C60@C240, C240@C960), which are predicted to be detectable as relatively strong broad features in the far-IR range. If successful, these observations will constitute the first firm detection of the most complex molecules ever detected in space. In addition, we will search for the predicted hydrogenated amorphous carbon (HAC) associated feature at ~60 um to confirm/refute the HAC's processing/decomposition scenario as the preferred fullerene formation route

  14. Carbon arc production of heptagon-containing fullerene[68

    PubMed Central

    Tan, Yuan-Zhi; Chen, Rui-Ting; Liao, Zhao-Jiang; Li, Jia; Zhu, Feng; Lu, Xin; Xie, Su-Yuan; Li, Jun; Huang, Rong-Bin; Zheng, Lan-Sun

    2011-01-01

    A carbon heptagon ring is a key unit responsible for structural defects in sp2-hybrized carbon allotropes including fullerenes, carbon nanotubes and graphenes, with consequential influences on their mechanical, electronic and magnetic properties. Previous evidence concerning the existence of heptagons in fullerenes has been obtained only in off-line halogenation experiments through top-down detachment of a C2 unit from a stable fullerene. Here we report a heptagon-incorporating fullerene C68, tentatively named as heptafullerene[68], which is captured as C68Cl6 from a carbon arc plasma in situ. The occurrence of heptagons in fullerenes is rationalized by heptagon-related strain relief and temperature-dependent stability. 13C-labelled experiments and mass/energy conservation equation simulations show that heptafullerene[68] grows together with other fullerenes in a bottom-up fashion in the arc zone. This work extends fullerene research into numerous topologically possible, heptagon-incorporating isomers and provides clues to an understanding of the heptagon-involved growth mechanism and heptagon-dependent properties of fullerenes. PMID:21829182

  15. Fullerene derivatives as electron donor for organic photovoltaic cells

    SciTech Connect

    Zhuang, Taojun; Wang, Xiao-Feng E-mail: ziruo@yz.yamagata-u.ac.jp; Sano, Takeshi; Kido, Junji; Hong, Ziruo E-mail: ziruo@yz.yamagata-u.ac.jp; Yang, Yang

    2013-11-11

    We demonstrated the performance of unconventional, all-fullerene-based, planar heterojunction (PHJ) organic photovoltaic (OPV) cells using fullerene derivatives indene-C{sub 60} bisadduct (ICBA) and phenyl C{sub 61}-butyric acid methyl ester as the electron donors with fullerene C{sub 70} as the electron acceptor. Two different charge generation processes, including charge generation in the fullerene bulk and exciton dissociation at the donor-acceptor interface, have been found to exist in such all-fullerene-based PHJ cells and the contribution to the total photocurrent from each process is strongly dependent on the thickness of fullerene donor. The optimized 5 nm ICBA/40 nm C{sub 70} PHJ cell gives clear external quantum efficiency responses for the long-wavelength photons corresponding to the dissociation of strongly bound Frenkel excitons, which is hardly observed in fullerene-based single layer reference devices. This approach using fullerene as a donor material provides further possibilities for developing high performance OPV cells.

  16. Storage of nuclear materials by encapsulation in fullerenes

    DOEpatents

    Coppa, Nicholas V.

    1994-01-01

    A method of encapsulating radioactive materials inside fullerenes for stable long-term storage. Fullerenes provide a safe and efficient means of disposing of nuclear waste which is extremely stable with respect to the environment. After encapsulation, a radioactive ion is essentially chemically isolated from its external environment.

  17. Fullerenes and Noble Gases in the Murchison and Allende Meteorites

    NASA Technical Reports Server (NTRS)

    Becker, Luann; Poreda, Robert J.; Bunch, Ted E.

    2000-01-01

    In this work we report the detection of fullerenes (C60 to C250) in the Murchison and Allende meteorites. By exploiting the unique ability of these molecules to trap noble gases, we have determined that fullerene is indeed a new carrier phase for noble gases in meteorites.

  18. Transport of Fullerene Nanoparticles in Saturated Porous Media

    EPA Science Inventory

    The high strength, electrical conductivity, and electron affinity of fullerenes has lead to their utilization in fuel cells and drug-delivery devices, as well as in cosmetics and other applications. Though C60 fullerene is very insoluble in water, studies have shown that C60 ful...

  19. Protective Fullerene (C60) Packaging System for Microelectromechanical Systems Applications

    NASA Technical Reports Server (NTRS)

    Olivas, John D. (Inventor)

    2004-01-01

    The invention involves tunneling tips to their conducting surface, and specifically the deposition of a monolayer of fullerene C60 onto the conducting plate surface to protect the tunneling tip from contact. The Fullerene C60 molecule is approximately spherical, and a monolayer of fullerene has a thickness of one nanometer, such that a monolayer thereby establishing the theoretical distance desired between the MEMS tunneling tip and the conducting plate. Exploiting the electrical conductivity of C60 the tip can be accurately positioned by simply monitoring conductivity between the fullerene and the tunneling tip. By monitoring the Conductivity between the tip and the fullerene layer as the tip is brought in proximity, the surfaces can be brought together without risk of contacting the underlying conducting surface. Once the tunneling tip is positioned at the one nanometer spacing, with only the monolayer of fullerene between the tunneling tip and the conducting plate, the monolayer of C60, can be broken down thermally and removed chemically leaving only the tunneling tip and the conducting plate at the ideal tunneling spacing. Alternatively, the properties of fullerene allow the tunneling process to occur directly across the fullerene monolayer.

  20. New Penta(tetrathiafulvalenyl)[60]fullerenes for Supramolecular Materials.

    PubMed

    Busseau, Antoine; Villegas, Carmen; Dabos-Seignon, Sylvie; Cabanetos, Clément; Hudhomme, Piétrick; Legoupy, Stéphanie

    2016-06-13

    New penta(organo)fullerenes donor-acceptor systems bearing five tetrathiafulvalene recognition units have been synthesized to promote self-assemblies similar in appearance to shuttlecocks nested into each other thanks to the conical host cavity created around the fullerene together with the π-π and electronic interactions. PMID:27061313

  1. New Penta(tetrathiafulvalenyl)[60]fullerenes for Supramolecular Materials.

    PubMed

    Busseau, Antoine; Villegas, Carmen; Dabos-Seignon, Sylvie; Cabanetos, Clément; Hudhomme, Piétrick; Legoupy, Stéphanie

    2016-06-13

    New penta(organo)fullerenes donor-acceptor systems bearing five tetrathiafulvalene recognition units have been synthesized to promote self-assemblies similar in appearance to shuttlecocks nested into each other thanks to the conical host cavity created around the fullerene together with the π-π and electronic interactions.

  2. Fullerene ion chemistry: a journey of discovery and achievement.

    PubMed

    Böhme, Diethard K

    2016-09-13

    An account is provided of the extraordinary features of buckminster fullerene cations and their chemistry that we discovered in our Ion Chemistry Laboratory at York University (Canada) during a 'golden' period of research in the early 1990s, just after C60 powder became available. We identified new chemical ways of C60 ionization and tracked novel chemistry of C60 (n+) as a function of charge state (n=1-3) with some 50 different reagent molecules. We found that multiple charges enhance reaction rates and diversify reaction products and mechanisms. Strong electrostatic interactions with reagent molecules were seen to reduce barriers to carbon surface bonding and charge-separation reactions, while intramolecular Coulomb repulsion appeared to localize charge on the surface or the substituent and so influence higher order chemistry, including 'spindle', 'star', 'fuzzy ball', 'ball-and-chain' and dimer ion formation. We introduced the notion of 'apparent' gas-phase acidity with measurements of proton-transfer reactions of multiply charged fullerene cations. We also explored the attachment of atomic metal cations to C60 and their subsequent reactions. All these findings were applied to the possible chemistry of fullerene cations in the interstellar medium with a focus on multiply charged fullerene ion formation and the intervention of fullerene cations in fullerene derivatization and molecular synthesis, with a view to their possible future detection.This article is part of the themed issue 'Fullerenes: past, present and future, celebrating the 30th anniversary of Buckminster Fullerene'. PMID:27501972

  3. Three dimensional aromaticity, elemental boron and stuffed fullerenes

    SciTech Connect

    Jemmis, E.D.

    1994-12-31

    An intriguing aspect of fullerenes is the large empty space within. It has been possible to use this space as a molecular container encapsulating neutral atoms and metal ions. A few atoms do not fill the available space. To stuff fullerenes a systematic chemical binding of atoms or molecules to the endohedral surface is needed.

  4. Fullerene stability: One rule for the electron-rich...

    NASA Astrophysics Data System (ADS)

    Fowler, Patrick

    2015-11-01

    A vast number of possible isomers exist for each fullerene, yet few are observed experimentally. Neutral fullerenes typically minimize adjacent pentagons, but charged ones often tolerate them. Now, a simple model taking into account structural strain and π electronic aspects predicts the asymmetric relative stabilities of charged isomers.

  5. Identification of a positive-Seebeck-coefficient exohedral fullerene

    NASA Astrophysics Data System (ADS)

    Almutlaq, Nasser; Al-Galiby, Qusiy; Bailey, Steven; Lambert, Colin J.

    2016-07-01

    If fullerene-based thermoelectricity is to become a viable technology, then fullerenes exhibiting both positive and negative Seebeck coefficients are needed. C60 is known to have a negative Seebeck coefficient and therefore in this paper we address the challenge of identifying a positive-Seebeck-coefficient fullerene. We investigated the thermoelectric properties of single-molecule junctions of the exohedral fullerene C50Cl10 connected to gold electrodes and found that it indeed possesses a positive Seebeck coefficient. Furthermore, in common with C60, the Seebeck coefficient can be increased by placing more than one C50Cl10 in series. For a single C50Cl10, we find S = +8 μV K-1 and for two C50Cl10's in series we find S = +30 μV K-1. We also find that the C50Cl10 monomer and dimer have power factors of 0.5 × 10-5 W m-1 K-2 and 6.0 × 10-5 W m-1 K-2 respectively. These results demonstrate that exohedral fullerenes provide a new class of thermoelectric materials with desirable properties, which complement those of all-carbon fullerenes, thereby enabling the boosting of the thermovoltage in all-fullerene tandem structures.If fullerene-based thermoelectricity is to become a viable technology, then fullerenes exhibiting both positive and negative Seebeck coefficients are needed. C60 is known to have a negative Seebeck coefficient and therefore in this paper we address the challenge of identifying a positive-Seebeck-coefficient fullerene. We investigated the thermoelectric properties of single-molecule junctions of the exohedral fullerene C50Cl10 connected to gold electrodes and found that it indeed possesses a positive Seebeck coefficient. Furthermore, in common with C60, the Seebeck coefficient can be increased by placing more than one C50Cl10 in series. For a single C50Cl10, we find S = +8 μV K-1 and for two C50Cl10's in series we find S = +30 μV K-1. We also find that the C50Cl10 monomer and dimer have power factors of 0.5 × 10-5 W m-1 K-2 and 6.0 × 10-5 W m-1

  6. Dye attached fullerene and P3HT complexes

    NASA Astrophysics Data System (ADS)

    Garnica, Amanda; Basurto, Luis; Zope, Rajendra; Baruah, Tunna

    2015-03-01

    We study the electronic structure of C60 fullerenes functionalized with thiophene-diketo-pyrrolopyrole-thiophene based chromophores using density functional theory combined with large polarized basis sets. These chromophores have electron donor character and thus the functionalization of the fullerene produces donor-acceptor (DA) systems. We examine in detail the effect of the linker and the addition site on the electronic structure of the fullerenes. We further study the charge transfer excited states of these DA complexes and also that of the complexes of these functionalized fullerenes with the poly(3-hexylthiophene-2,5-diyl) (P3HT) are studied using the perturbative Δ-SCF method. The exciton binding energies in the functionalized fullerene-P3MT complexes are found to be smaller compared to similarly prepared phenyl-C61-butyric acid methyl ester (PCBM)-P3MT complex. Support from DOE (DE-SC0002168) and NSF (DMR-1205302) is acknowledged.

  7. Polymer-Fullerene Network Formation via Light-Induced Crosslinking.

    PubMed

    Sugawara, Yuuki; Hiltebrandt, Kai; Blasco, Eva; Barner-Kowollik, Christopher

    2016-09-01

    A facile and efficient methodology for the formation of polymer-fullerene networks via a light-induced reaction is reported. The photochemical crosslinking is based on a nitrile imine-mediated tetrazole-ene cycloaddition reaction, which proceeds catalyst-free under UV-light irradiation (λmax = 320 nm) at ambient temperature. A tetrazole-functionalized polymer (Mn = 6500 g mol(-1) , Ð = 1.3) and fullerene C60 are employed for the formation of the hybrid networks. The tetrazole-functionalized polymer as well as the fullerene-containing networks are carefully characterized by NMR spectrometry, size exclusion chromatography, infrared spectroscopy, and elemental analysis. Furthermore, thermal analysis of the fullerene networks and their precursors is carried out. The current contribution thus induces an efficient platform technology for fullerene-based network formation. PMID:27336692

  8. Nanoencapsulation of Fullerenes in Organic Structures with Nonpolar Cavities

    NASA Astrophysics Data System (ADS)

    Murthy, C. N.

    2005-01-01

    The formation of supramolecular structures, assemblies, and arrays held together by weak intermolecular interactions and non-covalent binding mimicking natural processes has been used in applications being anticipated in nanotechnology, biotechnology and the emerging field of nanomedicine. Encapsulation of C60 fullerene by cyclic molecules like cyclodextrins and calixarenes has potential for a number of applications. Similarly, biomolecules like lysozyme also have been shown to encapsulate C60 fullerene. This poster article reports the recent trends and the results obtained in the nanoencapsulation of fullerenes by biomolecules containing nonpolar cavities. Lysozyme was chosen as the model biomolecule and it was observed that there is no covalent bond formed between the bimolecule and the C60 fullerene. This was confirmed from fluorescence energy transfer studies. UV Vis studies further supported this observation that it is possible to selectively remove the C60 fullerene from the nonpolar cavity. This behavior has potential in biomedical applications

  9. The role of fullerene shell upon stuffed atom polarization potential

    NASA Astrophysics Data System (ADS)

    Amusia, Miron; Chernysheva, Larissa

    2016-05-01

    We have demonstrated that the polarization of the fullerene shell considerably alters the polarization potential of an atom, stuffed inside a fullerene. This essentially affects the electron elastic scattering phases as well as corresponding cross-sections. We illustrate the general trend by concrete examples of electron scattering upon endohedrals that are formed when Ne and Ar atom are stuffed inside fullerene C60. To obtain the presented results, we have suggested a simplified approach that permits to incorporate the effect of fullerenes polarizability into the endohedrals polarization potential. By applying this approach, we obtained numeric results that show strong variations in shape and magnitudes of scattering phases and cross-sections due to effect of fullerene polarization upon the endohedral polarization potential. Using concrete examples we have demonstrated that the elastic scattering of electrons upon endohedrals is an entirely quantum mechanical process, where addition of even a single atom can qualitatively alter the multi-particle cross-section.

  10. Improving the Visible Light Photoactivity of Supported Fullerene Photocatalysts through the Use of [C₇₀] Fullerene.

    PubMed

    Moor, Kyle J; Valle, Dhyan C; Li, Chuanhao; Kim, Jae-Hong

    2015-05-19

    We herein present the first instance of employing [C₇₀] fullerene for photocatalytic ¹O₂ production in water, through covalent immobilization onto a mesoporous silica support via nucelophilic amine addition directly to fullerene's cage. This attachment approach prevents the aggregation of individual fullerene molecules in water, thus allowing fullerene to retain its photoactivity, yet is much less complex than other techniques commonly pursued to create such supported-fullerene materials, which typically rely on water-soluble fullerene derivatives and elaborate immobilization methods. The solid-supported C₇₀ material exhibits significantly improved aqueous visible-light photoactivity compared to previous C₆₀- and C₆₀-derivative-based supported fullerene materials. Further, this material rapidly inactivates MS2 bacteriophage under sunlight illumination, oxidizes various organic contaminants, and does not appear to be significantly fouled by natural organic matter (NOM), highlighting the potential of these materials in real-world applications. Collectively, the ease of preparation and significantly enhanced visible-light photoactivity of these materials advance fullerene-based technologies for water treatment.

  11. Fullerene fine particles adhere to pollen grains and affect their autofluorescence and germination

    PubMed Central

    Aoyagi, Hideki; Ugwu, Charles U

    2011-01-01

    Adhesion of commercially produced fullerene fine particles to Cryptomeria japonica, Chamaecyparis obtusa and Camellia japonica pollen grains was investigated. The autofluorescence of pollen grains was affected by the adhesion of fullerene fine particles to the pollen grains. The degree of adhesion of fullerene fine particles to the pollen grains varied depending on the type of fullerene. Furthermore, germination of Camellia japonica pollen grains was inhibited by the adhesion of fullerene fine particles. PMID:24198486

  12. Evidence Supporting an Early as Well as Late Heavy Bombardment on the Moon

    NASA Technical Reports Server (NTRS)

    Frey, Herbert

    2015-01-01

    Evidence supporting an intense early bombardment on the Moon in addition to the traditional Late Heavy Bombardment at approx. 4 BY ago include the distribution of N(50) Crater Retention Ages (CRAs) for candidate basins, a variety of absolute age scenarios for both a "young" and an "old" Nectaris age, and the decreasing contrasts in both topographic relief and Bouguer gravity with increasing CRA.

  13. Uses of ion bombardment in thin-film deposition

    SciTech Connect

    Erck, R.A.; Fenske, G.R.; Erdemir, A.

    1990-10-01

    Use of plasma- and ion-beam-modified surfaces and surface coatings in continually expanding in engineering disciplines. The purpose of these modifications and treatments is to impart favorable properties, such as wear resistance and lubricity, to the surfaces, while at the same time retaining the strength or toughness of the bulk materials. Energetic-ion bombardment can be used to modify the structural and chemical properties of surfaces or applied coatings. Ion-implantation has been used for many years, and recently, other surface-modification techniques, among them ion-beam mixing and ion-beam-assisted deposition, have attracted attention because they permit application of highly adherent lubricious and wear-resistant films. In this paper, ion-beam techniques are described from the viewpoint of ion-surface interactions, and some avenues for the engineering of tribological surfaces are presented. 100 refs., 4 figs.

  14. Optical radiation from regions downstream of mercury bombardment thrusters

    NASA Technical Reports Server (NTRS)

    Milder, N. L.; Sovey, J. S.

    1972-01-01

    A 0.5 meter focal length, plane grating monochromator was used to measure the radiance of spectral radiation emanating from regions downstream of a mercury bombardment thruster. The wavelength range investigated was 2800 A. This radiation was due primarily to the radiative decay of excited mercury atoms exhausted from the thruster. Radiance values ranged from 10 to the minus 11th power to 10 to the minus 9th power W/sq cm sr, varying with wavelength. For resonant radiation, the spectral radiance may exceed 10 to the minus 8th power W/sq cm sr. From such radiance measurements, it was concluded that the thruster background radiation should not interfere with the control functions of a star tracker viewing through the thruster exhaust, provided that the tracker is designed to operate with a sufficiently small field of view.

  15. ATS-6 - Cesium bombardment engine north-south stationkeeping experiment

    NASA Technical Reports Server (NTRS)

    Worlock, R. M.; James, E. L.; Hunter, R. E.; Bartlett, R. O.

    1975-01-01

    Two 0.004 N thrust cesium bombardment ion thrustors have been developed and used for north-south stationkeeping in the geostationary Applications Technology Satellite-6 (ATS-6). The thrustor subsystems are mounted on the north and south faces of the earth viewing module such that 0.0026 N of thrust is applied normal to the orbit plane and 0.0036 N is applied radially upward. The change in the orbit inclination of the satellite is maintained at zero by operating the two thrustors alternately so that their thrust components, normal to the orbital plane, are symmetrically applied about the nodal crossings. Initial operation of the thrustors was successful. There was no interference with the satellite communications systems and the predicted spacecraft operating potential was verified. Subsequent trials failed due to a defect in the operation of the propellant reservoirs in zero g. A feed line valve is under development to correct this difficulty.

  16. Changes of Dust Grain Properties Under Particle Bombardment

    NASA Astrophysics Data System (ADS)

    Pavlů, J.; Richterová, I.; Fujita, D.; Šafránková, J.; Němeček, Z.

    2008-09-01

    The dust in space environments is exposed to particle bombardment. Under an impact of ions, electrons, and photons, the charge of a particular grain changes and, in some cases, the grain structure can be modified. The present study deals with spherical melamine formaldehyde resin grains that are frequently used in many dusty plasmas and microgravity experiments and it concentrates on the influence of the electron beam impact on a grain size. We have performed series of experiments based on the SEM technique. Our investigation has shown that the electron impact can cause a significant increase of the grain size. We discuss changes of material properties and consequences for its applications in laboratory and space experiments.

  17. Changes of Dust Grain Properties Under Particle Bombardment

    SciTech Connect

    Pavlu, J.; Richterova, I.; Safrankova, J.; Nemecek, Z.; Fujita, D.

    2008-09-07

    The dust in space environments is exposed to particle bombardment. Under an impact of ions, electrons, and photons, the charge of a particular grain changes and, in some cases, the grain structure can be modified. The present study deals with spherical melamine formaldehyde resin grains that are frequently used in many dusty plasmas and microgravity experiments and it concentrates on the influence of the electron beam impact on a grain size. We have performed series of experiments based on the SEM technique. Our investigation has shown that the electron impact can cause a significant increase of the grain size. We discuss changes of material properties and consequences for its applications in laboratory and space experiments.

  18. Bombarding Cancer: Biolistic Delivery of therapeutics using Porous Si Carriers

    PubMed Central

    Zilony, Neta; Tzur-Balter, Adi; Segal, Ester; Shefi, Orit

    2013-01-01

    A new paradigm for an effective delivery of therapeutics into cancer cells is presented. Degradable porous silicon carriers, which are tailored to carry and release a model anti-cancer drug, are biolistically bombarded into in-vitro cancerous targets. We demonstrate the ability to launch these highly porous microparticles by a pneumatic capillary gene gun, which is conventionally used to deliver cargos by heavy metal carriers. By optimizing the gun parameters e.g., the accelerating gas pressure, we have successfully delivered the porous carriers, to reach deep targets and to cross a skin barrier in a highly spatial resolution. Our study reveals significant cytotoxicity towards the target human breast carcinoma cells following the delivery of drug-loaded carriers, while administrating empty particles results in no effect on cell viability. The unique combination of biolistics with the temporal control of payload release from porous carriers presents a powerful and non-conventional platform for designing new therapeutic strategies. PMID:23975675

  19. Compact electron gun based on secondary emission through ionic bombardment.

    PubMed

    Diop, Babacar; Bonnet, Jean; Schmid, Thomas; Mohamed, Ajmal

    2011-01-01

    We present a new compact electron gun based on the secondary emission through ionic bombardment principle. The driving parameters to develop such a gun are to obtain a quite small electron gun for an in-flight instrument performing Electron Beam Fluorescence measurements (EBF) on board of a reentry vehicle in the upper atmosphere. These measurements are useful to characterize the gas flow around the vehicle in terms of gas chemical composition, temperatures and velocity of the flow which usually presents thermo-chemical non-equilibrium. Such an instrument can also be employed to characterize the upper atmosphere if placed on another carrier like a balloon. In ground facilities, it appears as a more practical tool to characterize flows in wind tunnel studies or as an alternative to complex electron guns in industrial processes requiring an electron beam. We describe in this paper the gun which has been developed as well as its different features which have been characterized in the laboratory.

  20. Plasma properties in electron-bombardment ion thrusters

    NASA Technical Reports Server (NTRS)

    Matossian, J. N.; Beattie, J. R.

    1987-01-01

    The paper describes a technique for computing volume-averaged plasma properties within electron-bombardment ion thrusters, using spatially varying Langmuir-probe measurements. Average values of the electron densities are defined by integrating the spatially varying Maxwellian and primary electron densities over the ionization volume, and then dividing by the volume. Plasma properties obtained in the 30-cm-diameter J-series and ring-cusp thrusters are analyzed by the volume-averaging technique. The superior performance exhibited by the ring-cusp thruster is correlated with a higher average Maxwellian electron temperature. The ring-cusp thruster maintains the same fraction of primary electrons as does the J-series thruster, but at a much lower ion production cost. The volume-averaged predictions for both thrusters are compared with those of a detailed thruster performance model.

  1. Bombarding Cancer: Biolistic Delivery of therapeutics using Porous Si Carriers

    NASA Astrophysics Data System (ADS)

    Zilony, Neta; Tzur-Balter, Adi; Segal, Ester; Shefi, Orit

    2013-08-01

    A new paradigm for an effective delivery of therapeutics into cancer cells is presented. Degradable porous silicon carriers, which are tailored to carry and release a model anti-cancer drug, are biolistically bombarded into in-vitro cancerous targets. We demonstrate the ability to launch these highly porous microparticles by a pneumatic capillary gene gun, which is conventionally used to deliver cargos by heavy metal carriers. By optimizing the gun parameters e.g., the accelerating gas pressure, we have successfully delivered the porous carriers, to reach deep targets and to cross a skin barrier in a highly spatial resolution. Our study reveals significant cytotoxicity towards the target human breast carcinoma cells following the delivery of drug-loaded carriers, while administrating empty particles results in no effect on cell viability. The unique combination of biolistics with the temporal control of payload release from porous carriers presents a powerful and non-conventional platform for designing new therapeutic strategies.

  2. Sputtering yield of Pu bombarded by fission Fragments from Cf

    SciTech Connect

    Danagoulian, Areg; Klein, Andreas; Mcneil, Wendy V; Yuan, Vincent W

    2008-01-01

    We present results on the yield of sputtering of Pu atoms from a Pu foil, bombarded by fission fragments from a {sup 252}Cf source in transmission geometry. We have found the number of Pu atoms/incoming fission fragments ejected to be 63 {+-} 1. In addition, we show measurements of the sputtering yield as a function of distance from the central axis, which can be understood as an angular distribution of the yield. The results are quite surprising in light of the fact that the Pu foil is several times the thickness of the range of fission fragment particles in Pu. This indicates that models like the binary collision model are not sufficient to explain this behavior.

  3. A Unique Photon Bombardment System for Space Applications

    NASA Technical Reports Server (NTRS)

    Klein, E. J.

    1993-01-01

    The innovative Electromagnetic Radiation Collection and Concentration System (EMRCCS) described is the foundation for the development of a multiplicity of space and terrestrial system formats. The system capability allows its use in the visual, infrared, and ultraviolet ranges of the spectrum for EM collection, concentration, source/receptor tracking, and targeting. The nonimaging modular optical system uses a physically static position aperture for EM radiation collection. Folded optics provide the concentration of the radiation and source autotracking. The collected and concentrated electromagnetic radiation is utilized in many applications, e.g., solar spectrum in thermal and associative photon bombardment applications for hazardous waste management, water purification, metal hardening, hydrogen generation, photovoltaics, etc., in both space and terrestrial segment utilization. Additionally, at the high end of the concentration capability range, i.e., 60,000+, a solar-pulsed laser system is possible.

  4. Statistical Law of High-Energy Fullerene and Its Derivatives Passing Through Graphene

    NASA Astrophysics Data System (ADS)

    Xu, Zhi-Cheng; Wen, Jia-Le; Zhong, Wei-Rong; Wei, Liang

    2016-03-01

    The behavior of graphene bombarded by fullerene (C60 and C70) and its derivatives through using non-equilibrium molecular dynamics method are studied. The microscopic mechanism of passing through graphene is obviously related to the initial structure of destroying carbon-carbon bonds and the strong interaction between the circular region of graphene and the cluster. The probability of passing through graphene depends on the incident velocity of clusters, the species of clusters, the temperature of heat baths, and the defect of graphene. Our results can provide a perspective for further understanding the mechanism of generating nanopores in graphene. The clusters used here may also bring about some potential utilities in the functionalization of graphene and the production of nanopores. Supported in part by the National Natural Science Foundation of China under Grant Nos. 11004082, and 11291240477, the Natural Science Foundation of Guangdong Province under Grant No. 2014A030313367, and the Fundamental Research Funds for the Central Universities, Jinan University under Grant Nos. 21611437 and 11614341

  5. Preparation of radiotherapy glass by phosphorus ion implantation at 100 keV.

    PubMed

    Kawashita, M; Miyaji, F; Kokubo, T; Takaoka, G H; Yamada, I; Suzuki, Y; Kajiyama, K

    1997-01-01

    A chemically durable glass containing a large amount of phosphorus is useful for in situ irradiation of cancers. It can be activated to be a beta emitter (half-life of 14.3 days) by neutron bombardment. Microspheres of the activated glass injected into the tumors can irradiate the tumors directly with beta rays without irradiating neighboring normal tissues. In the present study a P+ ion was implanted into a pure silica glass in a plate form at 100 keV in order to find the fundamental conditions for obtaining such a glass. Little phosphorus was present in the surface region, at least to a depth of 2.4 nm for doses of 5 x 10(16) and 1 x 10(17) cm-2, whereas an appreciable amount of it was distributed on the glass surface and a part of it was oxidized for doses above 5 x 10(17) cm-2. The glasses implanted with doses of 5 x 10(16) and 1 x 10(17) cm-2 hardly released the P and Si into water at 95 degrees C, even after 7 days, whereas the glasses implanted with doses above 5 x 10(17) cm-2 released appreciable amounts of these elements. Implantation energies of 20 and 50 keV (even at doses of 5 x 10(16) and 1 x 10(17) cm-2, respectively), formed oxidized phosphorus on the glass surfaces and gave appreciable release of the P and Si into the hot water. This indicates that a chemically durable glass containing a larger amount of phosphorus could be obtained if a P+ ion is implanted at higher energies to localize in a deeper region of the glass surface.

  6. Atom penetration from a thin film into the substrate during sputtering by polyenergetic Ar{sup +} ion beam with mean energy of 9.4 keV

    SciTech Connect

    Kalin, B.A.; Gladkov, V.P.; Volkov, N.V.; Sabo, S.E.

    1995-12-31

    Penetration of alien atoms (Be, Ni) into Be, Al, Zr, Si and diamond was investigated under Ar{sup +} ion bombardment of samples having thermally evaporated films of 30--50 nm. Sputtering was carried out using a wide energy spectrum beam of Ar{sup +} ions of 9.4 keV to dose D = 1 {times} 10{sup 16}--10{sup 19} ion/cm{sup 2}. Implanted atom distribution in the targets was measured by Rutherford backscattering spectrometry (RBS) of H{sup +} and He{sup +} ions with energy of 1.6 MeV as well as secondary ion mass-spectrometry (SIMS). During the bombardment, the penetration depth of Ar atoms increases with dose linearly. This depth is more than 3--20 times deeper than the projected range of bombarding ions and recoil atoms. This is a deep action effect. The analysis shows that the experimental data for foreign atoms penetration depth are similar to the data calculated for atom migration through the interstitial site in a field of internal (lateral) compressive stresses created in the near-surface layer of the substrate as a result of implantation. Under these experimental conditions atom ratio r{sub i}/r{sub m} (r{sub i} -- radius of dopant, r{sub m} -- radius target of substrate) can play a principal determining role.

  7. Rotational dynamics of fullerenes and metallofullerenes

    SciTech Connect

    Johnson, R.D.; Salem, J.R.; Vries, M.S. de; Hoinkis, M.; Crowder, M.; Bethune, D.S.; Yannonni, C.S.

    1993-12-31

    The authors have investigated the rotational dynamics of C{sub 60} both in solution and the solid state, using {sup 13}C NMR. The rotational correlation times and activation energies of C{sub 60} in several solvents will be reported, and the results compared to measurements in the solid state. These results will then be used to interpret both EPR and NMR experiments on Scandium clusters encapsulated in fullerene cages. Measurement of {sup 45}Sc NMR relaxation rates are found to support conclusions from EPR experiments that the metal clusters form molecules inside the carbon cages.

  8. Significant enhancement of negative secondary ion yields by cluster ion bombardment combined with cesium flooding.

    PubMed

    Philipp, Patrick; Angerer, Tina B; Sämfors, Sanna; Blenkinsopp, Paul; Fletcher, John S; Wirtz, Tom

    2015-10-01

    In secondary ion mass spectrometry (SIMS), the beneficial effect of cesium implantation or flooding on the enhancement of negative secondary ion yields has been investigated in detail for various semiconductor and metal samples. All results have been obtained for monatomic ion bombardment. Recent progress in SIMS is based to a large extent on the development and use of cluster primary ions. In this work we show that the enhancement of negative secondary ions induced by the combination of ion bombardment with simultaneous cesium flooding is valid not only for monatomic ion bombardment but also for cluster primary ions. Experiments carried out using C60+ and Ar4000+ bombardment on silicon show that yields of negative secondary silicon ions can be optimized in the same way as by Ga+ and Cs+ bombardment. Both for monatomic and cluster ion bombardment, the optimization does not depend on the primary ion species. Hence, it can be assumed that the silicon results are also valid for other cluster primary ions and that results obtained for monatomic ion bombardment on other semiconductor and metal samples are also valid for cluster ion bombardment. In SIMS, cluster primary ions are also largely used for the analysis of organic matter. For polycarbonate, our results show that Ar4000+ bombardment combined with cesium flooding enhances secondary ion signals by a factor of 6. This can be attributed to the removal of charging effects and/or reduced fragmentation, but no major influence on ionization processes can be observed. The use of cesium flooding for the imaging of cells was also investigated and a significant enhancement of secondary ion yields was observed. Hence, cesium flooding has also a vast potential for SIMS analyses with cluster ion bombardment.

  9. Process for the removal of impurities from combustion fullerenes

    DOEpatents

    Alford, J. Michael; Bolskar, Robert

    2005-08-02

    The invention generally relates to purification of carbon nanomaterials, particularly fullerenes, by removal of PAHs and other hydrocarbon impurities. The inventive process involves extracting a sample containing carbon nanomaterials with a solvent in which the PAHs are substantially soluble but in which the carbon nanomaterials are not substantially soluble. The sample can be repeatedly or continuously extracted with one or more solvents to remove a greater amount of impurities. Preferred solvents include ethanol, diethyl ether, and acetone. The invention also provides a process for efficiently separating solvent extractable fullerenes from samples containing fullerenes and PAHs wherein the sample is extracted with a solvent in which both fullerenes and PAHs are substantially soluble and the sample extract then undergoes selective extraction to remove PAHs. Suitable solvents in which both fullerenes and PAHs are soluble include o-xylene, toluene, and o-dichlorobenzene. The purification process is capable of treating quantities of combustion soot in excess of one kilogram and can produce fullerenes or fullerenic soot of suitable purity for many applications.

  10. Identification of a positive-Seebeck-coefficient exohedral fullerene.

    PubMed

    Almutlaq, Nasser; Al-Galiby, Qusiy; Bailey, Steven; Lambert, Colin J

    2016-07-14

    If fullerene-based thermoelectricity is to become a viable technology, then fullerenes exhibiting both positive and negative Seebeck coefficients are needed. C60 is known to have a negative Seebeck coefficient and therefore in this paper we address the challenge of identifying a positive-Seebeck-coefficient fullerene. We investigated the thermoelectric properties of single-molecule junctions of the exohedral fullerene C50Cl10 connected to gold electrodes and found that it indeed possesses a positive Seebeck coefficient. Furthermore, in common with C60, the Seebeck coefficient can be increased by placing more than one C50Cl10 in series. For a single C50Cl10, we find S = +8 μV K(-1) and for two C50Cl10's in series we find S = +30 μV K(-1). We also find that the C50Cl10 monomer and dimer have power factors of 0.5 × 10(-5) W m(-1) K(-2) and 6.0 × 10(-5) W m(-1) K(-2) respectively. These results demonstrate that exohedral fullerenes provide a new class of thermoelectric materials with desirable properties, which complement those of all-carbon fullerenes, thereby enabling the boosting of the thermovoltage in all-fullerene tandem structures. PMID:27357101

  11. Charged fullerenes as high-capacity hydrogen storage media.

    PubMed

    Yoon, Mina; Yang, Shenyuan; Wang, Enge; Zhang, Zhenyu

    2007-09-01

    Using first-principles calculations within density functional theory, we explore systematically the capacity of charged carbon fullerenes Cn (20 fullerenes can be dramatically enhanced to 0.18-0.32 eV, a desirable range for potential room-temperature, near ambient applications. The enhanced binding is delocalized in nature, surrounding the whole surface of a charged fullerene, and is attributed to the polarization of the hydrogen molecules by the high electric field generated near the surface of the charged fullerene. At full hydrogen coverage, these charged fullerenes can gain storage capacities of up to approximately 8.0 wt %. We also find that, contrary to intuitive expectation, fullerenes containing encapsulated metal atoms only exhibit negligible enhancement in the hydrogen binding strength, because the charge donated by the metal atoms is primarily confined inside the fullerene cages. These predictions may prove to be instrumental in searching for a new class of high-capacity hydrogen storage media.

  12. Engineering the physical parameters for continuous synthesis of fullerene peapods

    NASA Astrophysics Data System (ADS)

    Tiwari, Neeru; Pandey, Nayancee; Roy, Debmalya; Mukhopadhyay, K.; Eswara Prasad, N.

    2016-05-01

    Previous efforts to insert fullerenes into a carbon nanotube (CNT) involved the isolated synthesis of CNTs and fullerenes and then annealing CNTs and fullerenes together for encapsulation. We demonstrated the process for the continuous production of fullerene peapods inside the arc instrument by modifying the conventional arc ablation system, which can be repeated to obtain the desired mass scale product. Inside the arc discharge unit, by using the tunable external magnetic field, the double-walled CNTs (DWCNTs) were first synthesized and then directed to deposit onto the water cooled aluminium (Al) plate. The openings were created on DWCNTs by controlled heating of the Al plate and then fullerenes were synthesized and deposited on DWCNTs. In the arc instrument, fullerenes were finally directed to enter into DWCNTs from the defect sites by heating the Al plate in a vacuum. The formation of the peapod was established by the structure-property studies despite the huge deposition of metal catalyst nanoparticles and fullerenes on the surface of the nanotube which were a serious challenge for molecular level characterization of the grown peapod structures.

  13. Noncovalent endo-binding of fullerenes to diprotonated bisporphyrins.

    PubMed

    Jung, Sunghan; van Paauwe, John D; Boyd, Peter D W; Shin, Seung Koo

    2011-12-01

    Noncovalent binding of fullerenes to bisporphyrins was studied in the gas phase by energy-dependent collision-induced dissociation (CID) with Xe under single-collision conditions. The electrospray ionization mass spectra of calix[4]arene-linked bisporphyrins show that bisporphyrins take up to 3-4 protons, depending on the type of meso-substituents. Of the protonated bisporphyrins, the diprotonated species form stable 1:1 complexes with fullerenes (C(60) and C(70)). CID cracking patterns of the diprotonated bisporphyrins indicate that each monomeric porphyrin moiety is singly protonated. CID yield-energy curves obtained from the 1:1 diprotonated bisporphyrin-fullerene complexes suggest that a fullerene occupies the endo-binding site intercalated between the two singly protonated porphyrin moieties. In the cases of 1:2 diprotonated bisporphyrin-fullerene complexes, CID results show that one fullerene binds inside (endo-binding) and the other outside (exo-binding). The exo-binding mode is energetically almost identical to the binding of fullerenes to singly protonated porphyrin monomers. The endo-binding energy is at least twice the exo-binding energy. To gain insights into the binding mode, we optimized structures of diprotonated bisporphyrins and their 1:1 endo-complexes with fullerenes, and calculated the endo-binding energy for C(60), C(70) (end-on), and C(70) (side-on). The endo-binding of fullerenes to diprotonated bisporphyrins nearly doubles the π-π interactions while reducing the electrostatic repulsion between the two singly protonated porphyrin moieties. The side-on binding of C(70) is favored over the end-on binding because the former exerts less steric strain to the lower rim of calixarene.

  14. Relief evolution of HOPG under high-fluence 30 keV argon ion irradiation

    NASA Astrophysics Data System (ADS)

    Andrianova, N. N.; Borisov, A. M.; Mashkova, E. S.; Shemukhin, A. A.; Shulga, V. I.; Virgiliev, Yu. S.

    2015-07-01

    The results of the experimental study of sputtering and erosion of the basal plane of HOPG under irradiation with 30-keV Ar+ in the range from RT to 400 °C are presented. It has been found that developed at elevated (⩾250 °C) temperatures needle-like microscopic relief results in twofold sputtering yield increase (Y ≈ 2) in comparison with sputtering of a surface with an etch pits microscopic relief at the temperatures less than the ion-induced texture transition temperature Tt ≈ 150 °C. The effects of ion-induced graphite relief on high-dose sputtering have been studied using binary-collision computer simulation. The relief was modeled as a sine function surface along two mutually perpendicular surface axes. The simulation has shown that at some parameters of the relief the essential part of the bombarding ions undergoes inclined incidence on the walls of surface hillocks, which increases the density of ion-atom collisions near the surface and, correspondingly, the ejection of atoms. This effect leads to non-monotonic behavior of the sputtering yield on the relief aspect ratio (amplitude/period). The sputtering yield decreases upon reaching the maximum at aspect ratio of 4, and becomes lower than that for a flat surface. The simulation permits to estimate the relation of amplitude to period of relief at T < Tt.

  15. Nonvalence correlation-bound anion states of spherical fullerenes.

    PubMed

    Voora, Vamsee K; Jordan, Kenneth D

    2014-08-13

    We present a one-electron model Hamiltonian for characterizing nonvalence correlation-bound anion states of fullerene molecules. These states are the finite system analogs of image potential states of metallic surfaces. The model potential accounts for both atomic and charge-flow polarization and is used to characterize the nonvalence correlation-bound anion states of the C60, (C60)2, C240, and C60@C240 fullerene systems. Although C60 is found to have a single (s-type) nonvalence correlation-bound anion state, the larger fullerenes are demonstrated to have multiple nonvalence correlation-bound anion states. PMID:24978808

  16. Superconductivity in alkali-doped fullerene nanowhiskers.

    PubMed

    Takeya, Hiroyuki; Konno, Toshio; Hirata, Chika; Wakahara, Takatsugu; Miyazawa, Kun'ichi; Yamaguchi, Takahide; Tanaka, Masashi; Takano, Yoshihiko

    2016-09-01

    Superconductivity in alkali metal-doped fullerene nanowhiskers (C60NWs) was observed in K3.3C60NWs, Rb3.0C60NWs and Cs2.0Rb1.0C60NWs with transition temperatures at 17, 25 and 26 K, respectively. Almost full shielding volume fraction (~80%) was observed in K3.3C60NWs when subjected to thermal treatment at 200 °C for a duration of 24 h. In contrast, the shielding fraction of Rb3.0C60NWs and Cs2.0Rb1.0C60NWs were calculated to be 8% and 6%, respectively. Here we report on an extensive investigation of the superconducting properties of these AC60NWs (A  =  K3.3, Rb3.0 and Cs2.0Rb1.0). These properties are compared to the ones reported on the corresponding conventional (single-crystal or powder) K-doped fullerene. We also evaluated the critical current densities of these C60NWs using the Bean model under an applied magnetic field up to 50 kOe. PMID:27385220

  17. Superconductivity in alkali-doped fullerene nanowhiskers.

    PubMed

    Takeya, Hiroyuki; Konno, Toshio; Hirata, Chika; Wakahara, Takatsugu; Miyazawa, Kun'ichi; Yamaguchi, Takahide; Tanaka, Masashi; Takano, Yoshihiko

    2016-09-01

    Superconductivity in alkali metal-doped fullerene nanowhiskers (C60NWs) was observed in K3.3C60NWs, Rb3.0C60NWs and Cs2.0Rb1.0C60NWs with transition temperatures at 17, 25 and 26 K, respectively. Almost full shielding volume fraction (~80%) was observed in K3.3C60NWs when subjected to thermal treatment at 200 °C for a duration of 24 h. In contrast, the shielding fraction of Rb3.0C60NWs and Cs2.0Rb1.0C60NWs were calculated to be 8% and 6%, respectively. Here we report on an extensive investigation of the superconducting properties of these AC60NWs (A  =  K3.3, Rb3.0 and Cs2.0Rb1.0). These properties are compared to the ones reported on the corresponding conventional (single-crystal or powder) K-doped fullerene. We also evaluated the critical current densities of these C60NWs using the Bean model under an applied magnetic field up to 50 kOe.

  18. Interaction of C(60) fullerene with lipids.

    PubMed

    Cataldo, Franco

    2010-06-01

    Unsaturated lipids when exposed to air at room temperature undergo a slow autoxidation. When fullerene C(60) was dissolved in selected lipids (ethyl oleate, ethyl linoleate, linseed oil and castor oil) the spectrophotometric analysis shows that the oxidation is concentrated to C(60) which is converted to an epoxide C(60)O. Thus, fullerene C(60) displays antioxidant activity not only when dissolved in unsaturated lipids but also, more generally, when dissolved in unsaturated solvents subjected to autoxidation like, for example, in cyclohexene. The behaviour of C(60) in ethyl oleate has been compared with that of the known antioxidant TMPPD (N,N',N,N,'-tetramethyl-p-phenylenediamine) in ethyl oleate. The mechanism of the antioxidant action of C(60) in lipids has been proposed. The kinetics of C(60) oxidation in lipids was determined spectrophotometrically both at room temperature in the dark and under UV irradiation. The oxidized products derived from C(60) photo-oxidation in lipids have been identified. PMID:20338159

  19. Fullerene and the origin of life.

    PubMed

    Goodman, Geoffrey; Gershwin, M Eric; Bercovich, Dani

    2012-10-01

    The role of carbon in the development of life and as the structural backbone of all organisms is universally accepted and an essential part of evolution. However, the molecular basis is largely unknown and the interactions of carbon with nitrogen and oxygen in space are enigmatic. In 1985, the previously unknown form of carbon, coined fullerene, was discovered. We hypothesize that by virtue of the unique properties of fullerene, this hollow, ultra-robust, large, purely carbon molecule was the earliest progenitor of life. It acted as a stable universal biologic template on which small molecules spontaneously assembled and then formed, by further assembly, a surface mantle (here termed rosasome) of larger molecules. We submit that this process, by its inherent flexibility, initiated evolution, allowing the emergence of parallel diverse rosasome lines responding selectively to varying spatial environments. For example, rosasomal lines mantled with nucleotide and peptide layers are conceived as primordial forerunners of the ubiquitous ribosome. Moreover, the parallel independent and interdependent evolution of rosasome lines would be more rapid than sequential development, refute precedence of either DNA or RNA, and explain the evolution of integration of two subunits with different structures and functions in ribosomes and of the triplet nature of the codon. Based on recent astronomical data, this hypothesis supports the concept that life is not a singularity. This concept also suggests a potential vehicle for therapeutics, biotechnology and genetic engineering.

  20. Superconductivity in alkali-doped fullerene nanowhiskers

    NASA Astrophysics Data System (ADS)

    Takeya, Hiroyuki; Konno, Toshio; Hirata, Chika; Wakahara, Takatsugu; Miyazawa, Kun'ichi; Yamaguchi, Takahide; Tanaka, Masashi; Takano, Yoshihiko

    2016-09-01

    Superconductivity in alkali metal-doped fullerene nanowhiskers (C60NWs) was observed in K3.3C60NWs, Rb3.0C60NWs and Cs2.0Rb1.0C60NWs with transition temperatures at 17, 25 and 26 K, respectively. Almost full shielding volume fraction (~80%) was observed in K3.3C60NWs when subjected to thermal treatment at 200 °C for a duration of 24 h. In contrast, the shielding fraction of Rb3.0C60NWs and Cs2.0Rb1.0C60NWs were calculated to be 8% and 6%, respectively. Here we report on an extensive investigation of the superconducting properties of these AC60NWs (A  =  K3.3, Rb3.0 and Cs2.0Rb1.0). These properties are compared to the ones reported on the corresponding conventional (single-crystal or powder) K-doped fullerene. We also evaluated the critical current densities of these C60NWs using the Bean model under an applied magnetic field up to 50 kOe.

  1. Molecular dynamics study of self-agglomeration of charged fullerenes in solvents.

    PubMed

    Banerjee, Soumik

    2013-01-28

    The agglomeration of fullerenes in solvents is an important phenomenon that is relevant to controlled synthesis of fullerene-based nanowires as well as fullerene-based composites. The molecular aggregation in solvents depends on the atomistic interactions of fullerene with the solvent and is made complicated by the fact that fullerenes accrue negative surface charges when present in solvents such as water. In the present work, we simulated fullerenes of varying size and shape (C60, C180, C240, and C540) with and without surface charges in polar protic (water), polar aprotic (acetone), and nonpolar (toluene) solvents using molecular dynamics method. Our results demonstrate that uncharged fullerenes form agglomerates in polar solvents such as water and acetone and remain relatively dispersed in nonpolar toluene. The presence of surface charge significantly reduces agglomerate size in water and acetone. Additionally, the relative influence of surface charge on fullerene agglomeration depends on the size and geometry of the fullerene with larger fullerenes forming relatively smaller agglomerates. We evaluated the diffusion coefficients of solvent molecules within the solvation shell of fullerenes and observed that they are much lower than the bulk solvent and are strongly associated with the fullerenes as seen in the corresponding radial distribution functions. To correlate agglomerate size with the binding energy between fullerenes, we evaluated the potential of mean force between fullerenes in each solvent. Consistent with the solubility of fullerenes, binding energy between fullerenes is the greatest in water followed by acetone and toluene. The presence of charge decreases the binding energy of fullerenes in water and thus results in dispersed fullerenes.

  2. Molecular dynamics study of self-agglomeration of charged fullerenes in solvents

    NASA Astrophysics Data System (ADS)

    Banerjee, Soumik

    2013-01-01

    The agglomeration of fullerenes in solvents is an important phenomenon that is relevant to controlled synthesis of fullerene-based nanowires as well as fullerene-based composites. The molecular aggregation in solvents depends on the atomistic interactions of fullerene with the solvent and is made complicated by the fact that fullerenes accrue negative surface charges when present in solvents such as water. In the present work, we simulated fullerenes of varying size and shape (C60, C180, C240, and C540) with and without surface charges in polar protic (water), polar aprotic (acetone), and nonpolar (toluene) solvents using molecular dynamics method. Our results demonstrate that uncharged fullerenes form agglomerates in polar solvents such as water and acetone and remain relatively dispersed in nonpolar toluene. The presence of surface charge significantly reduces agglomerate size in water and acetone. Additionally, the relative influence of surface charge on fullerene agglomeration depends on the size and geometry of the fullerene with larger fullerenes forming relatively smaller agglomerates. We evaluated the diffusion coefficients of solvent molecules within the solvation shell of fullerenes and observed that they are much lower than the bulk solvent and are strongly associated with the fullerenes as seen in the corresponding radial distribution functions. To correlate agglomerate size with the binding energy between fullerenes, we evaluated the potential of mean force between fullerenes in each solvent. Consistent with the solubility of fullerenes, binding energy between fullerenes is the greatest in water followed by acetone and toluene. The presence of charge decreases the binding energy of fullerenes in water and thus results in dispersed fullerenes.

  3. Molecular dynamics study of self-agglomeration of charged fullerenes in solvents.

    PubMed

    Banerjee, Soumik

    2013-01-28

    The agglomeration of fullerenes in solvents is an important phenomenon that is relevant to controlled synthesis of fullerene-based nanowires as well as fullerene-based composites. The molecular aggregation in solvents depends on the atomistic interactions of fullerene with the solvent and is made complicated by the fact that fullerenes accrue negative surface charges when present in solvents such as water. In the present work, we simulated fullerenes of varying size and shape (C60, C180, C240, and C540) with and without surface charges in polar protic (water), polar aprotic (acetone), and nonpolar (toluene) solvents using molecular dynamics method. Our results demonstrate that uncharged fullerenes form agglomerates in polar solvents such as water and acetone and remain relatively dispersed in nonpolar toluene. The presence of surface charge significantly reduces agglomerate size in water and acetone. Additionally, the relative influence of surface charge on fullerene agglomeration depends on the size and geometry of the fullerene with larger fullerenes forming relatively smaller agglomerates. We evaluated the diffusion coefficients of solvent molecules within the solvation shell of fullerenes and observed that they are much lower than the bulk solvent and are strongly associated with the fullerenes as seen in the corresponding radial distribution functions. To correlate agglomerate size with the binding energy between fullerenes, we evaluated the potential of mean force between fullerenes in each solvent. Consistent with the solubility of fullerenes, binding energy between fullerenes is the greatest in water followed by acetone and toluene. The presence of charge decreases the binding energy of fullerenes in water and thus results in dispersed fullerenes. PMID:23387595

  4. Effect of nitrogen atomic percentage on N+-bombarded MWCNTs in cytocompatibility and hemocompatibility

    NASA Astrophysics Data System (ADS)

    Zhao, Mengli; Cao, Ye; Liu, Xiaoqi; Deng, Jianhua; Li, Dejun; Gu, Hanqing

    2014-03-01

    N+-bombarded multi-walled carbon nanotubes (N+-bombarded MWCNTs), with different nitrogen atomic percentages, were achieved by different N ion beam currents using ion beam-assisted deposition (IBAD) on MWCNTs synthesized by chemical vapor deposition (CVD). Characterizations of N+-bombarded MWCNTs were evaluated by X-ray photoelectron spectroscopy (XPS), transmission electron microscopy (TEM), Raman spectroscopy, and contact angle. For comparison, the in vitro cytocompatibility of the N+-bombarded MWCNTs with different N atomic percentages was assessed by cellular adhesion investigation using human endothelial cells (EAHY926) and mouse fibroblast cells (L929), respectively. The results showed that the presence of nitrogen in MWCNTs accelerated cell growth and proliferation of cell culture. The higher nitrogen content of N+-bombarded MWCNTs, the better cytocompatibility. In addition, N+-bombarded MWCNTs with higher N atomic percentage displayed lower platelet adhesion rate. No hemolysis can be observed on the surfaces. These results proved that higher N atomic percentage led N+-bombarded MWCNTs to better hemocompatibility.

  5. Assaying effector function in planta using double-barreled particle bombardment.

    PubMed

    Kale, Shiv D; Tyler, Brett M

    2011-01-01

    The biolistic transient gene expression assay is a beneficial tool for studying gene function in vivo. However, biolistic transient assay systems have inherent pitfalls that often cause experimental inaccuracies such as poor transformation efficiency, which can be confused with biological phenomena. The double-barreled gene gun device is an inexpensive and highly effective attachment that enables statistically significant data to be obtained with one-tenth the number of experimental replicates compared to conventional biolistic assays. The principle behind the attachment is to perform two simultaneous bombardments with control and test DNA preparations onto the same leaf. The control bombardment measures the efficiency of the transformation while the ratio of the test bombardment to the control bombardment measures the activity of the gene of interest. With care, the ratio between the pair of bombardments can be highly reproducible from bombardment to bombardment. The double-barreled attachment has been used to study plant resistance (R) gene-mediated responses to effectors, induction and suppression of cell death by a wide variety of pathogen and host molecules, and the role of oömycete effector RXLR motifs in cell reentry.

  6. Effect of nitrogen atomic percentage on N+-bombarded MWCNTs in cytocompatibility and hemocompatibility.

    PubMed

    Zhao, Mengli; Cao, Ye; Liu, Xiaoqi; Deng, Jianhua; Li, Dejun; Gu, Hanqing

    2014-01-01

    N+-bombarded multi-walled carbon nanotubes (N+-bombarded MWCNTs), with different nitrogen atomic percentages, were achieved by different N ion beam currents using ion beam-assisted deposition (IBAD) on MWCNTs synthesized by chemical vapor deposition (CVD). Characterizations of N+-bombarded MWCNTs were evaluated by X-ray photoelectron spectroscopy (XPS), transmission electron microscopy (TEM), Raman spectroscopy, and contact angle. For comparison, the in vitro cytocompatibility of the N+-bombarded MWCNTs with different N atomic percentages was assessed by cellular adhesion investigation using human endothelial cells (EAHY926) and mouse fibroblast cells (L929), respectively. The results showed that the presence of nitrogen in MWCNTs accelerated cell growth and proliferation of cell culture. The higher nitrogen content of N+-bombarded MWCNTs, the better cytocompatibility. In addition, N+-bombarded MWCNTs with higher N atomic percentage displayed lower platelet adhesion rate. No hemolysis can be observed on the surfaces. These results proved that higher N atomic percentage led N+-bombarded MWCNTs to better hemocompatibility. PMID:24666845

  7. Power and Charge Deposition and Electron Transport in Disordered SiO2 Layers Under Electron Bombardment

    NASA Astrophysics Data System (ADS)

    Wilson, Gregory; Dennison, J. R.; Jensen, Amberly; Dekany, Justin

    2013-03-01

    Power and charge deposition in multilayer dielectrics from electron bombardment is dependent on the flux and energy-dependent electron penetration depth of the electron beam. Using the Continuous Slow Down Approximation (CSDA), a composite analytical formula has been developed to approximate the electron range which can be related to the dose rate, deposited power and Radiation Induced Conductivity (RIC). Based on the constituent layer geometry and material, the deposited charge can also be inferred. Three separate pulsed electron beam experiments were conducted to measure charge deposition, power dependent cathodoluminescence and RIC. The power and charge deposition experiments measured the net surface potential, electrode currents and electron induced luminescence of disordered SiO2 multilayer dielectrics with a grounded or floating conductive middle layer, using beam energies from 200 eV to 25 keV at <40 K to room temperature. These results showed that the power and charge deposition's dependence on electron beam flux and incident energy compare favorably with the model predictions. The RIC experiments measured electrode currents using disordered SiO2 layers from <40 K to >320 K with dose rates from 10-5 Gy/s to 10-1 Gy/s. The onset of RIC in the energy-dependant depth of the RIC region provides an explanation for observed retrograde charging. This work supported by the NASA Goddard Space Flight Center and an NRC Senior Research Fellowship at AFRL.

  8. Computer simulations of material ejection during C60 and Arm bombardment of octane and β-carotene

    NASA Astrophysics Data System (ADS)

    Palka, G.; Kanski, M.; Maciazek, D.; Garrison, B. J.; Postawa, Z.

    2015-06-01

    Molecular dynamics (MD) computer simulations are used to investigate material ejection and fragment formation during keV C60 and Arm (m = 60, 101, 205, 366, 872 and 2953) bombardment of organic solids composed from octane and β-carotene molecules at 0° and 45° impact angle. Both systems are found to sputter efficiently. For the octane system, material removal occurs predominantly by ejection of intact molecules, while fragment emission is a significant ejection channel for β-carotene. A difference in the molecular dimensions is proposed to explain this observation. It has been shown that the dependence of the sputtering yield Y on the primary kinetic energy E and the cluster size n can be expressed in a simplified form if represented in reduced units. A linear and nonlinear dependence of the Y/n on the E/n are identified and the position of the transition point from the linear to nonlinear regions depends on the size of the cluster projectile. The impact angle has a minor influence on the shape of the simplified representation.

  9. Photodynamic Therapy with Blended Conducting Polymer/Fullerene Nanoparticle Photosensitizers.

    PubMed

    Doshi, Mona; Gesquiere, Andre J

    2015-10-28

    In this article a method for the fabrication and reproducible in-vitro evaluation of conducting polymer nanoparticles blended with fullerene as the next generation photosensitizers for Photodynamic Therapy (PDT) is reported. The nanoparticles are formed by hydrophobic interaction of the semiconducting polymer MEH-PPV (poly[2-methoxy-5-(2-ethylhexyloxy)-1,4-phenylenevinylene]) with the fullerene PCBM (phenyl-C61-butyric acid methyl ester) in the presence of a non-compatible solvent. MEH-PPV has a high extinction coefficient that leads to high rates of triplet formation, and efficient charge and energy transfer to the fullerene PCBM. The latter processes enhance the efficiency of the PDT system through fullerene assisted triplet and radical formation, and ultrafast deactivation of MEH-PPV excited stated. The results reported here show that this nanoparticle PDT sensitizing system is highly effective and shows unexpected specificity to cancer cell lines.

  10. Role of Conformation in - Interactions and Polymer/Fullerene Miscibility

    SciTech Connect

    Sumpter, Bobby G; Bucknall, David G.; Thio, Yonathan S; Gurun, Bilge; Campbell, Katie

    2011-01-01

    The origin of the miscibility between C60 fullerene and a series of phenylic vinyl polymers has been investigate using a combination of wide-angle x-ray (WAXS) and neutron (WANS) scattering and density functional theory (DFT) computational modeling. The solubility limit of the C60 in the polymers was found to increase non-linearly with increasing phenylic groups in the side-chain from 1 wt% in polystyrene (PS) to 12 wt% in poly(9-vinyl phenanthrene) (P9VPh). The DFT calculations showed that the polymer interacts with the fullerene preferentially with the phenylic groups in these vinyl polymers. However, due to the backbone these phenyl groups are unable to form the energetically favorable T-junction or planar - stacks with the fullerene, and are randomly oriented to the cage. The non-linear increase in solubility is believed to be associated with shape conformity of the three ring phenanthrene to the curvature of the fullerene.

  11. Real time microscopy, kinetics, and mechanism of giant fullerene evaporation.

    PubMed

    Huang, J Y; Ding, Feng; Jiao, Kun; Yakobson, Boris I

    2007-10-26

    We report in situ high-resolution transmission electron microscopy observing the shrinkage of single-layer giant fullerenes (GF). At temperatures approximately 2000 degrees C, the GF volume reduces by greater than one 100-fold while the fullerene shell remains intact, evolving from a slightly polygonized to a nearly spherical shape with a smaller diameter. The number of carbon atoms in the GF decreases linearly with time until the small subbuckyball cage opens and rapidly disappears. Theoretical modeling indicates that carbon atoms are removed predominantly from the weakest binding energy sites, i.e., the pentagons, leading to the constant evaporation rate. The fullerene cage integrity is attributed to the collective behavior of interacting defects. These results constitute the first experimental evidence for the "shrink-wrapping" and "hot-giant" fullerene formation mechanisms.

  12. Fullerene-Encapsulated Atoms in the Light of Synchrotron Radiation

    SciTech Connect

    Mueller, A.; Schippers, S.; Esteves, D.; Habibi, M.; Phaneuf, R. A.; Kilcoyne, A. L. D.; Aguilar, A.; Dunsch, L.

    2009-12-03

    Mass-selected beams of endohedral fullerene Ce-C{sub 82}{sup +} ions, of atomic Ce{sup q+} ions (q = 2, 3, 4), and of empty fullerene-cage C{sub 82}{sup +} ions were employed to study photoionization of fullerene-encapsulated and free cerium atoms. The Ce 4d inner-shell contributions to single and double ionization of the endohedral Ce-C{sub 82}{sup +} fullerene have been extracted from the data and compared with expectations based on theory and the experiments with atomic Ce ions. Dramatic reduction and redistribution of the ionization contributions to Ce 4d photoabsorption is observed. More than half of the Ce 4d oscillator strength is apparently diverted to additional decay channels of the Ce-C{sub 82}{sup +} complex.

  13. Hydrogen storage in fullerenes and in an organic hydride

    SciTech Connect

    Wang, J.C.; Murphy, R.W.; Chen, F.C.; Loutfy, R.O.; Veksler, E.; Li, W.

    1998-05-29

    While the authors have demonstrated the importance and usefulness of thermal management to the hydrogen storage in fullerenes, their recent effort has concentrated on materials improvement and physical model development. In this paper, they report the results of this effort as follows: (1) Liquid phase hydrogenation of fullerenes indicated that more than 6 wt% capacity can be obtained at 180 C, 350--400 psi; (2) Dehydrogenation of fullerenes hydrides below 225 C was demonstrated using an Ir-based P-C-P pincer complex catalyst; (3) Cyclic hydrogenation and dehydrogenation tests of an organic hydride at 7 wt% capacity were conducted at 180--260 C; and (4) Physical models developed for fullerenes were determined to be applicable to this organic hydride (with much smaller activation energies).

  14. Production and Consumption of Reactive Oxygen Species by Fullerenes

    EPA Science Inventory

    Reactive oxygen species (ROS) are one of the most important intermediates in chemical, photochemical, and biological processes. To understand the environmental exposure and toxicity of fullerenes better, the production and consumption of ROS (singlet oxygen, superoxide, hydrogen ...

  15. Role of a fullerene shell upon stuffed atom polarization potential

    NASA Astrophysics Data System (ADS)

    Amusia, M. Ya.; Chernysheva, L. V.

    2016-02-01

    We have demonstrated that the polarization of the fullerene shell considerably alters the polarization potential of an atom, stuffed inside a fullerene. This essentially affects the electron elastic scattering phases as well as corresponding cross sections. We illustrate the general trend by particular examples of electron scattering upon endohedrals Ne@C60 and Ar@C60. To obtain the presented results, we have suggested a simplified approach that permits to incorporate the effect of fullerenes polarizability into the Ne@C60 and Ar@C60 polarization potential. By applying this approach, we obtained numeric results that show strong variations in shape and magnitudes of scattering phases and cross sections due to effect of fullerene polarization upon the endohedral polarization potential.

  16. Changes in a surface of polycrystalline aluminum upon bombardment with argon ions

    NASA Astrophysics Data System (ADS)

    Ashkhotov, O. G.; Ashkhotova, I. B.; Bliev, A. P.; Magkoev, T. T.; Krymshokalova, D. A.

    2014-10-01

    The interaction between argon ions and a natural oxide layer of polycrystalline aluminum is studied via Auger electron (AE) and electron energy loss (EEL) spectroscopy. It is found that bombardment with argon ions whose energy is lower than the Al2O3 sputtering threshold results in the accumulation of bombarding ions in interstitial surface voids, thus forming a supersaturated solid solution of target atoms and bombarding ions of argon and nitrogen entrapped by the ion beam from the residual gas of the working chamber of the spectrometer.

  17. Electron-beam-deposited thin polymer films - Electrical properties vs bombarding current.

    NASA Technical Reports Server (NTRS)

    Babcock, L. E.; Christy, R. W.

    1972-01-01

    Polymer films about 150 A thick, deposited on glass substrates by electron bombardment of tetramethyltetraphenyltrisiloxane, were studied, after being sandwiched between evaporated aluminum electrodes, the top one semitransparent. The capacitance, conductance, and photoconductance of the sandwiches were measured at room temperature as a function of the electron bombarding current which formed the polymer. The polymer thickness was obtained independently from Christy's (1960) empirical formula for the rate of formation. The obtained results indicate that, with increasing bombarding current, the polymer undergoes an increase in both crosslinking bonds and dangling bonds. Exposure to air drastically reduces the density of dangling bonds, but does not affect the crosslinking.

  18. Metal Evaporation-Induced Degradation of Fullerene Acceptors in Polymer/Fullerene Solar Cells.

    PubMed

    Huang, Wenchao; Gann, Eliot; Thomsen, Lars; Tadich, Anton; Cheng, Yi-Bing; McNeill, Christopher R

    2016-01-27

    Surface-sensitive NEXAFS spectroscopy is used to probe the interaction between low work function metal electrodes and fullerene derivatives in organic solar cells. Evaporation of either Ca or Al electrodes onto films of the fullerene derivatives (6,6)-phenyl-C61-butyric acid methyl ester (PCBM) and indene-C60 bisadduct (ICBA) leads to a dramatic change in the observed NEXAFS spectrum. The observed changes cannot be explained only in terms of interfacial electronic doping or charge transfer, but rather point to the formation of new chemical bonds that destroy the extensive electron delocalization on the C60 cage. A combination of ex situ and in situ ultrahigh vacuum measurements indicates that metal evaporation results in a change in the electronic structure of PCBM that then facilitates chemical degradation and oxidation in the presence of oxygen. To investigate the effect of this chemical interaction on device performance, a unique transfer method to laminate the Al electrode to the top of polymer blend is used, in which case, the chemical degradation of the fullerene is not observed. Device performance of P3HT/PCBM blend solar cells in which the top metal electrode has either been thermally evaporated or transferred is then compared. These results highlight that chemical, as well as electronic, interactions between metals and organic semiconductors must be considered.

  19. On Universality in Sputtering Yields Due to Cluster Bombardment.

    PubMed

    Paruch, Robert J; Garrison, Barbara J; Mlynek, Maksymilian; Postawa, Zbigniew

    2014-09-18

    Molecular dynamics simulations, in which atomic and molecular solids are bombarded by Arn (n = 60-2953) clusters, are used to explain the physics that underlie the "universal relation" of the sputtering yield Y per cluster atom versus incident energy E per cluster atom (Y/n vs E/n). We show that a better representation to unify the results is Y/(E/U0) versus (E/U0)/n, where U0 is the sample cohesive energy per atom or molecular equivalent, and the yield Y is given in the units of atoms or molecular equivalents for atomistic and molecular solids, respectively. In addition, we identified a synergistic cluster effect. Specifically, for a given (E/U0)/n value, larger clusters produce larger yields than the yields that are only proportional to the cluster size n or equivalently to the scaled energy E/U0. This synergistic effect can be described in the high (E/U0)/n regime as scaling of Y with (E/U0)(α), where α > 1.

  20. Experimental Investigation of Neutral Species from Micrometeoroid Bombardment

    NASA Astrophysics Data System (ADS)

    Collette, A.; Sternovsky, Z.; Rocha, J. R.; Munsat, T. L.; Horanyi, M.

    2014-12-01

    Surface-boundary exospheres exist in a balance between source and loss processes. An important area of uncertainty, highlighted by the MESSENGER observations of Mg and Ca at Mercury, and the recently concluded LADEE observations at the Moon, is the role of micrometeoroid bombardment as a source process for liberating surface species. Unlike sputtering or photon stimulated desorption processes, the physics of micrometeoroid impacts are still poorly understood; in particular, no comprehensive model exists to predict partitioning of impact products between ejecta fragments, charged particles, and neutrals. We present initial experiments at the IMPACT dust accelerator facility (University of Colorado Boulder) aimed at directly measuring the fraction of neutral species liberated in micrometeoroid impacts. Simulated micrometeoroids (micron- and submicron-sized iron spheres) are fired at targets containing refractory elements, including fused silica (SiO2), sapphire (Al2O3), and magnesium fluoride (MgF2). Total quantities of specific impact-generated neutral species are measured using a mass spectrometer, as a function of impactor speed and mass, and compared with well-established scaling laws for charged particle production.

  1. Determination of Betaines by Fast Atom Bombardment Mass Spectrometry 1

    PubMed Central

    Rhodes, David; Rich, Patrick J.; Myers, Ann C.; Reuter, Carol C.; Jamieson, Gene C.

    1987-01-01

    A rapid, sensitive, and selective method for the determination of betaines is described and discussed. The method entails derivatizing the quaternary ammonium compounds to increase their sensitivity to detection by fast atom bombardment mass spectrometry. Sensitivity of detection increases markedly as the length of the carbon chain of the alcohol used to esterify the betaine carboxylic acid group is increased (C4 > C3 > C2 > C1 > C0). The lower limit of detection of glycine betaine as the n-propyl ester is 0.05 nanomole per microliter of glycerol. Betaine aldehyde can be readily derivatized to the di-n-butyl or di-n-propyl acetal derivatives which exhibit lower limits of detection of about 5 picomoles and 10 picomoles per microliter of glycerol, respectively. Accurate quantification of these compounds is accomplished by the use of deuterium labeled internal standards or quaternary ammonium compound homologs of distinct mass. Methods for the synthesis of these internal standards are reported. Some applications of these methods are illustrated with stable isotope tracer studies on the kinetics of metabolism of choline to betaine aldehyde and glycine betaine in spinach leaf discs, and the identification of several Zea mays genotypes which appear deficient in glycine betaine. Tracer studies with deuterium labeled betaine aldehyde suggest that the deficiency of glycine betaine in one sweet corn hybrid is probably not due to a deficiency in the capacity to oxidize betaine aldehyde. PMID:16665522

  2. Production of high-Q ions by laser bombardment method

    SciTech Connect

    Phaneuf, R.A.

    1980-01-01

    The expanding plasma produced when an intense pulse of laser radiation is focused in vacuum onto a solid target has been used as a source of highly stripped ions for collision cross-section measurements. Usable fluxes of carbon nuclei at energies of a few hundred eV/charge have been obtained by irradiation of graphite with pulses of CO/sub 2/ laser radiation at a focused power density of 3 x 10/sup 10/ W/cm/sup 2/. Bombardment of aluminum and iron targets at comparable power levels have yielded ions of maximum charges of 9 and 16, respectively. A time-of-flight apparatus has been constructed to utilize the laser source for measurement of electron capture cross sections for highly stripped ions in gases at energies in the few hundred eV/charge range. Apertures collimate an ion beam from the plasma blowoff, and an electrostatic analyzer selects ions from the expanding plasma which have the same energy per charge. The beam is directed through a gas target cell, charge analyzed once more by deceleration, and detected by a channel plate electron multiplier used in a current amplification mode. Electron capture cross sections have been measured for C/sup +q/ ions, q = 3, 4, 5 in H/sub 2/ at energies ranging from 150 to 1160 eV/charge.

  3. Fast atom bombardment tandem mass spectrometry of carotenoids

    SciTech Connect

    van Breeman, R.B.; Schmitz, H.H.; Schwartz, S.J.

    1995-02-01

    Positive ion fast atom bombardment (FAB) tandem mass spectrometry (MS-MS) using a double-focusing mass spectrometer with linked scanning at constant B/E and high-energy collisionally activated dissociation (CAD) was used to differentiate 17 different cartenoids, including {beta}-apo-8{prime}- carotenal, astaxanthin, {alpha}-carotene, {beta}-carotene, {gamma}-carotene, {zeta}-carotene, canthaxanthin, {beta}-cryptoxanthin, isozeaxanthin bis (pelargonate), neoxanthin, neurosporene, nonaprene, lutein, lycopene, phytoene, phytofluene, and zeaxanthin. The carotenoids were either synthetic or isolated from plant tissues. The use of FAB ionization minimized degradation or rearrangement of the carotenoid structures due to the inherent thermal instability generally ascribed to these compounds. Instead of protonated molecules, both polar xanthophylls and nonpolar carotenes formed molecular ions, M{sup {center_dot}+}, during FAB ionization. Following collisionally activated dissociation, fragment ions of selected molecular ion precursors showed structural features indicative of the presence of hydroxyl groups, ring systems, ester groups, and aldehyde groups and the extent of aliphatic polyene conjugation. The fragmentation patterns observed in the mass spectra herein may be used as a reference for the structural determination of carotenoids isolated from plant and animal tissues. 18 refs., 4 figs.

  4. Compact Electron Gun Based on Secondary Emission Through Ionic Bombardment

    PubMed Central

    Diop, Babacar; Bonnet, Jean; Schmid, Thomas; Mohamed, Ajmal

    2011-01-01

    We present a new compact electron gun based on the secondary emission through ionic bombardment principle. The driving parameters to develop such a gun are to obtain a quite small electron gun for an in-flight instrument performing Electron Beam Fluorescence measurements (EBF) on board of a reentry vehicle in the upper atmosphere. These measurements are useful to characterize the gas flow around the vehicle in terms of gas chemical composition, temperatures and velocity of the flow which usually presents thermo-chemical non-equilibrium. Such an instrument can also be employed to characterize the upper atmosphere if placed on another carrier like a balloon. In ground facilities, it appears as a more practical tool to characterize flows in wind tunnel studies or as an alternative to complex electron guns in industrial processes requiring an electron beam. We describe in this paper the gun which has been developed as well as its different features which have been characterized in the laboratory. PMID:22163896

  5. Actinide production from xenon bombardments of curium-248

    SciTech Connect

    Welch, R.B.

    1985-01-01

    Production cross sections for many actinide nuclides formed in the reaction of /sup 129/Xe and /sup 132/Xe with /sup 248/Cm at bombarding energies slightly above the coulomb barrier were determined using radiochemical techniques to isolate these products. These results are compared with cross sections from a /sup 136/Xe + /sup 248/Cm reaction at a similar energy. When compared to the reaction with /sup 136/Xe, the maxima in the production cross section distributions from the more neutron deficient projectiles are shifted to smaller mass numbers, and the total cross section increases for the production of elements with atomic numbers greater than that of the target, and decreases for lighter elements. These results can be explained by use of a potential energy surface (PES) which illustrates the effect of the available energy on the transfer of nucleons and describes the evolution of the di-nuclear complex, an essential feature of deep-inelastic reactions (DIR), during the interaction. The other principal reaction mechanism is the quasi-elastic transfer (QE). Analysis of data from a similar set of reactions, /sup 129/Xe, /sup 132/Xe, and /sup 136/Xe with /sup 197/Au, aids in explaining the features of the Xe + Cm product distributions, which are additionally affected by the depletion of actinide product yields due to deexcitation by fission. The PES is shown to be a useful tool to predict the general features of product distributions from heavy ion reactions.

  6. Comet impacts and chemical evolution on the bombarded earth

    NASA Technical Reports Server (NTRS)

    Oberbeck, Verne R.; Aggarwal, Hans

    1992-01-01

    Amino acids yields for previously published shock tube experiments are used with minimum Cretaceous-Tertiary (K/T) impactor mass and comet composition to predict AIB amino acid K/T boundary sediment column density. The inferred initial concentration of all amino acids in the K/T sea and in similar primordial seas just after 10 km comet impacts would have been at least 10 exp -7 M. However, sinks for amino acids must also be considered in calculating amino acid concentrations after comet impacts and in assessing the contribution of comets to the origin of life. The changing concentration of cometary amino acids due to ultraviolet light is compared with the equilibrium concentration of amino acids produced in the sea from corona discharge in the atmosphere, deposition in water, and degradation by ultraviolet light. Comets could have been more important than endogenous agents for initial evolution of amino acids. Sites favorable for chemical evolution of amino acids are examined, and it is concluded that chemical evolution could have occurred at or above the surface even during periods of intense bombardment of earth before 3.8 billion years ago.

  7. Fullerenes, Noble Gases and the Flux of Extraterrestrial Debris to

    NASA Astrophysics Data System (ADS)

    Becker, Luann; Poreda, Robert; Bunch, Ted

    The discovery of fullerenes in deposits associated with two separate impact events involving a large bolide with the Earth suggests that these carbon (C) molecules may also be an indicator of extraterrestrial (ET) events over geologic time. Fullerenes were detected in carbon-rich breccias (Onaping Fm.) associated with the 1.85 byr Sudbury Crater (Becker et al., Science 265, 1994) and in clay sediments within the 65 myr old Cretaceous/Tertiary (K/T) boundary (Heymann et al., Science 265, 1994). To determine the origin of the Sudbury fullerenes, we searched for noble gases trapped inside the fullerene molecules (Saunders et al., Science 259, 1993). The Sudbury fullerenes contain trapped 3He/4He ratios (~5.5 times 10^{-4}) similar to those found in meteorites and some interplanetary dust particles (Becker et al., Science 272, 1996). Preliminary measurements of He in a continental K/T fullerene residue from Raton Basin (Colorado) revealed ^3He/^4He ratios some 100 times above air. A marine K/T residue from Stevns Klint, (Denmark) revealed ^3He/^4He ratios several thousand times above air in the high temperature fraction! We attribute the anomalously high ^3He/^4He ratios and high ^3He concentration in Stevns Klint to the abundance of higher fullerenes in the residue. The high ^3He/^4He ratio in the K/T fullerenes suggests that they were present in the bolide and somehow survived the impact event. Confirmation of these results could have broad implications concerning the importance of exogenous delivery in providing carbon, volatiles and perhaps other organics to the early Earth's crustal reservoir.

  8. Polynuclear aromatic hydrocarbons for fullerene synthesis in flames

    DOEpatents

    Alford, J. Michael; Diener, Michael D.

    2006-12-19

    This invention provides improved methods for combustion synthesis of carbon nanomaterials, including fullerenes, employing multiple-ring aromatic hydrocarbon fuels selected for high carbon conversion to extractable fullerenes. The multiple-ring aromatic hydrocarbon fuels include those that contain polynuclear aromatic hydrocarbons. More specifically, multiple-ring aromatic hydrocarbon fuels contain a substantial amount of indene, methylnapthalenes or mixtures thereof. Coal tar and petroleum distillate fractions provide low cost hydrocarbon fuels containing polynuclear aromatic hydrocarbons, including without limitation, indene, methylnapthalenes or mixtures thereof.

  9. Propagation of ripple patterns on Si during ion bombardment

    NASA Astrophysics Data System (ADS)

    Hofsäss, H.; Zhang, K.; Gehrke, H. G.; Brüsewitz, C.

    2013-08-01

    The lateral propagation of surface ripples on Si, generated by Xe ion irradiation with and without codeposition of Fe surfactant atoms, was investigated by scanning electron microscopy with the help of micron-sized marker structures prepared by focused ion beam milling. For 10-keV Xe ion irradiation of Si at oblique incidence between 62 and 70°, we determine lateral ripple propagation velocities varying from -1.9 to +2.9 nm per 1015 Xe ions/cm2. The propagation direction changes from opposite to the projected direction of the incident ion beam to along the projected beam direction within a narrow angular regime. At 67°, the pattern is almost static. The result is in good agreement with predictions from the theoretical model of Bradley and Harper. For perpendicular incident 5-keV Xe ions and oblique codeposition of Fe surfactant atoms, we find that ripple patterns propagate across the surface with a negative ripple propagation velocity of about -0.7 nm per 1015 Xe ions/cm2, i.e., opposite to the projected deposition direction of Fe surfactant atoms. The novel experimental method to determine the lateral ripple propagation based on markers set with a focused ion beam system does not require an in situ analysis and can therefore be applied in general to analyze the dynamics of ion beam-induced patterns.

  10. Physics of a 17 keV neutrino.

    NASA Astrophysics Data System (ADS)

    Kayser, B.

    The possible 17 keV neutrino, if real, cannot be νμ but could be essentially ντ. Relic 17 keV neutrinos from the big bang must have disappeared, through a non-Standard-Model decay or annihilation process, before the present epoch. If one assumes that the 17 keV neutrino is not a Dirac neutrino of the conventional kind, then one is led to picture it as a Dirac neutrino of the unconventional Zeldovich-Konopinski-Mahmoud kind. It is then an amalgam of ντ and ν¯μ.

  11. Effects of Two Fullerene Derivatives on Monocytes and Macrophages.

    PubMed

    Pacor, Sabrina; Grillo, Alberto; Đorđević, Luka; Zorzet, Sonia; Lucafò, Marianna; Da Ros, Tatiana; Prato, Maurizio; Sava, Gianni

    2015-01-01

    Two fullerene derivatives (fullerenes 1 and 2), bearing a hydrophilic chain on the pyrrolidinic nitrogen, were developed with the aim to deliver anticancer agents to solid tumors. These two compounds showed a significantly different behaviour on human neoplastic cell lines in vitro in respect to healthy leukocytes. In particular, the pyrrolidinium ring on the fullerene carbon cage brings to a more active compound. In the present work, we describe the effects of these fullerenes on primary cultures of human monocytes and macrophages, two kinds of immune cells representing the first line of defence in the immune response to foreign materials. These compounds are not recognized by circulating monocytes while they get into macrophages. The evaluation of the pronecrotic or proapoptotic effects, analysed by means of analysis of the purinergic receptor P2X7 activation and of ROS scavenging activity, has allowed us to show that fullerene 2, but not its analogue fullerene 1, displays toxicity, even though at concentrations higher than those shown to be active on neoplastic cells.

  12. Persistent homology for the quantitative prediction of fullerene stability.

    PubMed

    Xia, Kelin; Feng, Xin; Tong, Yiying; Wei, Guo Wei

    2015-03-01

    Persistent homology is a relatively new tool often used for qualitative analysis of intrinsic topological features in images and data originated from scientific and engineering applications. In this article, we report novel quantitative predictions of the energy and stability of fullerene molecules, the very first attempt in using persistent homology in this context. The ground-state structures of a series of small fullerene molecules are first investigated with the standard Vietoris-Rips complex. We decipher all the barcodes, including both short-lived local bars and long-lived global bars arising from topological invariants, and associate them with fullerene structural details. Using accumulated bar lengths, we build quantitative models to correlate local and global Betti-2 bars, respectively with the heat of formation and total curvature energies of fullerenes. It is found that the heat of formation energy is related to the local hexagonal cavities of small fullerenes, while the total curvature energies of fullerene isomers are associated with their sphericities, which are measured by the lengths of their long-lived Betti-2 bars. Excellent correlation coefficients (>0.94) between persistent homology predictions and those of quantum or curvature analysis have been observed. A correlation matrix based filtration is introduced to further verify our findings.

  13. Binding of fullerenes to amyloid beta fibrils: size matters.

    PubMed

    Huy, Pham Dinh Quoc; Li, Mai Suan

    2014-10-01

    Binding affinity of fullerenes C20, C36, C60, C70 and C84 for amyloid beta fibrils is studied by docking and all-atom molecular dynamics simulations with the Amber force field and water model TIP3P. Using the molecular mechanic-Poisson Boltzmann surface area method one can demonstrate that the binding free energy linearly decreases with the number of carbon atoms of fullerene, i.e. the larger is the fullerene size, the higher is the binding affinity. Overall, fullerenes bind to Aβ9-40 fibrils stronger than to Aβ17-42. The number of water molecules trapped in the interior of 12Aβ9-40 fibrils was found to be lower than inside pentamer 5Aβ17-42. C60 destroys Aβ17-42 fibril structure to a greater extent compared to other fullerenes. Our study revealed that the van der Waals interaction dominates over the electrostatic interaction and non-polar residues of amyloid beta peptides play the significant role in interaction with fullerenes providing novel insight into the development of drug candidates against Alzheimer's disease.

  14. Fullerenes synthesis by combined resistive heating and arc discharge techniques.

    PubMed

    Kyesmen, Pannan Isa; Onoja, Audu; Amah, Alexander Nwabueze

    2016-01-01

    The two main electrode techniques for fullerenes production; the direct arc technique and the resistive heating of graphite rod were employed in this work. One of the electrodes was resistively heated to high temperature and subjected to arc discharge along its length by the second graphite rod. Fullerenes solid were extracted from carbon soot samples collected from an installed arc discharge system using the solvent extraction method. The fullerenes solid obtained from carbon soot collected for 2 min of arc discharge run when one of the electrodes was resistively heated at different voltages all gave higher yields (maximum of 67 % higher, at 150 A arc current and 200 Torr chamber pressure) compared to when no resistive heating was carried out. Scanning electron microscopy and ultraviolet visible spectroscopy analysis carried out on all fullerenes solid indicated the presence of fullerenes. The enhancement of fullerenes production by combined resistive and direct arc techniques shows prospect for possible use at industrial level for large scale production. PMID:27563518

  15. Implications of fullerene-60 upon in-vitro LDPE biodegradation.

    PubMed

    Sah, Aditi; Kapri, Anil; Zaidi, M G H; Negi, Harshita; Goel, Reeta

    2010-05-01

    Fullerene-60 nanoparticles were used for studying their influence upon the LDPE biodegradation efficiency of two potential polymer-degrading consortia comprising of three bacterial strains each. At a concentration of 0.01% (w/v) in minimal broth lacking dextrose, fullerene did not have any negative influence upon the consortial growth. However, fullerene was found to be detrimental for bacterial growth at higher concentrations (viz. 0.25%, 0.5% and 1%). Although, addition of 0.01% fullerene into the biodegradation assays containing 5 mg/ml LDPE subsided growth-curves significantly, but subsequent analysis of degraded products revealed enhanced biodegradation. Fourier transform infrared spectroscopy (FT-IR) revealed breakage and formation of chemical bonds along with introduction of nu C-O frequencies into hydrocarbon backbone of LDPE. Further, simultaneous thermogravimetric-differential thermogravimetry-differential thermal analysis (TG-DTG-DTA) revealed higher number of decomposition steps along with a 1,000-fold decrease in the heat of reactions (DeltaH) in fullerene-assisted biodegraded LDPE suggesting probable formation of multiple, macromolecular by-products. This is the first report whereby fullerene-60, which is otherwise considered toxic, has helped to alleviate polymer biodegradation process of bacterial consortia. PMID:20519915

  16. Fullerene derivatives protect endothelial cells against NO-induced damage

    NASA Astrophysics Data System (ADS)

    Lao, Fang; Li, Wei; Han, Dong; Qu, Ying; Liu, Ying; Zhao, Yuliang; Chen, Chunying

    2009-06-01

    Functional fullerene derivatives have been demonstrated with potent antioxidation properties. Nitric oxide (NO) is a free radical that plays a part in leading to brain damage when it is accumulated to a high concentration. The possible scavenging activity of NO by the hydroxylated fullerene derivative C60(OH)22 and malonic acid derivative C60(C(COOH)2)2 was investigated using primary rat brain cerebral microvessel endothelial cells (CMECs). Results demonstrate that sodium nitroprusside (SNP), used as an NO donor, caused a marked decrease in cell viability and an increase in apoptosis. However, fullerene derivatives can remarkably protect against the apoptosis induced by NO assault. In addition, fullerene derivatives can also prevent NO-induced depolymerization of cytoskeleton and damage of the nucleus and accelerate endothelial cell repair. Further investigation shows that the sudden increase of the intercellular reactive oxygen species (ROS) induced by NO was significantly attenuated by post-treatment with fullerene derivatives. Our results suggest that functional fullerene derivatives are potential applications for NO-related disorders.

  17. Persistent Homology for The Quantitative Prediction of Fullerene Stability

    PubMed Central

    Xia, Kelin; Feng, Xin; Tong, Yiying; Wei, Guo Wei

    2014-01-01

    Persistent homology is a relatively new tool often used for qualitative analysis of intrinsic topological features in images and data originated from scientific and engineering applications. In this paper, we report novel quantitative predictions of the energy and stability of fullerene molecules, the very first attempt in employing persistent homology in this context. The ground-state structures of a series of small fullerene molecules are first investigated with the standard Vietoris-Rips complex. We decipher all the barcodes, including both short-lived local bars and long-lived global bars arising from topological invariants, and associate them with fullerene structural details. By using accumulated bar lengths, we build quantitative models to correlate local and global Betti-2 bars respectively with the heat of formation and total curvature energies of fullerenes. It is found that the heat of formation energy is related to the local hexagonal cavities of small fullerenes, while the total curvature energies of fullerene isomers are associated with their sphericities, which are measured by the lengths of their long-lived Betti-2 bars. Excellent correlation coefficients (> 0.94) between persistent homology predictions and those of quantum or curvature analysis have been observed. A correlation matrix based filtration is introduced to further verify our findings. PMID:25523342

  18. Fullerenes and interplanetary dust at the Permian-Triassic boundary.

    PubMed

    Poreda, Robert J; Becker, Luann

    2003-01-01

    We recently presented new evidence that an impact occurred approximately 250 million years ago at the Permian-Triassic boundary (PTB), triggering the most severe mass extinction in the history of life on Earth. We used a new extraterrestrial tracer, fullerene, a third carbon carrier of noble gases besides diamond and graphite. By exploiting the unique properties of this molecule to trap noble gases inside of its caged structure (helium, neon, argon), the origin of the fullerenes can be determined. Here, we present new evidence for fullerenes with extraterrestrial noble gases in the PTB at Graphite Peak, Antarctica, similar to PTB fullerenes from Meishan, China and Sasayama, Japan. In addition, we isolated a (3)He-rich magnetic carrier phase in three fractions from the Graphite Peak section. The noble gases in this magnetic fraction were similar to zero-age deep-sea interplanetary dust particles (IDPs) and some magnetic grains isolated from the Cretaceous-Tertiary boundary. The helium and neon isotopic compositions for both the bulk Graphite Peak sediments and an isolated magnetic fraction from the bulk material are consistent with solar-type gases measured in zero-age deep-sea sediments and point to a common source, namely, the flux of IDPs to the Earth's surface. In this instance, the IDP noble gas signature for the bulk sediment can be uniquely decoupled from fullerene, demonstrating that two separate tracers are present (direct flux of IDPs for (3)He vs. giant impact for fullerene).

  19. Histopathology of fathead minnow (Pimephales promelas) exposed to hydroxylated fullerenes.

    PubMed

    Jovanović, Boris; Whitley, Elizabeth M; Palić, Dušan

    2014-11-01

    Hydroxylated fullerenes are reported to be very strong antioxidants, acting to quench reactive oxygen species, thus having strong potential for important and widespread applications in innovative therapies for a variety of disease processes. However, their potential for toxicological side effects is still largely controversial and unknown. Effects of hydroxylated fullerenes C60(OH)24 on the fathead minnow (Pimephales promelas) were investigated microscopically after a 72-hour (acute) exposure by intraperitoneal injection of 20 ppm of hydroxylated fullerenes per gram of body mass. Cumulative, semi-quantitative histopathologic evaluation of brain, liver, anterior kidney, posterior kidney, skin, coelom, gills and the vestibuloauditory system revealed significant differences between control and hydroxylated fullerene-treated fish. Fullerene-treated fish had much higher cumulative histopathology scores. Histopathologic changes included loss of cellularity in the interstitium of the kidney, a primary site of haematopoiesis in fish, and loss of intracytoplasmic glycogen in liver. In the coelom, variable numbers of leukocytes, including many macrophages and fewer heterophils and rodlet cells, were admixed with the nanomaterial. These findings raise concern about in vivo administration of hydroxylated fullerenes in experimental drugs and procedures in human medicine, and should be investigated in more detail.

  20. Optical heating and rapid transformation of functionalized fullerenes

    NASA Astrophysics Data System (ADS)

    Krishna, Vijay; Stevens, Nathanael; Koopman, Ben; Moudgil, Brij

    2010-05-01

    Irradiating single-walled carbon nanotubes can lead to heat generation or ignition. These processes could be used in medical and industrial applications, but the poor solvent compatibility and high aspect ratios of nanotubes have led to concerns about safety. Here, we show that certain functionalized fullerenes, including polyhydroxy fullerenes (which are known to be environmentally safe and to have therapeutic properties) are heated or ignited by exposure to low-intensity (<102 W cm-2) continuous-wave laser irradiation. We also show that polyhydroxy fullerenes and other functionalized fullerenes can be transformed into single-walled nanotubes, multiwalled nanotubes and carbon onions without the presence of a catalyst by exposure to low-intensity laser irradiation in an oxygen-free environment. To demonstrate the potential usefulness of these processes in applications, we disrupted animal cells dosed with polyhydroxy fullerenes by exposing them to a near-infrared laser for a few seconds, and also ignited an explosive charge in contact with a particle of carboxy fullerenes.

  1. Fullerene embedded shape memory nanolens array.

    PubMed

    Jeon, Sohee; Jang, Jun Young; Youn, Jae Ryoun; Jeong, Jun-Ho; Brenner, Howard; Song, Young Seok

    2013-01-01

    Securing fragile nanostructures against external impact is indispensable for offering sufficiently long lifetime in service to nanoengineering products, especially when coming in contact with other substances. Indeed, this problem still remains a challenging task, which may be resolved with the help of smart materials such as shape memory and self-healing materials. Here, we demonstrate a shape memory nanostructure that can recover its shape by absorbing electromagnetic energy. Fullerenes were embedded into the fabricated nanolens array. Beside the energy absorption, such addition enables a remarkable enhancement in mechanical properties of shape memory polymer. The shape memory nanolens was numerically modeled to impart more in-depth understanding on the physics regarding shape recovery behavior of the fabricated nanolens. We anticipate that our strategy of combining the shape memory property with the microwave irradiation feature can provide a new pathway for nanostructured systems able to ensure a long-term durability. PMID:24253423

  2. Energetics and structures of fullerene crop circles

    NASA Astrophysics Data System (ADS)

    Han, Jie

    1998-01-01

    The energetics and structures of carbon tori are studied using molecular simulation. They include circular and polygonal tori, formed by bending ( n, n) tubes and by joining ( n, n) and ( n+1, n-1) or ( n+2, n-2) tubes with pentagon-heptagon defects, respectively, in which n=5, 8 and 10. The strain energy of a circular and polygonal torus decreases by D-2 and D-1, respectively, where D is the torus diameter. Comparisons in average and local maximum strain suggest that defect-free circular tori are more energetically stable and kinetically accessible than defective polygonal tori. This confirms the hypothesis that circular tori are the predominant constituents of the observed fullerene crop circles in laser-grown single-wall carbon nanotubes.

  3. Beta decay anomalies and the 17-keV conundrum

    SciTech Connect

    Hime, A.

    1993-03-01

    Recent developments in pursuance of the 17-keV neutrino are reviewed. Several different experiments found anomalies in {beta} decay spectra which were consistently interpreted as evidence for a heavy neutrino. On the other hand, recent null results definitively rule out the existence of a 17-keV neutrino, as well as escaping criticisms applicable to earlier experiments. While missing links remain, it seems that any strong evidence for a 17-keV neutrino has vanished. Specifically, the anomalies observed in {sup 35}S and {sup 63}Ni spectra at Oxford can be reinterpreted in terms of electron scattering effects. In addition, the discrepancy amongst internal bremsstrahlung measurements has an instrumental origin, and recent results disfavour a 17-keV neutrino. Anomalies persist in the low energy region of the tritium spectrum which deserve further investigation.

  4. Beta decay anomalies and the 17-keV conundrum

    SciTech Connect

    Hime, A.

    1993-01-01

    Recent developments in pursuance of the 17-keV neutrino are reviewed. Several different experiments found anomalies in [beta] decay spectra which were consistently interpreted as evidence for a heavy neutrino. On the other hand, recent null results definitively rule out the existence of a 17-keV neutrino, as well as escaping criticisms applicable to earlier experiments. While missing links remain, it seems that any strong evidence for a 17-keV neutrino has vanished. Specifically, the anomalies observed in [sup 35]S and [sup 63]Ni spectra at Oxford can be reinterpreted in terms of electron scattering effects. In addition, the discrepancy amongst internal bremsstrahlung measurements has an instrumental origin, and recent results disfavour a 17-keV neutrino. Anomalies persist in the low energy region of the tritium spectrum which deserve further investigation.

  5. Modification of polymer (PET) surface reactivity by low energy ion bombardment

    NASA Astrophysics Data System (ADS)

    Bertrand, P.; De Puydt, Y.; Beuken, J.-M.; Lutgen, P.; Feyder, G.

    The surface of polyethylene terephtalate (PET) was studied by low energy He + ion scattering (ISS). Modifications of the surface composition induced by the He + and Ar + bombardments are observed. The ion bombardment causes surface damages with bond breaking and it results a highly activated surface for the chemisorption of nitrogen from the residual gas phase. Similar effects were observed on highly oriented pyrolytic graphite when analyzed in the same beam conditions.

  6. Particle-In-Cell/Monte Carlo Simulation of Ion Back Bombardment in Photoinjectors

    SciTech Connect

    Qiang, Ji; Corlett, John; Staples, John

    2009-03-02

    In this paper, we report on studies of ion back bombardment in high average current dc and rf photoinjectors using a particle-in-cell/Monte Carlo method. Using H{sub 2} ion as an example, we observed that the ion density and energy deposition on the photocathode in rf guns are order of magnitude lower than that in a dc gun. A higher rf frequency helps mitigate the ion back bombardment of the cathode in rf guns.

  7. Cage connectivity and frontier π orbitals govern the relative stability of charged fullerene isomers.

    PubMed

    Wang, Yang; Díaz-Tendero, Sergio; Alcamí, Manuel; Martín, Fernando

    2015-11-01

    Fullerene anions and cations have unique structural, electronic, magnetic and chemical properties that make them substantially different from neutral fullerenes. Although much theoretical effort has been devoted to characterizing and predicting their properties, this has been limited to a fraction of isomeric forms, mostly for fullerene anions, and has practically ignored fullerene cations. Here we show that the concepts of cage connectivity and frontier π orbitals allow one to understand the relative stability of charged fullerene isomers without performing elaborate quantum chemistry calculations. The latter is not a trivial matter, as the number of possible isomers for a medium-sized fullerene is many more than 100,000. The model correctly predicts the structures observed experimentally and explains why the isolated pentagon rule is often violated for fullerene anions, but the opposite is found for fullerene cations. These predictions are relevant in fields as diverse as astrophysics, electrochemistry and supramolecular chemistry.

  8. Thermal stabilisation of polymer-fullerene bulk heterojunction morphology for efficient photovoltaic solar cells.

    PubMed

    Derue, Lionel; Dautel, Olivier; Tournebize, Aurélien; Drees, Martin; Pan, Hualong; Berthumeyrie, Sébastien; Pavageau, Bertrand; Cloutet, Eric; Chambon, Sylvain; Hirsch, Lionel; Rivaton, Agnès; Hudhomme, Piétrick; Facchetti, Antonio; Wantz, Guillaume

    2014-09-01

    A novel stable bisazide molecule that can freeze the bulk heterojunction morphology at its optimized layout by specifically bonding to fullerenes is reported. The concept is demonstrated with various polymers: fullerene derivatives systems enable highly thermally stable polymer solar cells.

  9. Cage connectivity and frontier π orbitals govern the relative stability of charged fullerene isomers

    NASA Astrophysics Data System (ADS)

    Wang, Yang; Díaz-Tendero, Sergio; Alcamí, Manuel; Martín, Fernando

    2015-11-01

    Fullerene anions and cations have unique structural, electronic, magnetic and chemical properties that make them substantially different from neutral fullerenes. Although much theoretical effort has been devoted to characterizing and predicting their properties, this has been limited to a fraction of isomeric forms, mostly for fullerene anions, and has practically ignored fullerene cations. Here we show that the concepts of cage connectivity and frontier π orbitals allow one to understand the relative stability of charged fullerene isomers without performing elaborate quantum chemistry calculations. The latter is not a trivial matter, as the number of possible isomers for a medium-sized fullerene is many more than 100,000. The model correctly predicts the structures observed experimentally and explains why the isolated pentagon rule is often violated for fullerene anions, but the opposite is found for fullerene cations. These predictions are relevant in fields as diverse as astrophysics, electrochemistry and supramolecular chemistry.

  10. Cage connectivity and frontier π orbitals govern the relative stability of charged fullerene isomers.

    PubMed

    Wang, Yang; Díaz-Tendero, Sergio; Alcamí, Manuel; Martín, Fernando

    2015-11-01

    Fullerene anions and cations have unique structural, electronic, magnetic and chemical properties that make them substantially different from neutral fullerenes. Although much theoretical effort has been devoted to characterizing and predicting their properties, this has been limited to a fraction of isomeric forms, mostly for fullerene anions, and has practically ignored fullerene cations. Here we show that the concepts of cage connectivity and frontier π orbitals allow one to understand the relative stability of charged fullerene isomers without performing elaborate quantum chemistry calculations. The latter is not a trivial matter, as the number of possible isomers for a medium-sized fullerene is many more than 100,000. The model correctly predicts the structures observed experimentally and explains why the isolated pentagon rule is often violated for fullerene anions, but the opposite is found for fullerene cations. These predictions are relevant in fields as diverse as astrophysics, electrochemistry and supramolecular chemistry. PMID:26492014

  11. Back bombardment for dispenser and lanthanum hexaboride cathodes

    NASA Astrophysics Data System (ADS)

    Bakr, Mahmoud; Kinjo, R.; Choi, Y. W.; Omer, M.; Yoshida, K.; Ueda, S.; Takasaki, M.; Ishida, K.; Kimura, N.; Sonobe, T.; Kii, T.; Masuda, K.; Ohgaki, H.; Zen, H.

    2011-06-01

    The back bombardment (BB) effect limits wide usage of thermionic rf guns. The BB effect induces not only ramping-up of a cathode’s temperature and beam current, but also degradation of cavity voltage and beam energy during a macropulse. This paper presents a comparison of the BB effect for the case of dispenser tungsten-base (DC) and lanthanum hexaboride (LaB6) thermionic rf gun cathodes. For each, particle simulation codes are used to simulate the BB effect and electron beam dynamics in a thermionic rf gun cathode. A semiempirical equation is also used to investigate the stopping range and deposited heat power of BB electrons in the cathode material. A numerical simulation method is used to calculate the change of the cathode temperature and current density during a single macropulse. This is done by solving two differential equations for the rf gun cavity equivalent circuit and one-dimensional thermal diffusion equation. High electron emission and small beam size are required for generation of a high-brightness electron beam, and so in this work the emission properties of the cathode are taken into account. Simulations of the BB effect show that, for a pulse of 6μs duration, the DC cathode experiences a large change in the temperature compared with LaB6, and a change in current density 6 times higher. Validation of the simulation results is performed using experimental data for beam current beyond the gun exit. The experimental data is well reproduced using the simulation method.

  12. Microanalysis of Ar and He bombarded biomedical polymer films

    NASA Astrophysics Data System (ADS)

    Manso Silvan, M.; Gago, R.; Valsesia, A.; Climent Font, A.; Duart, J. M. Martínez; Rossi, F.

    2007-04-01

    Implantations onto polyethyleneglycol, polycaprolactone and polymethylmethacrylate, carried out with Ar and He ions at 25 and 100 KeV with fluences of 5 × 1013 cm-2, have been made with identical ion currents (20 μA) but different sweep areas in order to take into account the effect of the ion flux on the composition and structure of these biopolymers. Vibrational (Fourier transformed infrared spectroscopy), microanalytical (Rutherford backscattering and energy recoil detection) and microscopic techniques (atomic force microscopy) confirm that, even in this low fluence regime, the ion flux effect is responsible of scaled modifications. More interestingly, these techniques indicate that the damage seems to be higher for He. All these factors suggest that He could be preferentially used to engineer biomedical polymers exploiting the tailoring opportunities offered by ion flux effects.

  13. Molecular structures of unstable isolated-pentagon-rule fullerenes C72-C86

    NASA Astrophysics Data System (ADS)

    Khamatgalimov, A. R.; Kovalenko, V. I.

    2016-08-01

    Published data on fullerenes C72 to C86 which obey the isolated pentagon rule (IPR) are generalized. Analysis of unstable isolated-pentagon-rule fullerenes is carried out and the instability criteria are formulated. Two main reasons for the instability of IPR fullerene molecules are identified: their radical nature and/or local overstrain. The classification of fullerenes and a revised isolated pentagon rule are presented. The bibliography includes 119 references.

  14. Calculation of the energy loss for an electron passing near giant fullerenes

    NASA Astrophysics Data System (ADS)

    Henrard, L.; Lambin, Ph

    1996-11-01

    We present a theoretical analysis of the electron energy-loss spectra of isolated giant fullerenes. We use a macroscopic dielectric description of spherical onion-like fullerenes and a discrete dipole approximation (DDA) framework for tubular fullerenes. In the DDA model, an anisotropic dynamical polarizability is assigned to each carbon site. We stress the fundamental importance of the hollow character of giant fullerenes in the electron energy-loss resonances.

  15. The development of a fullerene based hydrogen storage system

    SciTech Connect

    Brosha, E.L.; Davey, J.R.; Garzon, F.H.; Gottesfeld, S.

    1998-11-01

    This is the final report of a three-year, Laboratory Directed Research and Development (LDRD) project at Los Alamos National Laboratory (LANL). The project objective was to evaluate hydrogen uptake by fullerene substrates and to probe the potential of the hydrogen/fullerene system for hydrogen fuel storage. As part of this project, the authors have completed and tested a fully automated, computer controlled system for measuring hydrogen uptake that is capable of handling both a vacuum of 1 x 10{sup -6} torr and pressures greater than 200 bars. The authors have first established conditions for significant uptake of hydrogen by fullerenes. Subsequently, hydrogenation and dehydrogenation of pure and catalyst-doped C60 was further studied to probe suitability for hydrogen storage applications. C60 {center_dot} H18.7 was prepared at 100 bar H2 and 400 C, corresponding to hydrogen uptake of 2.6 wt%. Dehydrogenation of C60 {center_dot} H18.7 was studied using thermogravimetric and powder x-ray diffraction analysis. The C60 {center_dot} H18.7 molecule was found to be stable up to 430 C in Ar, at which point the release of hydrogen took place simultaneously with the collapse of the fullerene structure. X-ray diffraction analysis performed on C60 {center_dot} H18.7 samples dehydrogenated at 454 C, 475 C, and 600 C showed an increasing volume fraction of amorphous material due to randomly oriented, single-layer graphine sheets. Evolved gas analysis using gas chromatography and mass spectroscopy confirmed the presence of both H{sub 2} and methane upon dehydrogenation, indicating decomposition of the fullerene. The remaining carbon could not be re-hydrogenated. These results provide the first complete evidence for the irreversible nature of fullerene hydrogenation and for limitations imposed on the hydrogenation/dehydrogenation cycle by the limited thermal stability of the molecular crystal of fullerene.

  16. Impact of physicochemical properties of engineered fullerenes on key biological responses

    SciTech Connect

    Rebecca, Martin; Hsing-Lin, Wang; Jun, Gao; Srinivas, Iyer; Gabriel, Montano A.; Jennifer, Martinez; Andrew, Shreve P.; Bao Yuping; Wang, C.-C.; Chang Zhong; Gao Yuan; Rashi, Iyer

    2009-01-01

    Engineered fullerenes are widely integrated into several commercial and medical products and are now also being recognized as byproducts of many industrial activities. For most applications fullerenes have to be chemically modified. Surface modification of fullerenes can potentially impact their effect on biosystems. The purpose of the current study was to establish criteria to correlate fullerene structure to biological responses. We report studies of cellular responses induced by three different types of fullerenes that provide varying chemical and physical properties such as electronic behavior, solubility, and degree of agglomeration. Using a systematic and multipronged approach for material characterization and employing critical biological endpoints, we determined the impact of the physicochemical properties of fullerenes on cellular interactions. We examined the ability of these fullerenes to regulate intracellular oxidative stress, necrosis and apoptosis in human monocytic THP1 cells. Results indicate that the carboxylate derivatization of fullerenes was the determining factor in their ability to induce apoptosis. In contrast, the dispersion characteristics of fullerenes were found to be more relevant when considering their redox function. We also established a significant role for functionalization-dependent fullerene-regulation of the caspase proteases in the elicited responses. In addition, there was a notable increase in the level of several anti-oxidant enzymes. Collectively, the results clearly indicate that the physicochemical properties of fullerenes significantly influence the elicited biological response, thus impacting future applications. This study is an initial effort to lay the groundwork for routine correlation and predictive analysis on engineered fullerenes, thus expediting their use.

  17. Molecular dynamics studies of the C(60) fullerene associations in aqueous solutions and a biological membrane

    NASA Astrophysics Data System (ADS)

    Li, Liwei

    The associative behavior of C60 fullerenes in water and a biological membrane was studied using computer molecular dynamics (MD) simulations. Multiple histogram method combined with umbrella sampling technique was used in calculating the fullerene pairwise free energy as a function of separation. It was observed that water wets the fullerene surface due to the high fullerene atomic density and therefore the strong fullerene-water dispersion interaction. Despite the fact of the insolubility of fullerenes, water was found to promote the dispersion of fullerenes in aqueous solution. A decomposition of the solvent-induced potential of mean force between fullerenes into entropy and energy (enthalpy) contributions revealed that the water-induced repulsion between fullerenes is energetic in origin, contrasting strongly to entropy-driven association observed for conventional non-polar solutes. The repulsive interaction was observed to decrease at elevated temperature due to an increasing contribution from a relatively weak entropy-driven association. The surface curvature effect was surveyed by studying nanoparticles of different shapes (fullerene, carbon nanotubes and graphenes) with similar chemical structures. As for a potential application of fullerene in biomedical systems, the poly(ethylene oxide) (PEO) modified fullerene derivative interactions in aqueous solution and the bare fullerene-fullerene interactions inside a dimyristoylphosphatidylcholine (DMPC) lipid bilayer were investigated. It shows that while the attraction between two PEO-modified fullerenes is stronger and longer range than that between two bare C60 fullerenes in aqueous solution, the PEO-modified fullerenes do not phase-separate in water but rather aggregate in chainlike clusters at concentrations where unmodified fullerenes completely phase-separate. The results of pairwise fullerene interactions inside a DMPC lipid shows that fullerenes, constrained in the same lateral plane, was found to be

  18. Distorted asymmetric cubic nanostructure of soluble fullerene crystals in efficient polymer:fullerene solar cells.

    PubMed

    Kim, Youngkyoo; Nelson, Jenny; Zhang, Tong; Cook, Steffan; Durrant, James R; Kim, Hwajeong; Park, Jiho; Shin, Minjung; Nam, Sungho; Heeney, Martin; McCulloch, Iain; Ha, Chang-Sik; Bradley, Donal D C

    2009-09-22

    We found that 1-(3-methoxycarbonyl)propyl-1-phenyl-(6,6)C(61) (PCBM) molecules make a distorted asymmetric body-centered cubic crystal nanostructure in the bulk heterojunction films of reigoregular poly(3-hexylthiophene) and PCBM. The wider angle of distortion in the PCBM nanocrystals was approximately 96 degrees , which can be assigned to the influence of the attached side group to the fullerene ball of PCBM to bestow solubility. Atom concentration analysis showed that after thermal annealing the PCBM nanocrystals do preferentially distribute above the layer of P3HT nanocrystals inside devices.

  19. Linear Stability and Instability Patterns in Ion Bombarded Silicon Surfaces

    NASA Astrophysics Data System (ADS)

    Madi, Charbel Said

    2011-12-01

    This thesis is a combined experimental and theoretical study of the fundamental physical mechanisms governing nanoscale surface morphology evolution of Ar + ion bombarded silicon surfaces. I experimentally determined the topographical phase diagram resulting from Ar+ ion irradiation of Si surfaces at room temperature in the linear regime of surface dynamics as we vary the control parameters ion beam energy and incidence angle. At all energies, it is characterized by a diverging wavelength bifurcation from a smooth stable surface to parallel mode ripples (wavevector parallel to the projected ion beam on the surface) as the ion beam incidence angle is varied. At sufficiently high angles theta ≈ 85°, I observed perpendicular mode ripples (wavevector perpendicular to the ion beam). Through real-time Grazing-Incidence Small Angle X-ray Scattering, I have definitively established that ion-induced erosion, which is the consensus predominant cause of pattern formation, is not only of the wrong sign to explain the measured curvature coefficients responsible in driving the surface dynamics, but also is so small in magnitude as to be essentially negligible for pattern formation except possibly at the most grazing angles of incidence where both erosion and redistribution effects converge to zero. That the contribution of ion impact induced prompt atomic redistribution effects entirely overwhelms that of erosion in both the stabilizing and destabilizing regimes is of profound significance, as it overturns the erosion-based paradigm that has dominated the pattern formation field for over two decades. In situ wafer curvature measurements using the Multi-beam Optical Stress Sensor system were performed during amorphization of silicon by normal incidence 250 eV ion irradiation. An average compressive saturation stress built up in the amorphous layer was found to be as large as 1.5 GPa. By assuming the ion-induced amorphization layer to be modeled as a viscoelastic film that is

  20. Wobbling The Galactic Disk with Bombardment of Satellite Galaxies

    NASA Astrophysics Data System (ADS)

    D'Onghia, Elena

    We propose to assess the effect of impacts of large visible satellite galaxies on a disk, as well as the relevance of the continuing bombardment of the Galactic disk by dark matter clumps as predicted by the current cosmological framework that can wobble the disk, heating it and eventually exciting ragged spiral structures. In particular, we make detailed predictions for observable features such as spiral arms, rings and their associated stars in galactic disks and relate them to the physical processes that drive their formation and evolution in our Milky Way galaxy and nearby spirals. To do this, we will combine analytic methods and numerical simulations that allow us to calculate observables, which we will compare to present and forthcoming observations. Our methodology utilizes a combination of state of the art hydrodynamic simulations of galaxy evolution and multi- wavelength radiative transfer simulations. Our primary goals are: (1) To identify the physical processes that are responsible for spiral structure formation observed in our Milky Way and nearby disk galaxies, from the flocculent to grand- designed spiral galaxies and to provide observable signatures to be compared with data on nearby galaxies combining maps of 24 micron emission (Spitzer) and cold gas, CO (Heracles) and HI (THINGS). (2) To explore different morphologies of spiral galaxies: from the multi-armed galaxies to the Milky Way sized galaxies with few arms. (3) For a Milky Way disk we will assess the effect of impacts of substructures passing through the disk to origin the asymmetry in the number density of stars recently discovered from SDSS and SEGUE data and confirmed from RAVE data. We will also investigate the disk heating in the vertical plane due to the formation of vertical oscillations that are produced by the impact and migration of stars in the disk as consequence of the heating as compared to the classical stellar migration mechanism. (4) We will measure the spiral pattern speed

  1. The first stable lower fullerene: C{sub 36}

    SciTech Connect

    Piskoti, C.; Zettl, A.

    1998-08-01

    A new pure carbon material, presumably composed of thirty six carbon atom molecules, has been synthesized and isolated in milligram quantities. It appears as though these molecules have a closed cage structure making them the smallest member of a new class of molecules known as fullerenes, most notably of which is the soccer ball shaped C{sub 60}. However, unlike other known fullerenes, any closed, fullerene-like C{sub 36} cage will necessarily contain fused pentagon rings. Therefore, this molecule apparently violates the isolated pentagon rule, a criterion which requires isolated pentagons for stability in fullerene molecules. Striking parallels between this problem and the synthesis of other fused five member fused ring systems will be discussed. Also, it will be shown that certain biological structures known as clathrin behave in a manner which gives excellent predictions about fullerenes and nanotubes. These predictions help to explain the presence of abundant quantities of C{sub 36} in arced graphite soot. {copyright} {ital 1998 American Institute of Physics.}

  2. ON THE EXCITATION AND FORMATION OF CIRCUMSTELLAR FULLERENES

    SciTech Connect

    Bernard-Salas, J.; Jones, A. P.; Groenewegen, M. A. T.

    2012-09-20

    We compare and analyze the Spitzer mid-infrared spectrum of three fullerene-rich planetary nebulae in the Milky Way and the Magellanic Clouds: Tc1, SMP SMC 16, and SMP LMC 56. The three planetary nebulae share many spectroscopic similarities. The strongest circumstellar emission bands correspond to the infrared active vibrational modes of the fullerene species C{sub 60} and little or no emission is present from polycyclic aromatic hydrocarbons. The strengths of the fullerene bands in the three planetary nebulae are very similar, while the ratios of the [Ne III]15.5 {mu}m/[Ne II]12.8 {mu}m fine structure lines, an indicator of the strength of the radiation field, are markedly different. This raises questions about their excitation mechanism and we compare the fullerene emission to fluorescent and thermal models. In addition, the spectra show other interesting and common features, most notably in the 6-9 {mu}m region, where a broad plateau with substructure dominates the emission. These features have previously been associated with mixtures of aromatic/aliphatic hydrocarbon solids. We hypothesize on the origin of this band, which is likely related to the fullerene formation mechanism, and compare it with modeled hydrogenated amorphous carbon that present emission in this region.

  3. Theoretical investigation of C56 fullerene isomers and related compounds

    NASA Astrophysics Data System (ADS)

    Chen, De-Li; Tian, Wei Quan; Feng, Ji-Kang; Sun, Chia-Chung

    2008-01-01

    All the 924 classical isomers of fullerene C56 have been investigated by PM3, and some most stable isomers are refined with HCTH/3-21G and B3LYP /6-31G(d) methods. D2:003 with the least number of adjacent pentagons is predicted to be the most stable isomer at B3LYP /6-31G(d) level, while Cs:022 and C2:049 possess nearly degenerate energies with relative energies of 0.03 and 3.90kcal/mol, respectively. However, as to dianionic C562- fullerene, C2v:011 is predicted to be the most stable isomer. Investigations also show that the encapsulation of Ca atom in C56 fullerene is exothermic and the metallofullerenes Ca@C56 can be described as Ca2+@C562-. The computed relative stabilities show that the D2:003 behaves more thermodynamically stable than other isomers in a wide temperature interval, and C2v:011 should also be an important component. The electronic isomerization of C56 (C2v:011) and C50 (D5h:002) indicates that this phenomenon might be rather general in fullerenes and causes different properties, thus bringing about new possible applications of fullerenes. The static second-order hyperpolarizabilities of the three most stable isomers are slightly larger than that of C60.

  4. Theoretical Study of Hydrogen Storage in Ca-Coated Fullerenes.

    PubMed

    Wang, Qian; Sun, Qiang; Jena, Puru; Kawazoe, Yoshiyuki

    2009-02-10

    First principles calculations based on gradient corrected density functional theory and molecular dynamics simulations of Ca decorated fullerene yield some novel results: (1) C60 fullerene decorated with 32 Ca atoms on each of its 20 hexagonal and 12 pentagonal faces is extremely stable. Unlike transition metal atoms that tend to cluster on a fullerene surface, Ca atoms remain isolated even at high temperatures. (2) C60Ca32 can absorb up to 62 H2 molecules in two layers. The first 30 H2 molecules dissociate and bind atomically on the 60 triangular faces of the fullerene with an average binding energy of 0.45 eV/H, while the remaining 32 H2 molecules bind on the second layer quasi-molecularly with an average binding energy of 0.11 eV/H2. These binding energies are ideal for Ca coated C60 to operate as a hydrogen storage material at near ambient temperatures with fast kinetics. (3) The gravimetric density of this hydrogen storage material can reach 6.2 wt %. Simple model calculations show that this density is the limiting value for higher fullerenes.

  5. Fullerene-oxygen-iodine laser (FOIL): physical principles

    NASA Astrophysics Data System (ADS)

    Danilov, Oleg B.; Belousova, Inna M.; Mak, Artur A.; Belousov, Vlidilen P.; Grenishin, A. S.; Kiselev, V. M.; Krys'ko, A. V.; Murav'eva, T. D.; Ponomarev, Alexander N.; Sosnov, Eugene N.

    2004-09-01

    The paper considers the physical principles of developing the fullerene-oxygen-iodine laser (FOIL) with optical (sunlight in particular) pumping. Kinetic scheme of such a laser is considered. It is shown that the utmost efficiency of FOIL may exceed 40% of the energy, absorbed by fullerenes. Presented are the experimental results of singlet oxygen generation in liquid media (solutions and suspensions) and in solid-state structures, containing either fullerenes or fullerene-like nanoparticles (FNP). In experiment was shown the possibility of the singlet oxygen transfer to the gaseous phase by means of organizing of the solution (suspension) the boiling as well as of the gasodynamic wave of desorption from the solid-state structures, containing fullerenes or FNP. We present the preliminary experimental results of pulsed generation in optically pumped FOIL with the use of primary photodissociation of iodide for preparation of the atomic iodine in the generation zone. In the experiments on FOIL generation was implemented the principle of spectral separation of optical pumping.

  6. Fullerene-oxygen-iodine laser (FOIL): physical principles

    NASA Astrophysics Data System (ADS)

    Danilov, Oleg B.; Belousova, Inna M.; Mak, Artur A.; Belousov, Vlidilen P.; Grenishin, A. S.; Kiselev, V. M.; Krys'ko, A. V.; Murav'eva, T. D.; Ponomarev, Alexander N.; Sosnov, Eugene N.

    2004-06-01

    The paper considers the physical principles of developing the fullerene-oxygen-iodine laser (FOIL) with optical (sunlight in particular) pumping. Kinetic scheme of such a laser is considered. It is shown that the utmost efficiency of FOIL may exceed 40% of the energy, absorbed by fullerenes. Presented are the experimental results of singlet oxygen generation in liquid media (solutions and suspensions) and in solid-state structures, containing either fullerenes or fullerene-like nanoparticles (FNP). In experiment was shown the possibility of the singlet oxygen transfer to the gaseous phase by means of organizing of the solution (suspension) the boiling as well as of the gasodynamic wave of desorption from the solid-state structures, containing fullerenes or FNP. We present the preliminary experimental results of pulsed generation in optically pumped FOIL with the use of primary photodissociation of iodide for preparation of the atomic iodine in the generation zone. In the experiments on FOIL generation was implemented the principle of spectral separation of optical pumping.

  7. Table of periodic properties of fullerenes based on structural parameters.

    PubMed

    Torrens, Francisco

    2004-01-01

    The periodic table (PT) of the elements suggests that hydrogen could be the origin of everything else. The construction principle is an evolutionary process that is formally similar to those of Darwin and Oparin. The Kekulé structure count and permanence of the adjacency matrix of fullerenes are related to structural parameters involving the presence of contiguous pentagons p, q and r. Let p be the number of edges common to two pentagons, q the number of vertices common to three pentagons, and r the number of pairs of nonadjacent pentagon edges shared between two other pentagons. Principal component analysis (PCA) of the structural parameters and cluster analysis (CA) of the fullerenes permit classifying them and agree. A PT of the fullerenes is built based on the structural parameters, PCA and CA. The periodic law does not have the rank of the laws of physics. (1) The properties of the fullerenes are not repeated; only, and perhaps, their chemical character. (2) The order relationships are repeated, although with exceptions. The proposed statement is the following: The relationships that any fullerene p has with its neighbor p + 1 are approximately repeated for each period.

  8. Fullerene data mining using bibliometrics and database tomography

    PubMed

    Kostoff; Braun; Schubert; Toothman; Humenik

    2000-01-01

    Database tomography (DT) is a textual database analysis system consisting of two major components: (1) algorithms for extracting multiword phrase frequencies and phrase proximities (physical closeness of the multiword technical phrases) from any type of large textual database, to augment (2) interpretative capabilities of the expert human analyst. DT was used to derive technical intelligence from a fullerenes database derived from the Science Citation Index and the Engineering Compendex. Phrase frequency analysis by the technical domain experts provided the pervasive technical themes of the fullerenes database, and phrase proximity analysis provided the relationships among the pervasive technical themes. Bibliometric analysis of the fullerenes literature supplemented the DT results with author/journal/institution publication and citation data. Comparisons of fullerenes results with past analyses of similarly structured near-earth space, chemistry, hypersonic/supersonic flow, aircraft, and ship hydrodynamics databases are made. One important finding is that many of the normalized bibliometric distribution functions are extremely consistent across these diverse technical domains and could reasonably be expected to apply to broader chemical topics than fullerenes that span multiple structural classes. Finally, lessons learned about integrating the technical domain experts with the data mining tools are presented. PMID:10661546

  9. Fullerene data mining using bibliometrics and database tomography

    PubMed

    Kostoff; Braun; Schubert; Toothman; Humenik

    2000-01-01

    Database tomography (DT) is a textual database analysis system consisting of two major components: (1) algorithms for extracting multiword phrase frequencies and phrase proximities (physical closeness of the multiword technical phrases) from any type of large textual database, to augment (2) interpretative capabilities of the expert human analyst. DT was used to derive technical intelligence from a fullerenes database derived from the Science Citation Index and the Engineering Compendex. Phrase frequency analysis by the technical domain experts provided the pervasive technical themes of the fullerenes database, and phrase proximity analysis provided the relationships among the pervasive technical themes. Bibliometric analysis of the fullerenes literature supplemented the DT results with author/journal/institution publication and citation data. Comparisons of fullerenes results with past analyses of similarly structured near-earth space, chemistry, hypersonic/supersonic flow, aircraft, and ship hydrodynamics databases are made. One important finding is that many of the normalized bibliometric distribution functions are extremely consistent across these diverse technical domains and could reasonably be expected to apply to broader chemical topics than fullerenes that span multiple structural classes. Finally, lessons learned about integrating the technical domain experts with the data mining tools are presented.

  10. Effects of combined irradiation of 500 keV protons and atomic oxygen on polyimide films

    NASA Astrophysics Data System (ADS)

    Novikov, Lev; Chernik, Vladimir; Zhilyakov, Lev; Voronina, Ekaterina; Chirskaia, Natalia

    2016-07-01

    Polyimide films are widely used on the spacecraft surface as thermal control coating, films in different constuctions, etc. However, the space ionizing radiation of different types can alter the mechanical, optical and electrical properties of polyimide films. For example, it is well known that 20-100 keV proton irradiation causes breaking of chemical bonds and destruction of the surface layer in polyimide, deterioration of its optical properties, etc. In low-Earth orbits serious danger for polymeric materials is atomic oxygen of the upper atmosphere of the Earth, which is the main component in the range of heights of 200-800 km. Due to the orbital spacecraft velocity, the collision energy of oxygen atoms with the surface ( 5 eV) enhances their reactivity and opens additional pathways of their reaction with near-surface layers of materials. Hyperthermal oxygen atom flow causes erosion of the polyimide surface by breaking chemical bonds and forming of volatiles products (primarily, CO and CO _{2}), which leads to mass losses and degradation of material properties. Combined effect of protons and oxygen plasma is expected to give rise to synergistic effects enhancing the destruction of polyimide surface layers. This paper describes experimental investigation of polyimide films sequential irradiation with protons and oxygen plasma. The samples were irradiated by 500 keV protons at fluences of 10 ^{14}-10 ^{16} cm ^{-2} produced with SINP cascade generator KG-500 and 5-20 eV neutral oxygen atoms at fluence of 10 ^{20} cm ^{-2} generated by SINP magnetoplasmodynamics accelerator. The proton bombardment causes the decrease in optical transmission coefficient of samples, but their transmittance recovers partially after the exposure to oxygen plasma. The results of the comparative analysis of polyimide optical transmission spectra, Raman and XPS spectra obtained at different stages of the irradiation of samples, data on mass loss of samples due to erosion of the surface are

  11. Theory and mitigation of electron back-bombardment in thermionic cathode radio frequency guns

    NASA Astrophysics Data System (ADS)

    Edelen, Jonathan Paul

    Photocathode RF guns are currently the standard for high- power, low-emittance beam generation in free-electron lasers. These devices require the use of high-power lasers (which are bulky and expensive to operate) and high-quantum-efficiency cathodes (which have limited lifetimes requiring frequent replacement). The use of RF-gated thermionic cathodes enables operation without a large drive laser and with long lifetimes. One major limitation of RF-gated thermionic cathodes is that electrons emitted late in the RF period will not gain enough energy to exit the gun before being accelerated back towards the cathode by the change in sign of the RF field. These electrons deposit their kinetic energy on the cathode surface in the form of heat, limiting the ability to control the output current from the cathode. This dissertation is aimed at understanding the fundamental design factors that drive the back-bombardment process and at exploring novel techniques to reduce its impact on a high-current system. This begins with the development of analytic models that predict the back-bombardment process in single-cell guns. These models are compared with simulation and with a measurement taken at a specific facility. This is followed by the development of analytic models that predict the effects of space-charge on back-bombardment. These models are compared with simulations. This is followed by an analysis of how the addition of multiple cells will impact the back-bombardment process. Finally, a two-frequency gun is studied for its ability to mitigate the back-bombardment process. This dissertation provides new insight on how the back-bombardment process scales as a function of the beam parameters and how space-charge affects this process. Additionally this dissertation shows how a second frequency can be used to mitigate the back-bombardment effect.

  12. [Fullerenes: Characteristics of the substance, biological effects and occupational exposure levels].

    PubMed

    Świdwińska-Gajewska, Anna Maria; Czerczak, Sławomir

    2016-01-01

    Fullerenes are molecules composed of an even number of carbon atoms of a spherical or an ellipsoidal, closed spatial structure. The most common fullerene is the C60 molecule with a spherical structure - a truncated icosahedron, compared to a football. Fullerenes are widely used in the diagnostics and medicine, but also in the electronics and energy industry. Occupational exposure to fullerene may occur during its production. The occupational concentrations of fullerenes reached 0.12-1.2 μ/m3 for nanoparticles fraction (< 100 nm), which may evidence low exposure levels. However, fullerene mostly agglomerates into larger particles. Absorption of fullerene by oral and respiratory routes is low, and it is not absorbed by skin. After intravenous administration, fullerene accumulates mainly in the liver but also in the spleen and the kidneys. In animal experiments there was no irritation or skin sensitization caused by fullerene, and only mild irritation to the eyes. Fullerene induced transient inflammation in the lungs in inhalation studies in rodents. Oral exposure does not lead to major adverse effects. Fullerene was not mutagenic, genotoxic or carcinogenic in experimental research. However, fullerene may cause harmful effects on the mice fetus when administered intraperitoneally or intravenously. Pristine C60 fullerene is characterized by poor absorption and low toxicity, and it does not pose a risk in the occupational environment. The authors of this study are of the opinion that there is no ground for estimating the maximum allowable concentration (NDS) of pristine fullerene C60. Fullerene derivatives, due to different characteristics, require separate analysis in terms of occupational risk assessment. Med Pr 2016;67(3):397-410.

  13. [Fullerenes: Characteristics of the substance, biological effects and occupational exposure levels].

    PubMed

    Świdwińska-Gajewska, Anna Maria; Czerczak, Sławomir

    2016-01-01

    Fullerenes are molecules composed of an even number of carbon atoms of a spherical or an ellipsoidal, closed spatial structure. The most common fullerene is the C60 molecule with a spherical structure - a truncated icosahedron, compared to a football. Fullerenes are widely used in the diagnostics and medicine, but also in the electronics and energy industry. Occupational exposure to fullerene may occur during its production. The occupational concentrations of fullerenes reached 0.12-1.2 μ/m3 for nanoparticles fraction (< 100 nm), which may evidence low exposure levels. However, fullerene mostly agglomerates into larger particles. Absorption of fullerene by oral and respiratory routes is low, and it is not absorbed by skin. After intravenous administration, fullerene accumulates mainly in the liver but also in the spleen and the kidneys. In animal experiments there was no irritation or skin sensitization caused by fullerene, and only mild irritation to the eyes. Fullerene induced transient inflammation in the lungs in inhalation studies in rodents. Oral exposure does not lead to major adverse effects. Fullerene was not mutagenic, genotoxic or carcinogenic in experimental research. However, fullerene may cause harmful effects on the mice fetus when administered intraperitoneally or intravenously. Pristine C60 fullerene is characterized by poor absorption and low toxicity, and it does not pose a risk in the occupational environment. The authors of this study are of the opinion that there is no ground for estimating the maximum allowable concentration (NDS) of pristine fullerene C60. Fullerene derivatives, due to different characteristics, require separate analysis in terms of occupational risk assessment. Med Pr 2016;67(3):397-410. PMID:27364113

  14. Tuning the properties of polymer bulk heterojunction solar cells by adjusting fullerene size to control intercalation

    SciTech Connect

    Cates, N.C.

    2010-02-24

    We demonstrate that intercalation of fullerene derivatives between the side chains of conjugated polymers can be controlled by adjusting the fullerene size and compare the properties of intercalated and nonintercalated poly(2,5-bis(3-hexadecylthiophen-2-yl)thieno[3,2-b]thiophene) (pBTTT):fullerene blends. The intercalated blends, which exhibit optimal solar-cell performance at 1:4 polymer:fullerene by weight, have better photoluminescence quenching and lower absorption than the nonintercalated blends, which optimize at 1:1. Understanding how intercalation affects performance will enable more effective design of polymer:fullerene solar cells.

  15. Liposome Formulation of Fullerene-Based Molecular Diagnostic and Therapeutic Agents

    PubMed Central

    Zhou, Zhiguo

    2013-01-01

    Fullerene medicine is a new but rapidly growing research subject. Fullerene has a number of desired structural, physical and chemical properties to be adapted for biological use including antioxidants, anti-aging, anti-inflammation, photodynamic therapy, drug delivery, and magnetic resonance imaging contrast agents. Chemical functionalization of fullerenes has led to several interesting compounds with very promising preclinical efficacy, pharmacokinetic and safety data. However, there is no clinical evaluation or human use except in fullerene-based cosmetic products for human skincare. This article summarizes recent advances in liposome formulation of fullerenes for the use in therapeutics and molecular imaging. PMID:24300561

  16. Fullerene-rare gas mixed plasmas in an electron cyclotron resonance ion source

    SciTech Connect

    Asaji, T. Ohba, T.; Uchida, T.; Yoshida, Y.; Minezaki, H.; Ishihara, S.; Racz, R.; Biri, S.; Kato, Y.

    2014-02-15

    A synthesis technology of endohedral fullerenes such as Fe@C{sub 60} has developed with an electron cyclotron resonance (ECR) ion source. The production of N@C{sub 60} was reported. However, the yield was quite low, since most fullerene molecules were broken in the ECR plasma. We have adopted gas-mixing techniques in order to cool the plasma and then reduce fullerene dissociation. Mass spectra of ion beams extracted from fullerene-He, Ar or Xe mixed plasmas were observed with a Faraday cup. From the results, the He gas mixing technique is effective against fullerene destruction.

  17. Comparative process analysis of fullerene production by the arc and the radio-frequency discharge methods.

    PubMed

    Marković, Z; Todorović-Marković, B; Mohai, I; Farkas, Z; Kovats, E; Szepvolgyi, J; Otasević, D; Scheier, P; Feil, S; Romcević, N

    2007-01-01

    In this work, comparative analysis of processes in carbon arc and radio frequency (RF) plasma during fullerene synthesis has been presented. The kinetic model of fullerene formation developed earlier has been verified in both types of plasma reactors. The fullerene yield depended on carbon concentration, velocity of plasma flame and rotational temperature of C2 radicals predominantly. When mean rotational temperature of C2 radicals was 3000 K, the fullerene yield was the highest regardless of the type of used reactor. The zone of fullerene formation is larger significantly in RF plasma reactor compared to arc reactor. PMID:17450899

  18. Comparative process analysis of fullerene production by the arc and the radio-frequency discharge methods.

    PubMed

    Marković, Z; Todorović-Marković, B; Mohai, I; Farkas, Z; Kovats, E; Szepvolgyi, J; Otasević, D; Scheier, P; Feil, S; Romcević, N

    2007-01-01

    In this work, comparative analysis of processes in carbon arc and radio frequency (RF) plasma during fullerene synthesis has been presented. The kinetic model of fullerene formation developed earlier has been verified in both types of plasma reactors. The fullerene yield depended on carbon concentration, velocity of plasma flame and rotational temperature of C2 radicals predominantly. When mean rotational temperature of C2 radicals was 3000 K, the fullerene yield was the highest regardless of the type of used reactor. The zone of fullerene formation is larger significantly in RF plasma reactor compared to arc reactor.

  19. Seeded quantum FEL at 478 keV

    SciTech Connect

    Guenther, M. M.; Jentschel, M.; Thirolf, P. G.; Seggebrock, T.; Habs, D.

    2012-07-09

    We present for the first time the concept of a seeded {gamma} quantum Free-Electron-Laser (QFEL) at 478 keV, which has very different properties compared to a classical. The basic concept is to produce a highly brilliant {gamma} beam via SASE. To produce highly intense and coherent {gamma} beam, we intend to use a seeded FEL scheme. Important for the production of such a {gamma} beam are novel refractive {gamma}-lenses for focusing and an efficient monochromator, allowing to generate a very intense and coherent seed beam. The energy of the {gamma} beam is 478 keV, corresponding to a wavelength in the sub-Angstrom regime (1/38 A). To realize a coherent {gamma} beam at 478 keV, it is necessary to use a quantum FEL design. At such high radiation energies a classical description of the {gamma}-FEL becomes wrong.

  20. Compact, maintainable 80-KeV neutral beam module

    DOEpatents

    Fink, Joel H.; Molvik, Arthur W.

    1980-01-01

    A compact, maintainable 80-keV arc chamber, extractor module for a neutral beam system immersed in a vacuum of <10.sup.-2 Torr, incorporating a nested 60-keV gradient shield located midway between the high voltage ion source and surrounding grounded frame. The shield reduces breakdown or arcing path length without increasing the voltage gradient, tends to keep electric fields normal to conducting surfaces rather than skewed and reduces the peak electric field around irregularities on the 80-keV electrodes. The arc chamber or ion source is mounted separately from the extractor or ion accelerator to reduce misalignment of the accelerator and to permit separate maintenance to be performed on these systems. The separate mounting of the ion source provides for maintaining same without removing the ion accelerator.

  1. Accurate van der Waals coefficients between fullerenes and fullerene-alkali atoms and clusters: Modified single-frequency approximation

    NASA Astrophysics Data System (ADS)

    Tao, Jianmin; Mo, Yuxiang; Tian, Guocai; Ruzsinszky, Adrienn

    2016-08-01

    Long-range van der Waals (vdW) interaction is critically important for intermolecular interactions in molecular complexes and solids. However, accurate modeling of vdW coefficients presents a great challenge for nanostructures, in particular for fullerene clusters, which have huge vdW coefficients but also display very strong nonadditivity. In this work, we calculate the coefficients between fullerenes, fullerene and sodium clusters, and fullerene and alkali atoms with the hollow-sphere model within the modified single-frequency approximation (MSFA). In the MSFA, we assume that the electron density is uniform in a molecule and that only valence electrons in the outmost subshell of atoms contribute. The input to the model is the static multipole polarizability, which provides a sharp cutoff for the plasmon contribution outside the effective vdW radius. We find that the model can generate C6 in excellent agreement with expensive wave-function-based ab initio calculations, with a mean absolute relative error of only 3 % , without suffering size-dependent error. We show that the nonadditivities of the coefficients C6 between fullerenes and C60 and sodium clusters Nan revealed by the model agree remarkably well with those based on the accurate reference values. The great flexibility, simplicity, and high accuracy make the model particularly suitable for the study of the nonadditivity of vdW coefficients between nanostructures, advancing the development of better vdW corrections to conventional density functional theory.

  2. Exploration in metallic nitride fullerenes and oxometallic fullerenes: A new class of metallofullerenes

    NASA Astrophysics Data System (ADS)

    Mackey, Mary Alice

    2011-07-01

    Research groups around the world have taken an interest in the synthesis, purification, characterization, and functionalization of Metallic Nitride Fullerenes (MNFs) since their discovery in 1999. This dissertation details the discovery of another new class of molecules---Oxometallic Fullerenes (OMFs). There are many groups worldwide doing research on MNFs, and there is a large database of published MNF research, but we have had a unique opportunity to fill a research void on OMFs as at present no one else is doing research on these molecules; herein we take molecules that we discover and perform seminal research relating to them. MNF research is closely tied to this project; MNFs are a stepping stone because of their greater abundance and similar reactivity. Building off of previously developed techniques, we are able to create new methods for the separation and isolation of MNFs and OMFs. We studied the reactivity differences of various MNFs and OMFs in order to utilize Lewis acid chemistry as a tool for the enrichment and purification of both MNFs and OMFs, eventually resulting in a detailed separations technique. We have also begun studies to functionalize the carbon cage of endohedral metallofullerenes---this research includes using Lewis acids and various aromatic solvents via Friedel-Crafts reactions.

  3. Characterization of fullerenes and fullerene derivatives by small-angle neutron scattering and transmission measurements

    SciTech Connect

    Melnichenko, Y.B.; Wignall, G.D.; Affholter, K.A.

    1997-01-01

    Small-angle neutron scattering (SANS) has been shown to be an appropriate technique for the structural characterization of fullerenes (1) in solvents with strong SANS contrast (e.g. CS{sub 2}) and we have extended initial studies of C{sub 60} (1) to include C{sub 70} and C{sub 84} moieties. Deuterated solvents (e.g. toluene-d{sub 8}) have a high scattering length density (SLD), which is close to that of C{sub 60}, so there is virtually no SANS contrast with the solvent. Hence, these particles are practically {open_quotes}invisible{close_quotes} in such media, though the negative scattering length of hydrogen means that SLD of H{sup 1}-containing materials is much lower, so they have strong contrast with toluene-d{sub 8}. Thus, SANS makes it possible to study the size and shapes of modified buckyballs and this paper describes the first results on cyclohexane-substituted fullerenes.

  4. Supramolecular fullerene-porphyrin chemistry. Fullerene complexation by metalated "jaws porphyrin" hosts.

    PubMed

    Sun, Dayong; Tham, Fook S; Reed, Christopher A; Chaker, Leila; Boyd, Peter D W

    2002-06-12

    Porphyrins and fullerenes are spontaneously attracted to each other. This new supramolecular recognition element is explored in discrete, soluble, coordinatively linked porphyrin and metalloporphyrin dimers. Jawlike clefts in these bis-porphyrins are effective hosts for fullerene guests. X-ray structures of the Cu complex with C60 and free-base complexes with C70 and a pyrrolidine-derivatized C60 have been obtained. The electron-rich 6:6 ring-juncture bonds of C60 show unusually close approach to the porphyrin or metalloporphyrin plane. Binding constants in toluene solution increase in the order Fe(II) < Pd(II) < Zn(II) < Mn(II) < Co(II) < Cu(II) < 2H and span the range 490-5200 M-1. Unexpectedly, the free-base porphyrin binds C60 more strongly than the metalated porphyrins. This is ascribed to electrostatic forces, enhancing the largely van der Waals forces of the pi-pi interaction. The ordering with metals is ascribed to a subtle interplay of solvation and weak interaction forces. Conflicting opinions on the relative importance of van der Waals forces, charge transfer, electrostatic attraction, and coordinate bonding are addressed. The supramolecular design principles arising from these studies have potential applications in the preparation of photophysical devices, molecular magnets, molecular conductors, and porous metal-organic frameworks. PMID:12047181

  5. The Formation of Cosmic Fullerenes from Arophatic Clusters

    NASA Astrophysics Data System (ADS)

    Micelotta, Elisabetta R.; Jones, Anthony P.; Cami, Jan; Peeters, Els; Bernard-Salas, Jeronimo; Fanchini, Giovanni

    2012-12-01

    Fullerenes have recently been identified in space and they may play a significant role in the gas and dust budget of various astrophysical objects including planetary nebulae (PNe), reflection nebulae, and H II regions. The tenuous nature of the gas in these environments precludes the formation of fullerene materials following known vaporization or combustion synthesis routes even on astronomical timescales. We have studied the processing of hydrogenated amorphous carbon (a-C:H or HAC) nanoparticles and their specific derivative structures, which we name "arophatics," in the circumstellar environments of young, carbon-rich PNe. We find that UV-irradiation of such particles can result in the formation of fullerenes, consistent with the known physical conditions in PNe and with available timescales.

  6. THE FORMATION OF COSMIC FULLERENES FROM AROPHATIC CLUSTERS

    SciTech Connect

    Micelotta, Elisabetta R.; Cami, Jan; Peeters, Els; Fanchini, Giovanni; Jones, Anthony P.; Bernard-Salas, Jeronimo

    2012-12-10

    Fullerenes have recently been identified in space and they may play a significant role in the gas and dust budget of various astrophysical objects including planetary nebulae (PNe), reflection nebulae, and H II regions. The tenuous nature of the gas in these environments precludes the formation of fullerene materials following known vaporization or combustion synthesis routes even on astronomical timescales. We have studied the processing of hydrogenated amorphous carbon (a-C:H or HAC) nanoparticles and their specific derivative structures, which we name ''arophatics'', in the circumstellar environments of young, carbon-rich PNe. We find that UV-irradiation of such particles can result in the formation of fullerenes, consistent with the known physical conditions in PNe and with available timescales.

  7. DFT study on a fullerene doped with Si and N

    NASA Astrophysics Data System (ADS)

    Beigi, Hossein Shirani IL

    2013-09-01

    DFT calculations are applied for some stable C60, C59Si, and C59N hetero fullerenes. Sn and Ge atoms are doped at the same position of C60. Computations are carried out at the B3LYP/cc pVDZ levels. In this work the effects of the heteroatoms, Si and N, on the structural properties of the fullerene have been studied. The structure, energetic and relative stabilities of the compounds were compared and analyzed with each other. In addition, vibrations spectra of proposed stable neutral species, as well as the infrared intensities are calculated. From the data obtained from calculation, we found that there is strong correlation between the stability of pure C60 fullerene molecule and the numbers of different C-C bonds.

  8. Endohedral fullerenes for organic photovoltaic devices

    NASA Astrophysics Data System (ADS)

    Ross, Russel B.; Cardona, Claudia M.; Guldi, Dirk M.; Sankaranarayanan, Shankara Gayathri; Reese, Matthew O.; Kopidakis, Nikos; Peet, Jeff; Walker, Bright; Bazan, Guillermo C.; van Keuren, Edward; Holloway, Brian C.; Drees, Martin

    2009-03-01

    So far, one of the fundamental limitations of organic photovoltaic (OPV) device power conversion efficiencies (PCEs) has been the low voltage output caused by a molecular orbital mismatch between the donor polymer and acceptor molecules. Here, we present a means of addressing the low voltage output by introducing novel trimetallic nitride endohedral fullerenes (TNEFs) as acceptor materials for use in photovoltaic devices. TNEFs were discovered in 1999 by Stevenson et al. ; for the first time derivatives of the TNEF acceptor, Lu3N@C80, are synthesized and integrated into OPV devices. The reduced energy offset of the molecular orbitals of Lu3N@C80 to the donor, poly(3-hexyl)thiophene (P3HT), reduces energy losses in the charge transfer process and increases the open circuit voltage (Voc) to 260mV above reference devices made with [6,6]-phenyl-C61-butyric methyl ester (C60-PCBM) acceptor. PCEs >4% have been observed using P3HT as the donor material. This work clears a path towards higher PCEs in OPV devices by demonstrating that high-yield charge separation can occur with OPV systems that have a reduced donor/acceptor lowest unoccupied molecular orbital energy offset.

  9. On the origin of microcraters on the surface of ion beam bombarded plant cell walls

    NASA Astrophysics Data System (ADS)

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

    2006-01-01

    Ion bombardment of plant and bacterial cellular material has recently been used as a tool for the transfer of exogenous DNA macromolecules into the cell interior region. The precise mechanism that leads to the transfer of macromolecules through the cell envelope is not yet clear, however it has been observed that the ion bombardment is accompanied by the formation of "microcraters" on the cell wall, and it is possible that these features provide channels for the macromolecule transfer. Thus the nature and origin of the microcraters is of importance to understanding the DNA transfer phenomenon as well as being of fundamental interest. We report here on some scanning electron microscope observations we have made of onion skin cells that have been subjected to electron beam bombardment of sufficiently high power density to damage the cell wall. The damage seen is much less than and different from the microcraters formed subsequent to ion bombardment. We speculate that the microcraters may originate from the explosive release of gas generated in the biomaterial by ion bombardment.

  10. Ultra-low-energy (<10 eV/u) ion beam bombardment effect on naked DNA

    NASA Astrophysics Data System (ADS)

    Thopan, P.; Thongkumkoon, P.; Prakrajang, K.; Suwannakachorn, D.; Yu, L. D.

    2014-05-01

    Since ion energy deposition in the ion-bombarded materials dominantly occurs in the low-energy range, it is very interesting to know effects from ultra-low-energy ion interaction with DNA for understanding ion-beam-induced genetic mutation. Tens-keV Ar- and N-ion beams were decelerated to ultra-low energy ranging from 20 to 100 eV, or only a few to 10 eV/u, to bombard naked plasmid DNA. The bombarded DNA was analyzed using gel electrophoresis for DNA form changes. The original DNA supercoiled form was found to change to relaxed and linear forms, indicating single or double strand breaks after bombarded by tens-eV ion beam. N-ion beam was found more effective in inducing DNA change and mutation than Ar-ion beam. The study demonstrated that the ion bombardment with energy as low as several-tens eV was able to break DNA strands and thus potentially to cause genetic modification of biological cells. The experimental results were discussed in terms of direct atomic collision between the ions and DNA atoms.

  11. Dielectrophoretic and electrophoretic force analysis of colloidal fullerenes in a nematic liquid-crystal medium.

    PubMed

    Srivastava, Anoop Kumar; Kim, Miyoung; Kim, Sung Min; Kim, Mi-Kyung; Lee, Kyu; Lee, Young Hee; Lee, Myong-Hoon; Lee, Seung Hee

    2009-11-01

    This research focuses on the electrokinetic motion of fullerenes suspended in liquid crystal host medium, which are investigated in the homogeneously aligned nematic liquid crystal cells driven by in-plane field. We investigated the effect of electrophoretic and dielectrophoretic forces and related parameters of the colloidal fullerenes in liquid crystals. The electrophoretic mobility, zeta potential, and critical voltage have been evaluated. Fullerenes suspended in liquid crystal medium migrated toward the positive electrode, but were pulled back in the opposite direction when the polarity was reversed especially at low frequency range (<5 Hz) . At higher electric field and higher frequency ranges, the net displacement of fullerenes has been observed. We demonstrate that the dielectrophoretic force dominated the motion in the colloidal fullerenes by a proper analysis of different electrophoretic parameters. In addition, the electrodynamics of fullerenes was explained by applying the theory of the dielectrophoresis and Schwarz's formula. We propose a model to estimate the density of fullerenes suspended in liquid crystal medium.

  12. Mapping fullerene crystallization in a photovoltaic blend: an electron tomography study

    NASA Astrophysics Data System (ADS)

    Bäcke, Olof; Lindqvist, Camilla; Diaz de Zerio Mendaza, Amaia; Gustafsson, Stefan; Wang, Ergang; Andersson, Mats R.; Müller, Christian; Olsson, Eva

    2015-04-01

    The formation of fullerene crystals represents a major degradation pathway of polymer/fullerene bulk-heterojunction thin films that inexorably deteriorates their photovoltaic performance. Currently no tools exist that reveal the origin of fullerene crystal formation vertically through the film. Here, we show that electron tomography can be used to study nucleation and growth of fullerene crystals. A model bulk-heterojunction blend based on a thiophene-quinoxaline copolymer and a fullerene derivative is examined after controlled annealing above the glass transition temperature. We image a number of fullerene nanocrystals, ranging in size from 70 to 400 nanometers, and observe that their center is located close to the free-surface of spin-coated films. The results show that the nucleation of fullerene crystals predominately occurs in the upper part of the films. Moreover, electron tomography reveals that the nucleation is preceded by more pronounced phase separation of the blend components.

  13. Fullerene and nanotube growth: new insights using first principles and molecular dynamics.

    PubMed

    Cruz-Silva, Rodolfo; Araki, Takumi; Hayashi, Takuya; Terrones, Humberto; Terrones, Mauricio; Endo, Morinobu

    2016-09-13

    Shortly after the discovery of fullerenes, many researchers pointed out that carbon nanotubes could be considered as elongated fullerenes. However, the detailed formation mechanism for both structures has been a topic of debate for several years, and consequently it has been difficult to draw a clear connection between the two systems. While the synthesis conditions appear to be different for both fullerenes and nanotubes, here, we demonstrate that it is highly likely that, at an initial growth stage, single-walled carbon nanotubes begin to grow from a hemisphere-like fullerene cap. More importantly, by analysing the minimum-energy path, it is shown that the insertion of C2 fragments drives the transformation of this fullerene cap into an elongated structure that leads to the formation of very short carbon nanotubes.This article is part of the themed issue 'Fullerenes: past, present and future, celebrating the 30th anniversary of Buckminster Fullerene'.

  14. Fullerene and nanotube growth: new insights using first principles and molecular dynamics.

    PubMed

    Cruz-Silva, Rodolfo; Araki, Takumi; Hayashi, Takuya; Terrones, Humberto; Terrones, Mauricio; Endo, Morinobu

    2016-09-13

    Shortly after the discovery of fullerenes, many researchers pointed out that carbon nanotubes could be considered as elongated fullerenes. However, the detailed formation mechanism for both structures has been a topic of debate for several years, and consequently it has been difficult to draw a clear connection between the two systems. While the synthesis conditions appear to be different for both fullerenes and nanotubes, here, we demonstrate that it is highly likely that, at an initial growth stage, single-walled carbon nanotubes begin to grow from a hemisphere-like fullerene cap. More importantly, by analysing the minimum-energy path, it is shown that the insertion of C2 fragments drives the transformation of this fullerene cap into an elongated structure that leads to the formation of very short carbon nanotubes.This article is part of the themed issue 'Fullerenes: past, present and future, celebrating the 30th anniversary of Buckminster Fullerene'. PMID:27501974

  15. Theory of the Miscibility of Fullerenes in Random Copolymer Melts

    SciTech Connect

    Dadmun, Mark D; Sumpter, Bobby G; Schweizer, Kenneth; Banerjee, Debapriya

    2013-01-01

    We combine polymer integral equation theory and computational chemistry methods to study the interfacial structure, effective interactions, miscibility and spatial dispersion mechanism of fullerenes dissolved in specific random AB copolymer melts characterized by strong non-covalent electron donor-acceptor interactions with the nanofiller. A statistical mechanical basis is developed for designing random copolymers to optimize fullerene dispersion at intermediate copolymer compositions. Pair correlation calculations reveal a strong sensitivity of interfacial packing near the fullerene to copolymer composition and adsorption energy mismatch. The potential of mean force between fullerenes displays rich trends, often non-monotonic with copolymer composition, reflecting a non-additive competition between direct filler attractions and polymer-mediated bridging and steric stabilization. The spinodal phase diagrams are in qualitative agreement with recent solubility limit experimental observations on three systems, and testable predictions are made for other random copolymers. The distinctive non-monotonic variation of miscibility with copolymer composition is found to be primarily a consequence of composition-dependent, spatially short-range attractions between the A and B monomers with the fullerene. A remarkably rich, polymer-specific temperature dependence of the spinodal diagram is predicted which reflects the thermal sensitivity of spatial correlations which can result in fullerene miscibility either increasing or decreasing with cooling. The calculations are contrasted with a simpler effective homopolymer model and the random structure Flory-Huggins model. The former appears to be qualitatively reasonable but can incur large quantitative errors since it misses preferential packing of monomers near nanoparticles, while the latter appears to fail qualitatively due to its neglect of all spatial correlations.

  16. Thermal management technology for hydrogen storage: Fullerene option

    SciTech Connect

    Wang, J.C.; Chen, F.C.; Murphy, R.W.

    1996-10-01

    Fullerenes are selected as the first option for investigating advanced thermal management technologies for hydrogen storage because of their potentially high volumetric and gravimetric densities. Experimental results indicate that about 6 wt% of hydrogen (corresponding to C{sub 60}H{sub 48}) can be added to and taken out of fullerenes. A model assuming thermally activated hydrogenation and dehydrogenation processes was developed to explain the experimental findings. The activation energies were estimated to be 100 and 160 kJ/mole (1.0 and 1.6 eV/H{sub 2}) for the hydrogenation and dehydrogenation processes, respectively. The difference is interpreted as the heat released during hydrogenation. There are indications that the activation energies and the heat of hydrogenation can be modified by the use of catalysts. Preliminary hydrogen storage simulations for a conceptually simple device were performed. A 1-m long hollow metal cylinder with an inner diameter of 0.02 m was assumed to be filled with fullerene powders. The results indicate that the thermal diffusivity of the fullerenes controls the hydrogenation and dehydrogenation rates. The rates can be significantly modified by changing the thermal diffusivity of the material inside the cylinder, e.g., by incorporating a metal mesh. Results from the simulation suggest that thermal management is essential for efficient hydrogen storage devices using fullerenes. While the preliminary models developed in this study explain some of the observation, more controlled experiments, rigorous model development, and physical property determinations are needed for the development of practical hydrogen storage devices. The use of catalysts to optimize the hydrogen storage characteristics of fullerenes also needs to be pursued. Future cooperative work between Oak Ridge National Laboratory (ORNL) and Material & Electrochemical Research Corporation (MER) is planned to address these needs.

  17. Bombardment of thin lithium films with energetic plasma flows

    NASA Astrophysics Data System (ADS)

    Gray, Travis Kelly

    The Divertor Erosion and Vapor Shielding Experiment (DEVEX) has been constructed in the Center for Plasma-Material Interactions at the University of Illinois at Urbana-Champaign. It consists of a conical theta-pinch connected to a 60 kV, 36 muF capacitor bank which is switched with a rise time of 3.5 mus. This results in a peak current of 300 kA for a 30 kV charge on the capacitor bank. The resulting plasma is created and compressed under the theta-pinch coil and then expelled axially towards a target chamber due to the conical taper of the theta-coil. The plasma that reaches the target chamber is dense, 1021 m-3 and cool, 10--20 eV. For the purposes of this study, a thin stainless steel target, sputter coated with a lithium magnetron is the target/material of interest. Both computational [A. Hassanein, Fus. Eng. Des. 60: 527546 (2002)] and experimental [M.L. Apicella, et al., J. Nuc. Mater. 386--388:821823 (2009)] studies have shown that lithium, under fusion relevant plasma bombardment, maintains a much lower surface temperature than other plasma facing materials such as tungsten or carbon. This is believed clue to the strong evaporation and/or sputtering of lithium under these conditions. Subsequently a vapor cloud is formed in front of the plasma-facing surface. The lithium vapor interacts with the incident plasma stream absorbing a fraction of the incident plasma energy via the lithium-plasma interactions. Here, we present experimental verification of substantially reduced target surface temperature with the use of thin lithium films on surface of the target as compared to a bare target. Furthermore, optical measurements are made to determine the density and temperature of the lithium vapor cloud as it expands away from the target surface. A collisional-radiative model for both neutrals and singly ionized lithium is used to model the lithium vapor and is found to correlate well with the optical measurements. The vapor cloud electron temperature is found to

  18. 'Bubble chamber model' of fast atom bombardment induced processes.

    PubMed

    Kosevich, Marina V; Shelkovsky, Vadim S; Boryak, Oleg A; Orlov, Vadim V

    2003-01-01

    A hypothesis concerning FAB mechanisms, referred to as a 'bubble chamber FAB model', is proposed. This model can provide an answer to the long-standing question as to how fragile biomolecules and weakly bound clusters can survive under high-energy particle impact on liquids. The basis of this model is a simple estimation of saturated vapour pressure over the surface of liquids, which shows that all liquids ever tested by fast atom bombardment (FAB) and liquid secondary ion mass spectrometry (SIMS) were in the superheated state under the experimental conditions applied. The result of the interaction of the energetic particles with superheated liquids is known to be qualitatively different from that with equilibrium liquids. It consists of initiation of local boiling, i.e., in formation of vapour bubbles along the track of the energetic particle. This phenomenon has been extensively studied in the framework of nuclear physics and provides the basis for construction of the well-known bubble chamber detectors. The possibility of occurrence of similar processes under FAB of superheated liquids substantiates a conceptual model of emission of secondary ions suggested by Vestal in 1983, which assumes formation of bubbles beneath the liquid surface, followed by their bursting accompanied by release of microdroplets and clusters as a necessary intermediate step for the creation of molecular ions. The main distinctive feature of the bubble chamber FAB model, proposed here, is that the bubbles are formed not in the space and time-restricted impact-excited zone, but in the nearby liquid as a 'normal' boiling event, which implies that the temperature both within the bubble and in the droplets emerging on its burst is practically the same as that of the bulk liquid sample. This concept can resolve the paradox of survival of intact biomolecules under FAB, since the part of the sample participating in the liquid-gas transition via the bubble mechanism has an ambient temperature

  19. Thermal conductivity of hard carbon prepared from C 60 fulleren

    NASA Astrophysics Data System (ADS)

    Smontara, A.; Biljaković, K.; Starešinić, D.; Pajić, D.; Kozlov, M. E.; Hirabayashi, M.; Tokumoto, M.; Ihara, H.

    1996-02-01

    We report measurements of thermal conductivity in 30-350 K range of hard fullerene-based carbon. The material has been prepared from C 60 fullerene under pressure and has an unusual combination of large hardness and relatively high electrical conductivity. Its thermal conductivity is about 5.5 W/mk at room temperature and decreases almost linearly in the investigated temperature range. The data obtained bear resemblance to the thermal properties of amorphous materials. It is consistent with the structural investigation that allows one to suggest the existence of short-range crystalline order in this transformed substance.

  20. Template ordered open-grid arrays of paired endohedral fullerenes.

    PubMed

    Deak, David S; Silly, Fabien; Porfyrakis, Kyriakos; Castell, Martin R

    2006-11-01

    Developing useful molecular systems, such as planar networks for novel molecular electronics, requires the ability to control the way molecules assemble at surfaces. Here we report how an oxide crystal surface can be used as a template to controllably order endohedral fullerenes, Er3N@C80, into two-dimensional (2D) open-grid arrays. The crystal surface is made of highly ordered oxide nanostructures which self-assemble on the surface of SrTiO3(001). This method of molecular ordering can be applied to other fullerenes and has the potential to provide a basis for developing a wide range of molecular architectures. PMID:17061850

  1. Effect on magnetic properties of germanium encapsulated C60 fullerene

    NASA Astrophysics Data System (ADS)

    Umran, Nibras Mossa; Kumar, Ranjan

    2013-02-01

    Structural and electronic properties of Gen(n = 1-4) doped C60 fullerene are investigated with ab initio density functional theory calculations by using an efficient computer code, known as SIESTA. The pseudopotentials are constructed using a Trouiller-Martins scheme, to describe the interaction of valence electrons with the atomic cores. In endohedral doped embedding of more germanium atoms complexes we have seen that complexes are stable and thereafter cage break down. We have also investigated that binding energy, electronic affinity increases and magnetic moment oscillating behavior as the number of semiconductor atoms in C60 fullerene goes on increasing.

  2. Graph-theoretic independence as a predictor of fullerene stability

    NASA Astrophysics Data System (ADS)

    Fajtlowicz, S.; Larson, C. E.

    2003-08-01

    The independence number of the graph of a fullerene, the size of the largest set of vertices such that no two are adjacent (corresponding to the largest set of atoms of the molecule, no pair of which are bonded), appears to be a useful selector in identifying stable fullerene isomers. The experimentally characterized isomers with 60, 70 and 76 atoms uniquely minimize this number among the classes of possible structures with, respectively, 60, 70 and 76 atoms. Other experimentally characterized isomers also rank extremely low with respect to this invariant. These findings were initiated by a conjecture of the computer program Graffiti.

  3. Fullerenes: A New Carrier Phase for Noble Gases in Meteorites

    NASA Technical Reports Server (NTRS)

    Becker, Luann

    2004-01-01

    The major focus of our research effort has been to measure the noble gases encapsulated within fullerenes, a new carbon carrier phase and compare it to the myriad of components found in the bulk meteorite acid residues. We have concentrated on the carbonaceous chondrites (Allende, Murchison and Tagish Lake) since they have abundant noble gases, typically with a planetary signature that dominates the stepped-release of the meteorite bulk acid residue. They also contain an extractable fullerene component that can be isolated and purified from the same bulk material.

  4. Ag K-shell ionization by electron impact: New cross-section measurements between 50 and 100 keV and review of previous experimental data

    NASA Astrophysics Data System (ADS)

    Vanin, V. R.; Manso Guevara, M. V.; Maidana, N. L.; Martins, M. N.; Fernández-Varea, J. M.

    2016-02-01

    We report the measurement of Ag K-shell ionization cross-section by electron impact in the range 50-100 keV and review the experimental data found in the literature. The sample consisted in a thin film of Ag evaporated on a thin C backing. The x-ray spectra generated by electron bombardment in the São Paulo Microtron were observed with a planar HPGe detector. The ratios between characteristic and bremsstrahlung x-ray yields were transformed to ionization cross sections with the help of theoretical atomic-field bremsstrahlung cross sections. The measured cross sections are compared with existing experimental values and calculations based on the semi-relativistic distorted-wave Born approximation. According to our experiment, the ratio of Ag Kβ to Kα x-ray intensities is 0.2018(24).

  5. Classical-trajectory Monte Carlo calculations of the electronic stopping cross section for keV protons and antiprotons impinging on hydrogen atoms

    SciTech Connect

    Custidiano, Ernesto R.; Jakas, Mario M.

    2005-08-15

    Using the classical-trajectory Monte Carlo (CTMC) method, the electronic stopping cross sections of hydrogen atoms by protons and antiprotons impact are calculated. The results show that the CTMC method compares fairly well with previous quantum mechanics calculations of the stopping cross sections for the same colliding pairs. It turns out therefore that the CTMC method constitutes a reliable and, computationally speaking, convenient alternative to calculate the stopping of ions in matter. The present results also show that the stopping appears to be particularly sensitive to the angular momentum (L) of the electron orbit. In the case of protons, the highest sensitivity to L becomes evident around the energy of the maximum stopping. While for antiprotons the largest sensitivity of the stopping to L is observed down at low bombarding energies, i.e., below 10 keV.

  6. Bombardment-Induced Tunable Superlattices in the Growth of Au-Ni Films

    SciTech Connect

    He, J.H.; Carosella, C.A.; Hubler, G.K.; Qadri, S.B.; Sprague, J.A.

    2006-02-10

    Highly ordered superlattices are typically created through the sequential deposition of two different materials. Here, we report our experimental observation of spontaneous formation of superlattices in coevaporation of Au and Ni under energetic ion bombardment. The superlattice periodicities are on the order of a few nanometers and can be adjusted through the energy and flux of ion beams. Such a self-organization process is a consequence of the bombardment-induced segregation and uphill diffusion within the advancing nanoscale subsurface zone in the film growth. Our observations suggest that ion beams can be employed to make tunable natural superlattices in the deposition of phase-separated systems with strong bombardment-induced segregation.

  7. In situ spectroscopic ellipsometry studies of hydrogen ion bombardment of crystalline silicon

    SciTech Connect

    Hu, Y.Z.; Li, M.; Conrad, K.; Andres, J.W.; Irene, E.A.; Denker, M.; Ray, M.; McGuire, G.

    1992-05-01

    Hydrogen-bombardment induced damage in single crystal silicon as a function of the substrate temperature, ion energy, and ion dose was studied using in situ spectroscopic ellipsometry over the photon energy range 2.0-5.5 eV under high vacuum conditions. The incident hydrogen ion energies were 300 and 1000 eV, and the doses were 10{sup 15}-10{sup 18} ions/cm{sup 2}. In situ spectroscopic ellipsometry results showed that the damage layer thicknesses for the samples bombarded at elevated temperatures are smaller than for samples bombarded at room temperature and subsequently annealed at the same elevated temperature. The diffusion coefficient for hydrogen in silicon of 6 x 10{sup {minus}15} cm{sup {minus}2}/s was obtained from the in situ spectroscopic ellipsometry data. 40 refs., 11 figs., 1 tab.

  8. Producing virtually defect-free nanoscale ripples by ion bombardment of rocked solid surfaces

    NASA Astrophysics Data System (ADS)

    Harrison, Matt P.; Bradley, R. Mark

    2016-04-01

    Bombardment of a solid surface with a broad, obliquely incident ion beam frequently produces nanoscale surface ripples. The primary obstacle that prevents the adoption of ion bombardment as a nanofabrication tool is the high density of defects in the patterns that are typically formed. Our simulations indicate that ion bombardment can produce nearly defect-free ripples on the surface of an elemental solid if the sample is concurrently and periodically rocked about an axis orthogonal to the surface normal and the incident beam direction. We also investigate the conditions necessary for rocking to produce highly ordered ripples and discuss how the results of our simulations can be reproduced experimentally. Finally, our simulations show that periodic temporal oscillations of coefficients in the Kuramoto-Sivashinsky equation can suppress spatiotemporal chaos and lead to patterns with a high degree of order.

  9. Bombardment induced ion transport. Part I: Numerical investigation of bombardment induced ion transport through glasses and membranes on the basis of the Nernst-Planck-Poisson equations.

    PubMed

    Schäfer, M; Weitzel, K-M

    2011-12-01

    The bombardment of condensed matter by low energy ion beams induces ion transport through the material. A general theory for bombardment induced ion transport (BIIT) based on numerical solutions of the well known Nernst-Planck-Poisson equations is presented. The theory is applicable to polymer membranes as well as ion-conducting glasses with the implementation of appropriate boundary conditions. The fundamental properties of the theory, i.e. the capability to describe the potential, the field and the concentration/charge density profile within the two classes of materials mentioned above are demonstrated. In particular, the theory is capable of describing experimental observables which will be further elaborated in part II of this miniseries.

  10. KevJumba and the Adolescence of YouTube

    ERIC Educational Resources Information Center

    Saul, Roger

    2010-01-01

    This article considers the significance of YouTube as a pedagogical space from which young people can play participatory roles as theorists in their own constructions as popular cultural subjects. Drawing upon the public profile of "KevJumba," a teenager who makes videos of himself on YouTube, the article suggests that representational practices…

  11. Ion bombardment effects on ZnO nanowires during plasma treatment

    NASA Astrophysics Data System (ADS)

    Ra, H.-W.; Choi, K. S.; Ok, C. W.; Jo, S. Y.; Bai, K. H.; Im, Y. H.

    2008-07-01

    We present the effects of ion bombardment on ZnO nanowires caused by their exposure to an Ar inductively coupled plasma. The conductivity of the individual ZnO nanowire was increased in up to 3 orders of magnitude due to increase in both carrier concentration and mobility, with a substantial negative shift in the threshold gate voltage also being observed. The drastic changes in the electrical properties were attributed to the decrease in species adsorbed on the surface, as well as to the increase in oxygen vacancies near the surface caused by ion bombardment.

  12. Genetic transformation of banana and plantain (Musa spp.) via particle bombardment.

    PubMed

    Sági, L; Panis, B; Remy, S; Schoofs, H; De Smet, K; Swennen, R; Cammue, B P

    1995-05-01

    We have developed a simple protocol to allow the production of transgenic banana plants. Foreign genes were delivered into embryogenic suspension cells using accelerated particles coated with DNA. Bombardment parameters were optimized for a modified particle gun resulting in high levels of transient expression of the beta-glucuronidase gene in both banana and plantain cells. Bombarded banana cells were selected with hygromycin and regenerated into plants. Molecular and histochemical characterization of transformants revealed the stable integration of the transferred genes into the banana genome.

  13. Study on evolution of gases from fluoropolymer films bombarded with heavy ions

    NASA Astrophysics Data System (ADS)

    Minamisawa, Renato Amaral; Zimmerman, Robert Lee; Budak, Satilmis; Ila, Daryush

    2008-04-01

    Ion beam bombardment provides a unique way of material modification by inducing a high degree of localized electronic excitation. The ion track, or affected volume along the ion path through the material is related to the total damage and possible structural changes. Here we study the evolution of gases emitted by poly(tetrafluorethylene-co-perfluoro-(propyl vinyl ether)) (PFA) fluoropolymer bombarded with MeV gold ions. The gas was monitored by a residual gas analyzer (RGA), as a function of the ion fluence. Micro-Raman, atomic force microscopy and optical absorption were used to analyze the chemical structure changes and sputtering yield.

  14. Influence of organic ions on DNA damage induced by 1 eV to 60 keV electrons.

    PubMed

    Zheng, Yi; Sanche, Léon

    2010-10-21

    We report the results of a study on the influence of organic salts on the induction of single strand breaks (SSBs) and double strand breaks (DSBs) in DNA by electrons of 1 eV to 60 keV. Plasmid DNA films are prepared with two different concentrations of organic salts, by varying the amount of the TE buffer (Tris-HCl and EDTA) in the films with ratio of 1:1 and 6:1 Tris ions to DNA nucleotide. The films are bombarded with electrons of 1, 10, 100, and 60 000 eV under vacuum. The damage to the 3197 base-pair plasmid is analyzed ex vacuo by agarose gel electrophoresis. The highest yields are reached at 100 eV and the lowest ones at 60 keV. The ratios of SSB to DSB are surprisingly low at 10 eV (∼4.3) at both salt concentrations, and comparable to the ratios measured with 100 eV electrons. At all characteristic electron energies, the yields of SSB and DSB are found to be higher for the DNA having the lowest salt concentration. However, the organic salts are more efficient at protecting DNA against the damage induced by 1 and 10 eV electrons. DNA damage and protection by organic ions are discussed in terms of mechanisms operative at each electron energy. It is suggested that these ions create additional electric fields within the groove of DNA, which modify the resonance parameter of 1 and 10 eV electrons, namely, by reducing the electron capture cross-section of basic DNA units and the lifetime of corresponding transient anions. An interstrand electron transfer mechanism is proposed to explain the low ratios for the yields of SSB to those of DSB produced by 10 eV electrons.

  15. Influence of organic ions on DNA damage induced by 1 eV to 60 keV electrons

    SciTech Connect

    Zheng Yi; Sanche, Leon

    2010-10-21

    We report the results of a study on the influence of organic salts on the induction of single strand breaks (SSBs) and double strand breaks (DSBs) in DNA by electrons of 1 eV to 60 keV. Plasmid DNA films are prepared with two different concentrations of organic salts, by varying the amount of the TE buffer (Tris-HCl and EDTA) in the films with ratio of 1:1 and 6:1 Tris ions to DNA nucleotide. The films are bombarded with electrons of 1, 10, 100, and 60 000 eV under vacuum. The damage to the 3197 base-pair plasmid is analyzed ex vacuo by agarose gel electrophoresis. The highest yields are reached at 100 eV and the lowest ones at 60 keV. The ratios of SSB to DSB are surprisingly low at 10 eV ({approx}4.3) at both salt concentrations, and comparable to the ratios measured with 100 eV electrons. At all characteristic electron energies, the yields of SSB and DSB are found to be higher for the DNA having the lowest salt concentration. However, the organic salts are more efficient at protecting DNA against the damage induced by 1 and 10 eV electrons. DNA damage and protection by organic ions are discussed in terms of mechanisms operative at each electron energy. It is suggested that these ions create additional electric fields within the groove of DNA, which modify the resonance parameter of 1 and 10 eV electrons, namely, by reducing the electron capture cross-section of basic DNA units and the lifetime of corresponding transient anions. An interstrand electron transfer mechanism is proposed to explain the low ratios for the yields of SSB to those of DSB produced by 10 eV electrons.

  16. Fullerenes, Organics and the Diffuse Interstellar Bands

    NASA Astrophysics Data System (ADS)

    Foing, Bernard H.

    2016-07-01

    The status of DIB research has strongly advanced since 20 years [1], as well as the quest for fullerenes, PAHs and large organics in space. In 1994 we reported the discovery of two near IR diffuse bands coincident with C60+, confirmed in subsequent years [2-6] and now by latest laboratory experiments. A number of DIB observational studies have been published, dealing with: DIB surveys [1,7-10]; measurements of DIB families, correlations and environment dependences [11-14]; extragalactic DIBs [15, 16]. Resolved substructures were detected [17,18] and compared to predicted rotational contours by large molecules [19]. Polarisation studies provided upper limits constraints [20, 21]. DIBs carriers have been linked with organic molecules observed in the interstellar medium [22-25] such as IR bands (assigned to PAHs), Extended Red Emission or recently detected Anomalous Microwave Emission (AME, assigned to spinning dust) and with spectroscopic IR emission bands measured with ISO or Spitzer. Fullerenes and PAHs have been proposed to explain some DIBs and specific molecules were searched in DIB spectra [eg 2-6, 26-31]. These could be present in various dehydrogenation and ionisation conditions [32,33]. Experiments in the laboratory and in space [eg 34-36] allow to measure the survival and by-products of these molecules. We review DIB observational results and their interpretation, and discuss the presence of large organics, fullerenes, PAHs, graphenes in space. References [1] Herbig, G. 1995 ARA&A33, 19; [2] Foing, B. & Ehrenfreund, P. 1994 Natur 369, 296; [3] Foing, B. & Ehrenfreund, P. 1997 A&A317, L59; [4] Foing, B. & Ehrenfreund, P. 1995 ASSL202, 65; [5] Ehrenfreund, P., Foing, B. H. 1997 AdSpR19, 1033; [6] Galazutdinov, G. A. et al. 2000 MNRAS317, 750; [7] Jenniskens, P., Desert, F.-X. 1994 A&AS106, 39; [8] Ehrenfreund, P. et al. 1997 A&A318, L28; [9] Tuairisg, S. Ó. et al. 2000 A&AS142, 225; [10] Cox, N. et al. 2005 A&A438, 187; [11] Cami, J. et al. 1997A&A.326, 822

  17. Synthesis of mono-dispersed nano-scale fullerene (C60) crystals.

    PubMed

    Bae, Eunjoo; Kwak, Byoung Kyu; Kim, Woo-Sik; Kim, Younghun; Choi, Kyunghee; Yil, Jongheop

    2011-04-01

    Fullerene (C60), which has a unique molecular structure, was used in the preparation of crystalline organic nano-crystals. Fullerene was dissolved in toluene and this fullerene solution was mixed with water drastically. During this process, fullerene transferred from toluene to water phase. The significantly different solubility of fullerene in a toluene/water solvent system played an important role in the self-assembly of single fullerene nano-crystals, as it is called drowning-out crystallization. In addition, pH of water was controlled to carry out the interfacial transference of fullerene. An optical spectrum analysis showed that the fullerene was transferred by a hydrolysis reaction from toluene to water, depending on the pH and toluene involved in the crystal structure. During the interfacial transference, the growth of nano-scale fullerene occurred at pH > 7. Importantly, fullerene nanocrystals were formed with a mono-dispersed square structure on a nano-scale (104 nm average size and 1.03 +/- 0.24 aspect ratio) at pH 10.

  18. Nonlinear optical systems based on fullerene-containing media

    NASA Astrophysics Data System (ADS)

    Belousova, Inna M.; Belousov, Vlidilen P.; Bespalov, Victor G.; Grigorev, V. A.; Danilov, Oleg B.; Zevlakov, A. P.; Zgonnick, V. N.; Kalintsev, Alexander G.; Kris'ko, A. V.; Mironova, N. G.; Sosnov, Eugene N.; Ponomarev, Alexander N.

    2000-03-01

    We present the results of theoretical and experimental studies on creation of nonlinear optical systems on a base of fullerene-containing media: power radiation limiters, photorefractive media for dynamic hologram recording, and devices for controlling spatial and temporal parameters of radiation.

  19. Quantum transport through single and multilayer icosahedral fullerenes

    NASA Astrophysics Data System (ADS)

    Lovey, Daniel A.; Romero, Rodolfo H.

    2013-10-01

    We use a tight-binding Hamiltonian and Green functions methods to calculate the quantum transmission through single-wall fullerenes and bilayered and trilayered onions of icosahedral symmetry attached to metallic leads. The electronic structure of the onion-like fullerenes takes into account the curvature and finite size of the fullerenes layers as well as the strength of the intershell interactions depending on to the number of interacting atom pairs belonging to adjacent shells. Misalignment of the symmetry axes of the concentric iscosahedral shells produces breaking of the level degeneracies of the individual shells, giving rise some narrow quasi-continuum bands instead of the localized discrete peaks of the individual fullerenes. As a result, the transmission function for non symmetrical onions is rapidly varying functions of the Fermi energy. Furthermore, we found that most of the features of the transmission through the onions are due to the electronic structure of the outer shell with additional Fano-like antiresonances arising from coupling with or between the inner shells.

  20. Photophysical and theoretical investigations on fullerene/phthalocyanine supramolecular complexes.

    PubMed

    Ray, Anamika; Goswami, Dibakar; Chattopadhyay, Subrata; Bhattacharya, Sumanta

    2008-11-20

    The present paper reports the photophysical aspects of a very interesting and unique host-guest interaction between fullerene and phthalocyanines, viz., free base phthalocyanine (H2-Pc) and zinc-phthalocyanine (Zn-Pc), in toluene medium. Ground state electronic interaction between these two supramolecules has been evidenced from the observation of well-defined charge transfer (CT) absorption bands in the visible region. Vertical ionization potentials of the phthalocyanines have been determined utilizing CT transition energy. Magnitude of degrees of CT reveals that, in the ground state, 2-4% CT takes place. Binding constants (K) for the fullerene/phthalocyanine complexes were determined from the fluorescence quenching experiment. Large K values in the ranges approximately 4.7 x 10(4) to 7.3 x 10(4) and 2.3 x 10(4) to 2.5 x 10(4) dm(3) x mol(-1) were obtained for the 1:1 fullerene complexes of Zn and H 2-Pc, respectively. Values of K suggest that both H 2- and Zn-Pc could not serve as an efficient discriminators between C60 and C70. Theoretical calculations as well as (13)C NMR studies establish that the orientation of C 70 toward phthalocyanine is favored in end-on orientation, which proves that interaction between fullerenes and phthalocyanines were governed by the electrostatic mechanism rather than dispersive forces associated with pi-pi interaction.

  1. Single or functionalized fullerenes interacting with heme group

    NASA Astrophysics Data System (ADS)

    Costa, Wallison Chaves; Diniz, Eduardo Moraes

    2014-09-01

    The heme group is responsible for iron transportation through the bloodstream, where iron participates in redox reactions, electron transfer, gases detection etc. The efficiency of such processes can be reduced if the whole heme molecule or even the iron is somehow altered from its original oxidation state, which can be caused by interactions with nanoparticles as fullerenes. To verify how such particles alter the geometry and electronic structure of heme molecule, here we report first principles calculations based on density functional theory of heme group interacting with single C60 fullerene or with C60 functionalized with small functional groups (-CH3, -COOH, -NH2, -OH). The calculations shown that the system heme + nanoparticle has a different spin state in comparison with heme group if the fullerene is functionalized. Also a functional group can provide a stronger binding between nanoparticle and heme molecule or inhibit the chemical bonding in comparison with single fullerene results. In addition heme molecule loses electrons to the nanoparticles and some systems exhibited a geometry distortion in heme group, depending on the binding energy. Furthermore, one find that such nanoparticles induce a formation of spin up states in heme group. Moreover, there exist modifications in density of states near the Fermi energy. Although of such changes in heme electronic structure and geometry, the iron atom remains in the heme group with the same oxidation state, so that processes that involve the iron might not be affected, only those that depend on the whole heme molecule.

  2. Three-stage transformation pathway from nanodiamonds to fullerenes.

    PubMed

    Sorkin, Anastassia; Tay, Bengkang; Su, Haibin

    2011-08-01

    The dynamics of structure evolution of nanodiamonds ranging from 22 to 318 atoms of various shapes is studied by density functional tight-binding molecular dynamics. The spherical and cubic nanodiamonds can be transformed into fullerene-like structures upon heating. A number of the transformed fullerenes consist of pentagons and hexagons only. Others contain squares, heptagons, and octagons. One simulated fullerene is an isomer of C(60). The temperature of the transformation depends on the size, shape, and orientation of initial cluster. To be transformed into onion-like fullerenes, the spherical nanodiamonds should have 200 atoms or more, while the cubic ones require 302 atoms or more. The time-resolved energy profiles of all the transformations clearly reveal three-stage transformation character. During the first stage, the energy reduces quickly due to converting sp(3) carbon with dangling bond at the surface into sp(2) one, and the formation of partial sp(2) envelope wrapping the cluster. For the second stage, energy decreases slowly. The remaining interior carbon atoms come to the surface through the hole in the sp(2) envelope, and similar amount of sp(3) and sp(2) atoms coexist. The third stage involves the closure of holes, accompanied by the detachment of C(2) molecules and carbon chains from the edges. The energy decreases relatively fast in this stage. The proposed three-stage transformation pathway holds for all the simulations performed in this work, including those with the instant heating.

  3. Physisorption of Fullerenes in Graphene layers and carbon Nanoribbons

    NASA Astrophysics Data System (ADS)

    Pacheco, Monica; Orellana, Pedro; Correa, Julian

    2015-03-01

    The study of nanostructures based on carbon allotropes has captured the interest of the scientific community in the last two decades, due to its great versatility. In such structures a simple change of geometry leads to important changes in their physicochemical properties. In this context it has been studied different carbon allotropes complexes in particular for the development of photovoltaic systems. In this paper we show a study of opto-electronic properties of fullerenes physisorbed on graphene nanoribbons. Our calculations are carried out within the framework of density functional theory (DFT) using the SIESTA package. Our results show that effectively the fullerenes bind both to the layer of graphene as well as to the nanoribbons, with binding energies of about 0.5EV. We find that when the complex is formed, the physical properties of fullerenes, graphene and nanoribbons are preserved and when graphene is functionalized with various fullerenes the electronic spectrum is composed of bands of energy which increases the intensity of the optical absorption spectrum of the complex. Conicyt ACT 1204, USM 11.14.68.

  4. Thermochemistry of Pt-fullerene complexes: semiempirical study.

    PubMed

    Voityuk, Alexander A

    2009-10-29

    Modified Neglect of Differential Overlap (MNDO) and MNDO/d based semiempirical methods are widely employed to explore structure and thermochemistry of molecular systems. In this work, the AM1/d method has been parametrized for systems containing platinum. The proposed scheme delivers excellent performance for binding energies of Pt complexes with ethylene and large pi conjugated hydrocarbons. The estimated bond energies accurately reproduce the results of MP4(SDQ) calculations and show significant improvement over DFT (B3LYP and M05) data. We apply the AM1/d scheme to explore the structure and thermochemistry of several Pt compounds with C(60) and C(70). The calculated binding energies of bare Pt atoms and [Pt(PH(3))(2)] units to the fullerenes are 75 and 45 kcal/mol, respectively. We find that coordination of a single metal center to C(60) activates the fullerene cage making subsequent coordination of Pt more favorable. The bond energy [C(60)-PtC(60)] is calculated to be 65 kcal/mol. The estimated reaction enthalpies are useful for exploring the stability of Pt(x)C(60) polymer systems and their interaction with phosphines. AM1/d predicts a very low barrier to rotation of the coordinated fullerenes in [Pt(C(60))(2)]. The AM1/d scheme is computationally very efficient and can be employed to obtain fast quantitative estimates for binding energies and structural parameters of Pt complexes with large pi conjugated systems like fullerenes and carbon nanotubes.

  5. Fullerenes, fulleranes and polycyclic aromatic hydrocarbons in the Allende meteorite.

    PubMed

    Becker, L; Bunch, T E

    1997-07-01

    In this paper, we confirm our earlier observations of fullerenes (C60 and C70) in the Allende meteorite (Becker et al., 1994a, 1995). Fullerene C60 was also detected in two separate C-rich (approximately 0.5-1.0%) dark inclusions (Heymann et al., 1987) that were hand picked from the Allende sample. The amounts of C60 detected were approximately 5 and approximately 10 ppb, respectively, which is considerably less than what was detected in the Allende 15/21 sample (approximately 100 ppb; Becker et al., 1994a, 1995). This suggests that fullerenes are heterogeneously distributed in the meteorite. In addition, we present evidence for fulleranes, (C60Hx), detected in separate samples by laser desorption (reflectron) time-of-flight (TOF) mass spectrometry (LDMS). The LDMS spectra for the Allende extracts were remarkably similar to the spectra generated for the synthetic fullerane mixtures. Several fullerane products were synthesized using a Rh catalyst (Becker et al., 1993a) and separated using high-performance liquid chromatography (HPLC). Polycyclic aromatic hydrocarbons (PAHs) were also observed ppm levels) that included benzofluoranthene and corannulene, a cup-shaped molecule that has been proposed as a precursor molecule to the formation of fullerenes in the gas phase (Pope et al., 1993).

  6. Fullerenes, fulleranes and polycyclic aromatic hydrocarbons in the Allende meteorite

    NASA Technical Reports Server (NTRS)

    Becker, L.; Bunch, T. E.

    1997-01-01

    In this paper, we confirm our earlier observations of fullerenes (C60 and C70) in the Allende meteorite (Becker et al., 1994a, 1995). Fullerene C60 was also detected in two separate C-rich (approximately 0.5-1.0%) dark inclusions (Heymann et al., 1987) that were hand picked from the Allende sample. The amounts of C60 detected were approximately 5 and approximately 10 ppb, respectively, which is considerably less than what was detected in the Allende 15/21 sample (approximately 100 ppb; Becker et al., 1994a, 1995). This suggests that fullerenes are heterogeneously distributed in the meteorite. In addition, we present evidence for fulleranes, (C60Hx), detected in separate samples by laser desorption (reflectron) time-of-flight (TOF) mass spectrometry (LDMS). The LDMS spectra for the Allende extracts were remarkably similar to the spectra generated for the synthetic fullerane mixtures. Several fullerane products were synthesized using a Rh catalyst (Becker et al., 1993a) and separated using high-performance liquid chromatography (HPLC). Polycyclic aromatic hydrocarbons (PAHs) were also observed ppm levels) that included benzofluoranthene and corannulene, a cup-shaped molecule that has been proposed as a precursor molecule to the formation of fullerenes in the gas phase (Pope et al., 1993).

  7. The Electronic Structure of Transition Metal Coated Fullerenes

    NASA Astrophysics Data System (ADS)

    Patton, David C.; Pederson, Mark R.; Kaxiras, Efthimios

    1998-03-01

    Clusters composed of fullerene molecules with an outer shell of transition metal atoms in the composition C_60M_62 (M being a transition metal) have been produced with laser vaporisation techniques(F. Tast, N. Malinowski, S. Frank, M. Heinebrodt, I.M.L. Billas, and T. P. Martin, Z. Phys D 40), 351 (1997).. We have studied several of these very large systems with a parallel version of the all-electron NRLMOL cluster code. Optimized geometries of the metal encased fullerenes C_60Ti_62 and C_60V_62 are presented along with their HOMO-LUMO gaps, electron affinities, ionization energies, and cohesive energies. We compare the stability of these clusters to relaxed met-car structures (e.g. Ti_8C_12) and to relaxed rocksalt metal-carbide fragments (TiC)n with n=8 and 32. In addition to metal-coated fullerenes we consider the possibility of a trilayered structure consisting of a small shell of metal atoms enclosed by a metal coated fullerene. The nature of bonding in these systems is analyzed by studying the electronic charge distributions.

  8. Fullerene-based symmetry in Hibiscus rosa-sinensis pollen.

    PubMed

    Andrade, Kleber; Guerra, Sara; Debut, Alexis

    2014-01-01

    The fullerene molecule belongs to the so-called super materials. The compound is interesting due to its spherical configuration where atoms occupy positions forming a mechanically stable structure. We first demonstrate that pollen of Hibiscus rosa-sinensis has a strong symmetry regarding the distribution of its spines over the spherical grain. These spines form spherical hexagons and pentagons. The distance between atoms in fullerene is explained applying principles of flat, spherical, and spatial geometry, based on Euclid's "Elements" book, as well as logic algorithms. Measurements of the pollen grain take into account that the true spine lengths, and consequently the real distances between them, are measured to the periphery of each grain. Algorithms are developed to recover the spatial effects lost in 2D photos. There is a clear correspondence between the position of atoms in the fullerene molecule and the position of spines in the pollen grain. In the fullerene the separation gives the idea of equal length bonds which implies perfectly distributed electron clouds while in the pollen grain we suggest that the spines being equally spaced carry an electrical charge originating in forces involved in the pollination process.

  9. Fullerene-Based Symmetry in Hibiscus rosa-sinensis Pollen

    PubMed Central

    Andrade, Kleber; Guerra, Sara; Debut, Alexis

    2014-01-01

    The fullerene molecule belongs to the so-called super materials. The compound is interesting due to its spherical configuration where atoms occupy positions forming a mechanically stable structure. We first demonstrate that pollen of Hibiscus rosa-sinensis has a strong symmetry regarding the distribution of its spines over the spherical grain. These spines form spherical hexagons and pentagons. The distance between atoms in fullerene is explained applying principles of flat, spherical, and spatial geometry, based on Euclid’s “Elements” book, as well as logic algorithms. Measurements of the pollen grain take into account that the true spine lengths, and consequently the real distances between them, are measured to the periphery of each grain. Algorithms are developed to recover the spatial effects lost in 2D photos. There is a clear correspondence between the position of atoms in the fullerene molecule and the position of spines in the pollen grain. In the fullerene the separation gives the idea of equal length bonds which implies perfectly distributed electron clouds while in the pollen grain we suggest that the spines being equally spaced carry an electrical charge originating in forces involved in the pollination process. PMID:25003375

  10. Quenching and Sensitizing Fullerene Photoreactions by Natural Organic Matter

    EPA Science Inventory

    Effects of natural organic matter (NOM) on the photoreaction kinetics of fullerenes (i.e., C60 and fullerenol) were investigated using simulated sunlight and monochromatic radiation (365 nm). NOM from several sources quenched (slowed) the photoreaction of C60 aggregates in water ...

  11. Comment on 'Carbon and fullerene nanomaterials in plant system'.

    PubMed

    Dasgupta-Schubert, N; Tiwari, D K; Villaseñor Cendejas, L M

    2016-01-01

    A recent review article entitled "Carbon and fullerene nanomaterials in plant system" published in this journal, misinterprets a component of our (published) work on the interactions of carbon nanotubes with plants. In this comment, we provide the rationale to counter this misconstruction. PMID:27066901

  12. Hydrogenated fullerenes dimer, peanut and capsule: An atomic comparison

    NASA Astrophysics Data System (ADS)

    EL-Barbary, A. A.

    2016-04-01

    Hydrogenated fullerenes are detected in the Universe in space but their identification is still unsolved task. Therefore, this paper provides useful information about hydrogenated fullerenes (dimer, peanut and capsule) using DFT method at the B3LYP/6-31G(d) level of theory. The stability, geometric structures, hydrogen adsorption energies and NMR chemical shifts are calculated. The results show that the energy of most stable isomer of C118 dimer is lower than the energies sum of C60 and C58 cages by 1.77 eV and the energy per carbon atom of C144 capsule is more stable than C60 cage by 126.98 meV. Also, endohedral Ti-doped C118 dimer and C128 peanut are found to be most stable structures than exohedral Ti-doped C118 dimer and C128 peanut by 2.19 eV/Ti and 3.52 eV/Ti, respectively. The hydrogenation process is found to be enhanced (especially at the caps) for endohedral Ti-doped C118 dimer and C128 peanut through electronic surface modifications. The most active hydrogenation sites are selected and it is found that the most stable hydrogenation sites are Houts1 and Houts3 for fullerenes and endohedral Ti-doped fullerenes, respectively.

  13. Nanopatterning dynamics on Si(100) during oblique 40-keV Ar+ erosion with metal codeposition: Morphological and compositional correlation

    NASA Astrophysics Data System (ADS)

    Redondo-Cubero, A.; Gago, R.; Palomares, F. J.; Mücklich, A.; Vinnichenko, M.; Vázquez, L.

    2012-08-01

    The formation and dynamics of nanopatterns produced on Si(100) surfaces by 40-keV Ar+ oblique (α = 60°) bombardment with concurrent Fe codeposition have been studied. Morphological and chemical analysis has been performed by ex situ atomic force microscopy, Rutherford backscattering spectrometry, x-ray photoelectron spectroscopy, and scanning and transmission electron microscopies. During irradiation, Fe atoms incorporated into the target surface react with Si to form silicides, a process enhanced at this medium-ion energy range. The silicides segregate at the nanoscale from the early irradiation stages. As the irradiation proceeds, a ripple pattern is formed without any correlation with silicide segregation. From the comparison with the pattern dynamics reported previously for metal-free conditions, it is demonstrated that the metal incorporation alters both the pattern dynamics and the morphology. Although the pattern formation and dynamics are delayed for decreasing metal content, once ripples emerge, the same qualitative pattern of morphological evolution is observed for different metal content, resulting in an asymptotic saw-tooth-like facetted surface pattern. Despite the medium ion energy employed, the nanopatterning process with concurrent Fe deposition can be explained by those mechanisms proposed for low-ion energy irradiations such as shadowing, height fluctuations, silicide formation and segregation, ensuing composition dependent sputter rate, and ion sculpting effects. In particular, the interplay between the ion irradiation and metal flux geometries, differences in sputtering rates, and the surface pattern morphology produces a dynamic compositional patterning correlated with the evolving morphological one.

  14. [60]Fullerene Displacement from (Dihapto-Buckminster-Fullerene) Pentacarbonyl Tungsten(0): An Experiment for the Inorganic Chemistry Laboratory, Part II

    ERIC Educational Resources Information Center

    Cortes-Figueroa, Jose E.; Moore-Russo, Deborah A.

    2006-01-01

    The kinetics experiments on the ligand-C[subscript 60] exchange reactions on (dihapto-[60]fullerene) pentacarbonyl tungsten(0), ([eta][superscript 2]-C[subscript 60])W(CO)[subscript 5], form an educational activity for the inorganic chemistry laboratory that promotes graphical thinking as well as the understanding of kinetics, mechanisms, and the…

  15. Photon Counting Imaging with an Electron-Bombarded Pixel Image Sensor

    PubMed Central

    Hirvonen, Liisa M.; Suhling, Klaus

    2016-01-01

    Electron-bombarded pixel image sensors, where a single photoelectron is accelerated directly into a CCD or CMOS sensor, allow wide-field imaging at extremely low light levels as they are sensitive enough to detect single photons. This technology allows the detection of up to hundreds or thousands of photon events per frame, depending on the sensor size, and photon event centroiding can be employed to recover resolution lost in the detection process. Unlike photon events from electron-multiplying sensors, the photon events from electron-bombarded sensors have a narrow, acceleration-voltage-dependent pulse height distribution. Thus a gain voltage sweep during exposure in an electron-bombarded sensor could allow photon arrival time determination from the pulse height with sub-frame exposure time resolution. We give a brief overview of our work with electron-bombarded pixel image sensor technology and recent developments in this field for single photon counting imaging, and examples of some applications. PMID:27136556

  16. The distribution of cotransformed transgenes in particle bombardment-mediated transformed wheat

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Although particle bombardment is the predominant method of foreign DNA direct transfer, whether transgene is integrated randomly into the genome has not been determined. In this study, we identified the distribution of transgene loci in 45 transgenic wheat (Triticum aestivum L.) lines containing c...

  17. Effects of Bombardment on the Manifest Anxiety Level of Children Living in Kibbutzim

    ERIC Educational Resources Information Center

    Ziv, Avner; Israeli, Ruth

    1973-01-01

    The Children's Manifest Anxiety Scale was administered to 103 children from seven kibbutzim under frequent shelling and 90 children from seven kibbutzim that were never under fire. Contrary to the hypotheses that the children from the bombarded kibbutzim would have a higher level of anxiety than those from the nonbombarded ones, no significant…

  18. Ion bombardment induced formation of micro-craters in plant cell envelopes

    NASA Astrophysics Data System (ADS)

    Sangyuenyongpipat, S.; Yu, L. D.; Vilaithong, T.; Brown, I. G.

    2006-01-01

    Ion beam bombardment of biological material has been recently applied for gene transfer in both plant and bacterial cells. A consistent physical mechanism for this significant result has not yet been developed. A fundamental question about the mechanism is the possible formation of pathways due to ion bombardment that are responsible for the gene transfer. We have carried out investigations of the effects of low-energy bombardment by both gaseous and metallic ion species of onion skin cells on their surface microstructure. Our experimental results reveal evidence demonstrating that the formation of micro-crater-like structures on the plant cell envelope surface is a general phenomenon consequent to ion bombardment, no matter what ion species, under certain ion beam conditions. The micro-craters are about 0.1-1 μm in size (diameter) and a few tens of nanometers in depth. The micro-crater formation process seems to be unrelated to the chemical composition of and rapid water evaporation from the cell envelope, but is associated with the special microstructure of the cell wall.

  19. Bombardment of gas molecules on single graphene layer at high temperature

    SciTech Connect

    Murugesan, Ramki; Park, Jae Hyun; Ha, Dong Sung

    2014-12-09

    Graphite is widely used as a material for rocket-nozzle inserts due to its excellent thermo-physical properties as well as low density. During the operation of rockets, the surface of the graphite nozzle is subjected to very high heat fluxes and the undesirable erosion of the surface occurs due to the bombardment of gas molecules with high kinetic energy, which causes a significant reduction of nozzle performance. However, the understanding and quantification of such bombardment is not satisfactory due to its complexity: The bond breaking-forming happens simultaneously for the carbon atoms of graphene, some gas molecules penetrate through the surface, some of them are reflected from the surface, etc. In the present study, we perform extensive molecular dynamics (MD) simulations to examine the bombardment phenomena in high temperature environment (several thousand Kelvin). Advanced from the previous studies that have focused on the bombardment by light molecules (e.g., H{sub 2}), we will concentrate on the impact by realistic molecules (e.g., CO{sub 2} and H{sub 2}O). LAMMPS is employed for the MD simulations with NVE ensemble and AIREBO potential for graphene. The molecular understanding of the interaction between graphene and highly energetic gas molecules will enable us to design an efficient thermo-mechanical protection system.

  20. 33 CFR 334.950 - Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 33 Navigation and Navigable Waters 3 2013-07-01 2013-07-01 false Pacific Ocean at San Clemente... REGULATIONS § 334.950 Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas. (a) The danger zones. (1) The waters of the Pacific Ocean within an area beginning at China Point...

  1. 33 CFR 334.950 - Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 33 Navigation and Navigable Waters 3 2014-07-01 2014-07-01 false Pacific Ocean at San Clemente... REGULATIONS § 334.950 Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas. (a) The danger zones. (1) The waters of the Pacific Ocean within an area beginning at China Point...

  2. 33 CFR 334.950 - Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 33 Navigation and Navigable Waters 3 2012-07-01 2012-07-01 false Pacific Ocean at San Clemente... REGULATIONS § 334.950 Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas. (a) The danger zones. (1) The waters of the Pacific Ocean within an area beginning at China Point...

  3. 33 CFR 334.950 - Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 33 Navigation and Navigable Waters 3 2011-07-01 2011-07-01 false Pacific Ocean at San Clemente... REGULATIONS § 334.950 Pacific Ocean at San Clemente Island, California; Navy shore bombardment areas. (a) The danger zones. (1) The waters of the Pacific Ocean within an area beginning at China Point...

  4. Bombardment of gas molecules on single graphene layer at high temperature

    NASA Astrophysics Data System (ADS)

    Murugesan, Ramki; Park, Jae Hyun; Ha, Dong Sung

    2014-12-01

    Graphite is widely used as a material for rocket-nozzle inserts due to its excellent thermo-physical properties as well as low density. During the operation of rockets, the surface of the graphite nozzle is subjected to very high heat fluxes and the undesirable erosion of the surface occurs due to the bombardment of gas molecules with high kinetic energy, which causes a significant reduction of nozzle performance. However, the understanding and quantification of such bombardment is not satisfactory due to its complexity: The bond breaking-forming happens simultaneously for the carbon atoms of graphene, some gas molecules penetrate through the surface, some of them are reflected from the surface, etc. In the present study, we perform extensive molecular dynamics (MD) simulations to examine the bombardment phenomena in high temperature environment (several thousand Kelvin). Advanced from the previous studies that have focused on the bombardment by light molecules (e.g., H2), we will concentrate on the impact by realistic molecules (e.g., CO2 and H2O ). LAMMPS is employed for the MD simulations with NVE ensemble and AIREBO potential for graphene. The molecular understanding of the interaction between graphene and highly energetic gas molecules will enable us to design an efficient thermo-mechanical protection system.

  5. Enhanced bioactivity of polyvinylidene chloride films using argon ion bombardment for guided bone regeneration.

    PubMed

    Kobayashi, Shuichiro; Hayashi, Tatsuhide; Asakura, Masaki; Hamajima, Soichiro; Sato, Yamato; Sasaki, Keisuke; Okabe, Eijiro; Kawase, Mayu; Ando, Masahiko; Kawai, Tatsushi; Noguchi, Toshihide

    2014-09-01

    Polyvinylidene chloride (PVDC) is a long chain carbon synthetic polymer. The objective of this study was to improve the bioactivity of PVDC films through surface modification using argon (Ar) ion bombardment to create Ar-modified PVDC films (Ar-PVDC) to address the clinical problems of guided bone regeneration (GBR), which is technique-sensitive, and low bone regenerative ability. First, the effects of Ar ion bombardment, a low temperature plasma etching technique widely used in industry, on PVDC film wettability, surface chemistry, and morphology were confirmed. Next, fibroblast-like and osteoblast-like cell attachment and proliferation on Ar-PVDC were assessed. As a preclinical in vivo study, Ar-PVDC was used to cover a critical-sized bone defect on rat calvaria and osteoconductivity was evaluated by micro-computed tomography analysis and histological examinations. We found that the contact angle of PVDC film decreased by 50° because of the production of -OH groups on the PVDC film surface, though surface morphological was unchanged at 30 min after Ar ion bombardment. We demonstrated that cell attachment increased by about 40% and proliferation by more than 140% because of increased wettability, and 2.4 times greater bone regeneration was observed at week 3 with Ar-PVDC compared with untreated PVDC films. These results suggest that Ar ion bombardment modification of PVDC surfaces improves osteoconductivity, indicating its potential to increase bone deposition during GBR. PMID:24893861

  6. Enhanced bioactivity of polyvinylidene chloride films using argon ion bombardment for guided bone regeneration.

    PubMed

    Kobayashi, Shuichiro; Hayashi, Tatsuhide; Asakura, Masaki; Hamajima, Soichiro; Sato, Yamato; Sasaki, Keisuke; Okabe, Eijiro; Kawase, Mayu; Ando, Masahiko; Kawai, Tatsushi; Noguchi, Toshihide

    2014-09-01

    Polyvinylidene chloride (PVDC) is a long chain carbon synthetic polymer. The objective of this study was to improve the bioactivity of PVDC films through surface modification using argon (Ar) ion bombardment to create Ar-modified PVDC films (Ar-PVDC) to address the clinical problems of guided bone regeneration (GBR), which is technique-sensitive, and low bone regenerative ability. First, the effects of Ar ion bombardment, a low temperature plasma etching technique widely used in industry, on PVDC film wettability, surface chemistry, and morphology were confirmed. Next, fibroblast-like and osteoblast-like cell attachment and proliferation on Ar-PVDC were assessed. As a preclinical in vivo study, Ar-PVDC was used to cover a critical-sized bone defect on rat calvaria and osteoconductivity was evaluated by micro-computed tomography analysis and histological examinations. We found that the contact angle of PVDC film decreased by 50° because of the production of -OH groups on the PVDC film surface, though surface morphological was unchanged at 30 min after Ar ion bombardment. We demonstrated that cell attachment increased by about 40% and proliferation by more than 140% because of increased wettability, and 2.4 times greater bone regeneration was observed at week 3 with Ar-PVDC compared with untreated PVDC films. These results suggest that Ar ion bombardment modification of PVDC surfaces improves osteoconductivity, indicating its potential to increase bone deposition during GBR.

  7. A review of electron bombardment thruster systems/spacecraft field and particle interfaces

    NASA Technical Reports Server (NTRS)

    Byers, D. C.

    1978-01-01

    Information on the field and particle interfaces of electron bombardment ion thruster systems was summarized. Major areas discussed were the nonpropellant particles, neutral propellant, ion beam, low energy plasma, and fields. Spacecraft functions and subsystems reviewed were solar arrays, thermal control systems, optical sensors, communications, science, structures and materials, and potential control.

  8. Trace Elements Reveal a Possible Link Between Jack Hills Detrital Zircons and the Late Heavy Bombardment

    NASA Astrophysics Data System (ADS)

    Bell, E. A.; Harrison, T. M.

    2012-03-01

    The Jack Hills detrital zircons range in age 4.3-3.0 Ga. At ca. 3.9 Ga the record contains a population that appears to have recrystallized during a major thermal event. This may be circumstantial terrestrial evidence for the Late Heavy Bombardment.

  9. Effect of fullerene tris-adducts on the photovoltaic performance of P3HT:fullerene ternary blends.

    PubMed

    Kang, Hyunbum; Kim, Ki-Hyun; Kang, Tae Eui; Cho, Chul-Hee; Park, Sunhee; Yoon, Sung Cheol; Kim, Bumjoon J

    2013-05-22

    Fullerene tris-adducts have the potential of achieving high open-circuit voltages (V(OC)) in bulk heterojunction (BHJ) polymer solar cells (PSCs), because their lowest unoccupied molecular orbital (LUMO) level is higher than those of fullerene mono- and bis-adducts. However, no successful examples of the use of fullerene tris-adducts as electron acceptors have been reported. Herein, we developed a ternary-blend approach for the use of fullerene tris-adducts to fully exploit the merit of their high LUMO level. The compound o-xylenyl C60 tris-adduct (OXCTA) was used as a ternary acceptor in the model system of poly(3-hexylthiophene) (P3HT) as the electron donor and the two soluble fullerene acceptors of OXCTA and fullerene monoadduct (o-xylenyl C60 monoadduct (OXCMA), phenyl C61-butyric acid methyl ester (PCBM), or indene-C60 monoadduct (ICMA)). To explore the effect of OXCTA in ternary-blend PSC devices, the photovoltaic behavior of the device was investigated in terms of the weight fraction of OXCTA (W(OXCTA)). When W(OXCTA) is small (<0.3), OXCTA can generate a synergistic bridging effect between P3HT and the fullerene monoadduct, leading to simultaneous enhancement in both V(OC) and short-circuit current (J(SC)). For example, the ternary PSC devices of P3HT:(OXCMA:OXCTA) with W(OXCTA) of 0.1 and 0.3 exhibited power-conversion efficiencies (PCEs) of 3.91% and 3.96%, respectively, which were significantly higher than the 3.61% provided by the P3HT:OXCMA device. Interestingly, for W(OXCTA) > 0.7, both V(OC) and PCE of the ternary-blend PSCs exhibited nonlinear compositional dependence on W(OXCTA). We noted that the nonlinear compositional trend of P3HT:(OXCMA:OXCTA) was significantly different from that of P3HT:(OXCMA:o-xylenyl C60 bis-adduct (OXCBA)) ternary-blend PSC devices. The fundamental reasons for the differences between the photovoltaic trends of the two different ternary-blend systems were investigated systemically by comparing their optical, electrical

  10. Spectroscopy from 2 to 200 keV

    NASA Technical Reports Server (NTRS)

    Helfand, D. J.; Chanan, G. A.; Novick, R.; Maccallum, C. J.; Leventhal, M.

    1981-01-01

    The astrophysical processes responsible for line and continuum emission in the spectra range 2 keV to 200 keV are examined from the viewpoint of designing a spectrometer which would operate in this regime. Phenomena considered include fluorescent line radiation in X-ray binaries, magnetically shifted iron lines and cyclotron emission from neutron star surfaces, line emission from cosmically abundant elements in thermal plasmas, and nuclear deexcitation lines in fresh nucleosynthetically produced matter. An instrument consisting of a approximately 10 sq cm array of planar germanium detectors surrounded by a large sodium-iodide anticoincidence shield is described and projected background rates and sensitivities are considered. A sample observing program for a two-day shuttle-based mission is included as an example of the wide range of scientific questions which could be addressed by such an instrument.

  11. Two-chamber configuration of Bio-Nano electron cyclotron resonance ion source for fullerene modification

    NASA Astrophysics Data System (ADS)

    Uchida, T.; Rácz, R.; Muramatsu, M.; Kato, Y.; Kitagawa, A.; Biri, S.; Yoshida, Y.

    2016-02-01

    We report on the modification of fullerenes with iron and chlorine using two individually controllable plasmas in the Bio-Nano electron cyclotron resonance ion source (ECRIS). One of the plasmas is composed of fullerene and the other one is composed of iron and chlorine. The online ion beam analysis allows one to investigate the rate of the vapor-phase collisional modification process in the ECRIS, while the offline analyses (e.g., liquid chromatography-mass spectrometry) of the materials deposited on the plasma chamber can give information on the surface-type process. Both analytical methods show the presence of modified fullerenes such as fullerene-chlorine, fullerene-iron, and fullerene-chlorine-iron.

  12. Structural and optical characteristics of fullerenes incorporated inside porous silica aerogel

    NASA Astrophysics Data System (ADS)

    Zhu, Lei; Li, Yufen; Wang, Jue; Shen, Jun

    1995-06-01

    The successful synthesis of fullerene-doped silica aerogel by the sol-gel process followed by the supercritical drying technique is reported. The fullerenes (C 60/C 70) can be embedded inside micropores linked by the silica skeleton and the fullerene structures were retained in the fabrication process as seen using mass spectroscopy, Fourier transform infrared spectroscopy and transmission electron microscopy. The fulleren-doped composites were found to be able to emit intense visible light (2.26 eV) under Ar + laser (488 nm) excitation at room temperature. The luminescent intensity increased strongly with low doping of fullerenes (0.05 mol%), then decreased while the peak was red-shifted and finally quenched upon heavy doping (2.5 mol%). This phenomenon is explained as a result of the quantum confinement effect for fullerenes which produces emissions far above the inter-band gap of C 60/C 70.

  13. Toxicity of fullerene (C60) to sediment-dwelling invertebrate Chironomus riparius larvae.

    PubMed

    Waissi-Leinonen, Greta C; Petersen, Elijah J; Pakarinen, Kukka; Akkanen, Jarkko; Leppänen, Matti T; Kukkonen, Jussi V K

    2012-09-01

    An environmentally realistic method to test fullerene (C(60) ) toxicity to the benthic organism Chironomus riparius was created by allowing suspended fullerenes to settle down, making a layer on top of the sediment. To test the hypothesis that higher food concentrations will reduce toxic responses, two food concentrations were tested (0.5 and 0.8% Urtica sp.) in sediment containing fullerene masses of 0.36 to 0.55 mg/cm(2) using a 10-d chronic test. In the 0.5% food level treatments, there were significant differences in all growth-related endpoints compared with controls. Fewer effects were observed for the higher food treatment. Fullerene agglomerates were observed by electron microscopy in the gut, but no absorption into the gut epithelial cells was detected. In the organisms exposed to fullerenes, microvilli were damaged and were significantly shorter. The potential toxicity of fullerene to C. riparius appears to be caused by morphological changes, inhibiting larval growth.

  14. Interaction of C60 fullerenes with asymmetric and curved lipid membranes: a molecular dynamics study.

    PubMed

    Cherniavskyi, Yevhen K; Ramseyer, Christophe; Yesylevskyy, Semen O

    2016-01-01

    Interaction of fullerenes with asymmetric and curved DOPC/DOPS bicelles is studied by means of coarse-grained molecular dynamics simulations. The effects caused by asymmetric lipid composition of the membrane leaflets and the curvature of the membrane are analyzed. It is shown that the aggregates of fullerenes prefer to penetrate into the membrane in the regions of the moderately positive mean curvature. Upon penetration into the hydrophobic core of the membrane fullerenes avoid the regions of the extreme positive or the negative curvature. Fullerenes increase the ordering of lipid tails, which are in direct contact with them, but do not influence other lipids significantly. Our data suggest that the effects of the membrane curvature should be taken into account in the studies concerning permeability of the membranes to fullerenes and fullerene-based drug delivery systems.

  15. Elemental and Microscopic Analysis of Naturally Occurring C-O-Si Hetero-Fullerene-Like Structures.

    PubMed

    Hullavarad, Nilima V; Hullavarad, Shiva S; Fochesatto, Javier

    2015-03-01

    Carbon exhibits an ability to form a wide range of structures in nature. Under favorable conditions, carbon condenses to form hollow, spheroid fullerenes in an inert atmosphere. Using high resolution FESEM, we have concealed the existence of giant hetero-fullerene like structures in the natural form. Clear, distinct features of connected hexagons and pentagons were observed. Energy dispersive X-ray analysis depth-profile of natural fullerene structures indicates that Russian-doll-like configurations composed of C, 0, and Si rings exist in nature. The analysis is based on an outstanding molecular feature found in the size fraction of aerosols having diameters 150 nm to 1.0 µm. The fullerene like structures, which are ~ 150 nm in diameter, are observed in large numbers. To the best of our knowledge, this is the first direct detailed observation of natural fullerene-like structures. This article reports inadvertent observation of naturally occurring hetero-fullerene-like structures in the Arctic.

  16. A sawtooth-like timeline for the first billion years of lunar bombardment

    NASA Astrophysics Data System (ADS)

    Morbidelli, A.; Marchi, S.; Bottke, W. F.; Kring, D. A.

    2012-11-01

    We revisit the early evolution of the Moon's bombardment. Our work combines modeling (based on plausible projectile sources and their dynamical decay rates) with constraints from the lunar crater record, radiometric ages of the youngest lunar basins, and the abundance of highly siderophile elements in the lunar crust and mantle. We deduce that the evolution of the impact flux did not decline exponentially over the first billion years of lunar history, but also there was no prominent and narrow impact spike ˜3.9Gy ago, unlike that typically envisioned in the lunar cataclysm scenario. Instead, we show the timeline of the lunar bombardment has a sawtooth-like profile, with an uptick in the impact flux near ˜4.1Gy ago. The impact flux at the beginning of this weaker cataclysm was 5-10 times higher than the immediately preceding period. The Nectaris basin should have been one of the first basins formed at the sawtooth. We predict the bombardment rate since ˜4.1Gy ago declined slowly and adhered relatively close to classic crater chronology models (Neukum and Ivanov, 1994). Overall we expect that the sawtooth event accounted for about one-fourth of the total bombardment suffered by the Moon since its formation. Consequently, considering that ˜12-14 basins formed during the sawtooth event, we expect that the net number of basins formed on the Moon was ˜45-50. From our expected bombardment timeline, we derived a new and improved lunar chronology suitable for use on pre-Nectarian surface units. According to this chronology, a significant portion of the oldest lunar cratered terrains has an age of 4.38-4.42 Gyr. Moreover, the largest lunar basin, South Pole Aitken, is older than 4.3 Gy, and therefore was not produced during the lunar cataclysm.

  17. 40 CFR 721.10270 - [5,6]Fullerene-C84-D2d.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Fullerene-C84-D2d. 721.10270 Section... Substances § 721.10270 Fullerene-C84-D2d. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as Fullerene-C84-D2d (PMN P-09-57; CAS No. 145809-20-7)...

  18. 40 CFR 721.10268 - [5,6]Fullerene-C70-D5h(6).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Fullerene-C70-D5h(6). 721.10268... Substances § 721.10268 Fullerene-C70-D5h(6). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as Fullerene-C70-D5h(6) (PMN P-09-55; CAS No....

  19. Observation of fullerenes (C60-C70) associated with LDEF crater number 31

    NASA Technical Reports Server (NTRS)

    Radicatidibrozolo, Filippo; Fleming, R. H.; Bunch, T. E.

    1992-01-01

    The presence of fullerenes in and around the LDEF crater number 31 is reported. This crater has a high C level associated with it, and is interpreted as having been produced by the impact of a C-rich micrometeoroid. Fullerenes are large 3-D C structures, among which the species C sub 60 (MW 720) and C sub 70 (MW 840) are preeminent. Fullerenes have several UV absorption bands, hence fullerenes should be detectable using UV laser ionization time-of-flight mass spectrometry. We use a LIMA-2A instrument with pulsed UV laser (266 nm) to search for high mass C species associated with LDEF crater number 31. The mass range was 0 to 1200 amu. Low ablating laser power levels were used (less than or = 5 x 10 exp 7 W/sq. cm); 200 mass spectra were acquired and summed. We observed high mass signals near m/z 720, exhibiting 24 amu separation, which is characteristic of fullerenes. Alkali ion signals were also observed. Little or no C clusters of intermediate mass were observed. We interpret the signals around m/z 720 as fullerenes, mainly C sub 60+ with lower levels of C sub 70+. We propose that the mechanism that produces these signals is resonant multiphoton ionization (REMPI). This selective mechanism explains why low mass C cluster ions are not observed along with the fullerenes, since they have much higher ionization potentials. This finding is unexpected, since up to now the search for fullerenes in extraterrestrial materials has not been successful. We conclude that the fullerenes became associated with crater number 31 in space. Two alternative (and exciting) scenarios are being considered at this time: either the fullerenes were carried by the C-rich projectile that formed crater number 31, or the fullerenes formed upon impact with the LDEF. We show the results of experiments at the ARC Vertical Gun Facility, which may establish some constraints on the origin of the fullerenes.

  20. Synthesis and properties of novel water-soluble fullerene-glycine derivatives as new materials for cancer therapy.

    PubMed

    Jiang, Guichang; Yin, Fen; Duan, Jihua; Li, Guangtao

    2015-01-01

    Novel water-soluble fullerene-glycine derivatives were synthesized by means of simple organic chemistry. They are completely soluble in water, yielding a clear brown solution. The products were characterized by fourier transform infrared (FTIR), ultraviolet-visible spectroscopy (UV-Vis), (1)H NMR, (13)C NMR, thermogravimetric analyses (TGA), and scanning electron microscopy (SEM). The assembly behavior of water-soluble fullerene-glycine derivatives was investigated by SEM. The results show that the fullerene-glycine derivatives create morphology that is sphere-like. The cytotoxicity to cancer cell lines of the fullerene-glycine derivatives was evaluated by MTT (3-(4,5-dimethylthiazol-2-yl)-2,5-diphenyl tetrazolium bromide) and flow cytometry. The results show that fullerene-glycine derivatives exhibit mortality and apoptosis of the cells which increased with the increase of fullerene-glycine derivative concentration. The cytotoxicity mechanism of fullerene-glycine derivatives was investigated for the first time. Novel water-soluble fullerene-glycine derivatives were synthesized by means of simple organic chemistry. The products were characterized by FTIR, UV-Vis, (1)H NMR, (13)C NMR, TGA, and SEM. The bioactivities of fullerene-glycine derivative materials have been tested, and the results show that compared with the fullerene complex, the fullerene-glycine derivative materials exhibit mortality and apoptosis of the cells which increased with the increase of fullerene-glycine derivative concentration. SEM images showed the macrostructure of fullerene-glycine derivative materials was spheres.

  1. Low-background-rate detector for ions in the 5- to 50-keV energy range to be used for radioisotope dating with a small cyclotron

    SciTech Connect

    Friedman, P.G.

    1986-01-01

    Accelerator mass spectrometry in tandem Van de Graaff accelerators has proven successful for radioisotope dating small samples. Small, inexpensive cyclotrons serving this purpose would make the technique accessible to more researchers and inexpensive enough to compare many small samples. To this end, VC Berkeley is developing a 20-cm-diameter, 30- to 40-keV cyclotron dedicated to high-sensitivity radioisotope dating, initially for /sup 14/C. At this energy, range and dE/dx methods of particle identification are impossible. Thus arises the difficult problem of reliably detecting 30- to 40-keV /sup 14/C at 10/sup -1/ counts/sec in the high-background environment of the cyclotron, where lower energy ions, electrons, and photons bombard the detector at much higher rates. To meet this challenge, an inexpensive, generally useful ion detector was developed that allows dark-count rates below 10/sup -4/ counts/sec and excellent background suppression. With the cyclotron tuned near the /sup 13/CH background peak, to the frequency for /sup 14/C, the detector suppresses the background to 6 x 10/sup -4/ counts/sec. For each /sup 14/C ion, the detector's grazing-incidence Al/sub 2/O/sub 3/ conversion dynode emits about 20 secondary electrons, which are independently multiplied in separate pores of a microchannel plate. The output signal is proportional to the number of secondary electrons, allowing pulse-height discrimination of background.

  2. Effect of fullerene containing lubricants on wear resistance of machine components in boundary lubrication

    NASA Astrophysics Data System (ADS)

    Titov, Andriy

    Fullerenes, a new form of carbon nanomaterials, possess unique physical and mechanical properties that make their use as additives to liquid lubricants potentially beneficial. The goal of this study was to investigate the effect of fullerene containing lubricants on wear resistance of steel-bronze couples operating under boundary lubrication conditions. A mathematical model of deformed asperity contact was built to calculate real contact area and real contact pressure. Computer controlled wear friction testing methodology and equipment were designed, developed and implemented for obtaining reliable and objective experimental data. In addition, optical and scanning electron microscopy and standard surface texture analysis were employed. Heavy duty motor oil SAE 10 was modified by admixing fullerenes C60, a fullerene mixture of C60 and C70, fullerene containing soot, and graphite powder. The experiments showed that all of the selected fullerene additives dissolved in liquid lubricants reduce wear of the tested materials. In addition, it was found that despite improvements in wear resistance, the selected modified lubricants did not significantly change friction characteristics. Improvement of wear resistance of contact surfaces operating with fullerene modified lubricants can be explained by the presence of fullerenes in real contact while the liquid lubricant is squeezed out. Fullerenes are considered to function as minute hard particles that do not break down under applied normal force, and tend to separate direct contact of functional surfaces of selected materials.

  3. Cooperative tin oxide fullerene electron selective layers for high-performance planar perovskite solar cells

    SciTech Connect

    Ke, Weijun; Zhao, Dewei; Xiao, Chuanxiao; Wang, Changlei; Cimaroli, Alexander J.; Grice, Corey R.; Yang, Mengjin; Li, Zhen; Jiang, Chun-Sheng; Al-Jassim, Mowafak; Zhu, Kai; Kanatzidis, Mercouri G.; Fang, Guojia; Yan, Yanfa

    2016-01-01

    Both tin oxide (SnO2) and fullerenes have been reported as electron selective layers (ESLs) for producing efficient lead halide perovskite solar cells. Here, we report that SnO2 and fullerenes can work cooperatively to further boost the performance of perovskite solar cells. We find that fullerenes can be redissolved during perovskite deposition, allowing ultra-thin fullerenes to be retained at the interface and some dissolved fullerenes infiltrate into perovskite grain boundaries. The SnO2 layer blocks holes effectively; whereas, the fullerenes promote electron transfer and passivate both the SnO2/perovskite interface and perovskite grain boundaries. With careful device optimization, the best-performing planar perovskite solar cell using a fullerene passivated SnO2 ESL has achieved a steady-state efficiency of 17.75% and a power conversion efficiency of 19.12% with an open circuit voltage of 1.12 V, a short-circuit current density of 22.61 mA cm-2, and a fill factor of 75.8% when measured under reverse voltage scanning. We find that the partial dissolving of fullerenes during perovskite deposition is the key for fabricating high-performance perovskite solar cells based on metal oxide/fullerene ESLs.

  4. Colloidal structure and stabilization mechanism of aqueous solutions of unmodified fullerene C{sub 60}

    SciTech Connect

    Khokhryakov, A. A. Kyzyma, O. A.; Bulavin, L. A.; Len, A.; Avdeev, M. V.; Aksenov, V. L.

    2007-05-15

    Despite the inability of fullerenes to be directly dissolved in water, there are methods for preparing stable dispersions of fullerenes in water without any particular modifications of the fullerene or addition of stabilizers. The colloidal properties of such systems prepared by replacing the solvent and structural changes in them during coagulation have been studied. The coagulation dynamics has been investigated by spectroscopy and small-angle neutron scattering. The results obtained confirm the colloidal nature of such systems. During coagulation, particles retain a large volume of water around them, an indication of interaction between fullerene and water during solution stabilization.

  5. Effect of pulse-modulated microwaves on fullerene ion production with electron cyclotron resonance ion source.

    PubMed

    Asaji, T; Uchida, T; Minezaki, H; Oshima, K; Racz, R; Muramatsu, M; Biri, S; Kitagawa, A; Kato, Y; Yoshida, Y

    2012-02-01

    Fullerene plasmas generated by pulse-modulated microwaves have been investigated under typical conditions at the Bio-Nano electron cyclotron resonance ion source. The effect of the pulse modulation is distinct from that of simply structured gases, and then the density of the fullerene plasmas increased as decreasing the duty ratio. The density for a pulse width of 10 μs at the period of 100 μs is 1.34 times higher than that for CW mode. We have studied the responses of fullerene and argon plasmas to pulsed microwaves. After the turnoff of microwave power, fullerene plasmas lasted ∼30 times longer than argon plasmas.

  6. Enhanced brain penetration of hexamethonium in complexes with derivatives of fullerene C60.

    PubMed

    Piotrovskiy, L B; Litasova, E V; Dumpis, M A; Nikolaev, D N; Yakovleva, E E; Dravolina, O A; Bespalov, A Yu

    2016-05-01

    The present report describes development of hexamethonium complexes based on fullerene C60. Hexamethonium has a limited penetration into CNS and therefore can antagonize central effects of nicotine only when given at high doses. In the present studies conducted in laboratory rodents, intraperitoneal administration of hexamethonium-fullerene complexes blocked effects of nicotine (convulsions and locomotor stimulation). When compared to equimolar doses of hexamethonium, complexes of hexamethonium with derivatives of fullerene C60 were 40 times more potent indicating an enhanced ability to interact with central nicotine receptors. Thus, fullerene C60 derivatives should be explored further as potential carrier systems for polar drug delivery into CNS. PMID:27417712

  7. Synthesis of Fullerenes in Low Pressure Benzene/Oxygen Diffusion Flames

    NASA Technical Reports Server (NTRS)

    Hebgen, Peter; Howard, Jack B.

    1999-01-01

    The interest in fullerenes is strongly increasing since their discovery by Kroto et al. in 1985 as products of the evaporation of carbon into inert gas at low pressure. Due to their all carbon closed-shell structure, fullerenes have many exceptional physical and chemical properties and a large potential for applications such as superconductors, sensors, catalysts, optical and electronic devices, polymers, high energy fuels, and biological and medical materials. This list is still growing, because the research on fullerenes is still at an early stage. Fullerenes can be formed not only in a system containing only carbon and an inert gas, but also in premixed hydrocarbon flames under reduced pressure and fuel rich conditions. The highest yields of fullerenes in flames are obtained under conditions of substantial soot formation. There is a need for more information on the yields of fullerenes under different conditions in order to understand the mechanisms of their formation and to enable the design of practical combustion systems for large-scale fullerene production. Little work has been reported on the formation of fullerenes in diffusion flames. In order to explore the yields of fullerenes and the effect of low pressure in diffusion flames, therefore we constructed and used a low pressure diffusion flame burner in this study.

  8. Facile Method toward Hierarchical Fullerene Architectures with Enhanced Hydrophobicity and Photoluminescence.

    PubMed

    Zheng, Shushu; Xu, Meilin; Lu, Xing

    2015-09-16

    A two-step self-assembly strategy has been developed for the preparation of fullerene hierarchical architectures. Typically, the precipitation method is utilized to synthesize the initial fullerene microstructures, and subsequently a drop-drying process is employed to facilitate the fullerene microstructures to self-assemble into the final hierarchical structures. Overall, this methodology is quite simple and feasible, which can be applied to prepare fullerene hierarchical structures with different morphological features, simply by choosing proper solvent. Moreover, the as-obtained C70 hierarchical structures have many superior properties over the original C70 microrods such as superhydrophobicity and unique photoluminescence behaviors, promising their applications as waterproof optoelectronics. PMID:26320882

  9. Controlling Exciton Diffusion and Fullerene Distribution in Photovoltaic Blends by Side Chain Modification

    PubMed Central

    2015-01-01

    The influence of crystallinity on exciton diffusion and fullerene distribution was investigated by blending amorphous and semicrystalline copolymers. We measured exciton diffusion and fluorescence quenching in such blends by dispersing fullerene molecules into them. We find that the diffusion length is more than two times higher in the semicrystalline copolymer than in the amorphous copolymer. We also find that fullerene preferentially mixes into disordered regions of the polymer film. This shows that relatively small differences in molecular structure are important for exciton diffusion and fullerene distribution. PMID:26267202

  10. Immobilization of [60]fullerene on silicon surfaces through a calix[8]arene layer

    NASA Astrophysics Data System (ADS)

    Busolo, Filippo; Silvestrini, Simone; Armelao, Lidia; Maggini, Michele

    2013-10-01

    In this work, we report the functionalization of flat Si(100) surfaces with a calix[8]arene derivative through a thermal hydrosilylation process, followed by docking with [60]fullerene. Chemical grafting of calix[8]arene on silicon substrates was evaluated by X-ray photoelectron spectroscopy, whereas host-guest immobilization of fullerene was demonstrated by atomic force microscopy and sessile drop water contact angle measurements. Surface topographical variations, modelled on the basis of calix[8]arene and [60]fullerene geometrical parameters, are consistent with the observed morphological features relative to surface functionalization and to non-covalent immobilization of [60]fullerene.

  11. Immobilization of [60]fullerene on silicon surfaces through a calix[8]arene layer

    SciTech Connect

    Busolo, Filippo; Silvestrini, Simone; Maggini, Michele; Armelao, Lidia

    2013-10-28

    In this work, we report the functionalization of flat Si(100) surfaces with a calix[8]arene derivative through a thermal hydrosilylation process, followed by docking with [60]fullerene. Chemical grafting of calix[8]arene on silicon substrates was evaluated by X-ray photoelectron spectroscopy, whereas host-guest immobilization of fullerene was demonstrated by atomic force microscopy and sessile drop water contact angle measurements. Surface topographical variations, modelled on the basis of calix[8]arene and [60]fullerene geometrical parameters, are consistent with the observed morphological features relative to surface functionalization and to non-covalent immobilization of [60]fullerene.

  12. Endohedral metal atoms in pristine and functionalized fullerene cages.

    PubMed

    Yamada, Michio; Akasaka, Takeshi; Nagase, Shigeru

    2010-01-19

    Fullerene, an allotropic form of carbon made up of spherical molecules formed from pentagonal and hexagonal rings, was first discovered in 1985. Because fullerenes have spacious inner cavities, atoms and clusters can be encapsulated inside the fullerene cages to form endohedral fullerenes. In particular, the unique structural and electronic properties of endohedral metallofullerenes (EMFs), where metal atoms are encapsulated within the fullerene, have attracted wide interest from physicists and chemists as well as materials scientists and biologists. The remarkable characteristics of these molecules originate in the electron transfer from the encapsulated metal atoms to the carbon cage. The positions and movements of the encapsulated metal atoms are important determinants of the chemical and physical properties of EMFs. In this Account, we specifically describe the positions and dynamic behavior of the metal atoms encapsulated in pristine and functionalized fullerene cages. First, we examined whether the metal atoms are attached rigidly to cage carbons or move around. Our systematic investigations of EMFs, including M@C(2v)-C(82), M(2)@D(2)(10611)-C(72), M(2)@D(3h)(5)-C(78), M(2)@I(h)-C(80), and M(2)@D(5h)-C(80), revealed that the metal positions and movements vary widely with different cage structures and numbers of metal atoms. Second, we wanted to understand whether we could control the positions and movements of the untouchable metal atoms in EMFs. One possible way to modulate this behavior was through attachment of a molecule to the outer surface of the cage. We developed synthetic methods to modify EMFs and have examined the metal positions and movements in the functionalized carbon cages. Remarkably, we could alter the dynamic behavior of the encaged metal atoms in M(2)@I(h)-C(80) drastically through chemical modification of the outer cage. We anticipate that the control of metal atom structures and dynamics within a cage could be valuable for designing

  13. Optical Properties of Fullerene-Based Materials

    NASA Astrophysics Data System (ADS)

    Wang, Ying

    In this dissertation I have presented results of my optical studies of fullerene-based solids: pristine solid C_{60}, alkali-metal (M) doped C_{60} rm(M_6C_{60}) and phototransformed C_{60}.. Raman scattering and infrared spectroscopy were used to study the vibrational modes and it was found that modes observed experimentally were intramolecular modes whose frequencies were found in reasonable agreement with theoretical predictions for an isolated C_ {60} molecule. Weaker, numerous second -order IR and Raman scattering lines are observed, and are found to be very narrow, which also supports a molecular picture for solid C_{60}.. Doping C_{60} films with alkali metals up to the saturated stoichiometry rm M_6C_{60} produces a vibrational spectrum which is similar to pristine solid C_{60}. Furthermore, the rm M_6C_{60} Raman spectra are found insensitive to the mass and size of the particular ion (e.g., K, Rb, or Cs), indicating a weak coupling of the C_{60} ^{6-} and M^{+ } sublattices. The crystal field was observed to split the five-fold degenerate H_{ rm g} modes, however. Optical absorption/reflection spectroscopy for solid C_{60} in the ultra violet (UV), visible (vis) and infrared (IR) range were carried out on thin films on transparent substrates. Careful analysis of data have led to a quantitative determination of the dielectric function varepsilon(omega)= varepsilon_1(omega)+{rm i }varepsilon_2(omega) for C_{60} from 0.05-6 eV. The low frequency dielectric constant was found to be varepsilon_1(0) = 4.0, and an electronic absorption edge is observed at 1.7 eV, with three strong bands in the range 2-5 eV. Without the vibronic coupling between excited electronic and vibrational states, the parity selection rule would have forbidden transitions between the highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO), and this 1.7 eV edge would not have been detected. Finally, results of studies of the phototransformation of solid C

  14. Ripple formation on atomically flat cleaved Si surface with roughness of 0.038 nm rms by low-energy Ar{sup 1+} ion bombardment

    SciTech Connect

    Pahlovy, Shahjada A.; Mahmud, S. F.; Yanagimoto, K.; Miyamoto, I.

    2011-03-15

    The authors have conducted research regarding ripple formation on an atomically flat cleaved Si surface by low-energy Ar{sup +} ion bombardment. The cleaved atomically flat and smooth plane of a Si wafer was obtained by cutting vertically against the orientation of a Si (100) wafer. Next, the cleaved surface was sputtered by a 1 keV Ar{sup +} ion beam at ion-incidence angles of 0 deg., 60 deg., 70 deg., and 80 deg. The results confirm the successful ripple formation at ion-incidence angles of 60 deg. - 80 deg. and that the wavelength of the ripples increases with the increase of the ion-incidence angle, as well as the inverse of ion doses. The direction of the ripple also changes from perpendicular to parallel to the projection of the ion-beam direction along the surface with the increasing ion-incidence angle. The authors have also observed the dose effects on surface roughness of cleaved Si surface at the ion-incidence angle of 60 deg., where the surface roughness increases with the increased ion dose. Finally, to understand the roughening mechanism, the authors studied the scaling behavior, measured the roughness exponent {alpha}, and compared the evolution of scaling regimes with Cuerno's one-dimensional simulation results.

  15. Protein-directed self-assembly of a fullerene crystal.

    PubMed

    Kim, Kook-Han; Ko, Dong-Kyun; Kim, Yong-Tae; Kim, Nam Hyeong; Paul, Jaydeep; Zhang, Shao-Qing; Murray, Christopher B; Acharya, Rudresh; DeGrado, William F; Kim, Yong Ho; Grigoryan, Gevorg

    2016-04-26

    Learning to engineer self-assembly would enable the precise organization of molecules by design to create matter with tailored properties. Here we demonstrate that proteins can direct the self-assembly of buckminsterfullerene (C60) into ordered superstructures. A previously engineered tetrameric helical bundle binds C60 in solution, rendering it water soluble. Two tetramers associate with one C60, promoting further organization revealed in a 1.67-Å crystal structure. Fullerene groups occupy periodic lattice sites, sandwiched between two Tyr residues from adjacent tetramers. Strikingly, the assembly exhibits high charge conductance, whereas both the protein-alone crystal and amorphous C60 are electrically insulating. The affinity of C60 for its crystal-binding site is estimated to be in the nanomolar range, with lattices of known protein crystals geometrically compatible with incorporating the motif. Taken together, these findings suggest a new means of organizing fullerene molecules into a rich variety of lattices to generate new properties by design.

  16. Influence of Substrate on Crystallization in Polythiophene/fullerene Blends

    SciTech Connect

    C He; D Germack; J Kline; D Delongchamp; D Fischer; C Snyder; M Toney; J Kushmerick; L Richter

    2011-12-31

    The nanoscale morphology of the active layer in organic, bulk heterojunction (BHJ) solar cells is crucial to device performance. Often a combination of casting conditions and post deposition thermal treatment is used to optimize the morphology. In general, the development of microscopic crystals is deleterious, as the exciton diffusion length is {approx}10 nm. We find that the microscopic crystallization behavior in polythiophene/fullerene blends is strongly influenced by the substrate on which the BHJ is cast. With a silicon oxide substrate, the crystal nucleation density is high and significant crystallization occurs at a temperature of 140 C. On more hydrophobic substrates, significantly higher temperatures are required for observable crystallization. This difference is attributed to the interfacial segregation of the PCBM, controlled by the substrate surface energy. The substrate dependence of crystallization has significant implications on the fullerene crystal growth mechanisms and practical implications for device studies.

  17. Protein-directed self-assembly of a fullerene crystal

    NASA Astrophysics Data System (ADS)

    Kim, Kook-Han; Ko, Dong-Kyun; Kim, Yong-Tae; Kim, Nam Hyeong; Paul, Jaydeep; Zhang, Shao-Qing; Murray, Christopher B.; Acharya, Rudresh; Degrado, William F.; Kim, Yong Ho; Grigoryan, Gevorg

    2016-04-01

    Learning to engineer self-assembly would enable the precise organization of molecules by design to create matter with tailored properties. Here we demonstrate that proteins can direct the self-assembly of buckminsterfullerene (C60) into ordered superstructures. A previously engineered tetrameric helical bundle binds C60 in solution, rendering it water soluble. Two tetramers associate with one C60, promoting further organization revealed in a 1.67-Å crystal structure. Fullerene groups occupy periodic lattice sites, sandwiched between two Tyr residues from adjacent tetramers. Strikingly, the assembly exhibits high charge conductance, whereas both the protein-alone crystal and amorphous C60 are electrically insulating. The affinity of C60 for its crystal-binding site is estimated to be in the nanomolar range, with lattices of known protein crystals geometrically compatible with incorporating the motif. Taken together, these findings suggest a new means of organizing fullerene molecules into a rich variety of lattices to generate new properties by design.

  18. Interface engineering for efficient fullerene-free organic solar cells

    SciTech Connect

    Shivanna, Ravichandran; Narayan, K. S. E-mail: narayan@jncasr.ac.in; Rajaram, Sridhar E-mail: narayan@jncasr.ac.in

    2015-03-23

    We demonstrate the role of zinc oxide (ZnO) morphology and addition of an acceptor interlayer to achieve high efficiency fullerene-free bulk heterojunction inverted organic solar cells. Nanopatterning of the ZnO buffer layer enhances the effective light absorption in the active layer, and the insertion of a twisted perylene acceptor layer planarizes and decreases the electron extraction barrier. Along with an increase in current homogeneity, the reduced work function difference and selective transport of electrons prevent the accumulation of charges and decrease the electron-hole recombination at the interface. These factors enable an overall increase of efficiency to 4.6%, which is significant for a fullerene-free solution-processed organic solar cell.

  19. Cationic Fullerenes Are Effective and Selective Antimicrobial Photosensitizers

    PubMed Central

    Tegos, George P.; Demidova, Tatiana N.; Arcila-Lopez, Dennisse; Lee, Haeryeon; Wharton, Tim; Gali, Hariprasad; Hamblin, Michael R.

    2011-01-01

    Summary Fullerenes are soccer ball-shaped molecules composed of carbon atoms, and, when derivatized with functional groups, they become soluble and can act as photosensitizers. Antimicrobial photodynamic therapy combines a nontoxic photosensitizer with harmless visible light to generate reactive oxygen species that kill microbial cells. We have compared the antimicrobial activity of six functionalized C60 compounds with one, two, or three hydrophilic or cationic groups in combination with white light against gram-positive bacteria, gram-negative bacteria, and fungi. After a 10 min incubation, the bis- and tris-cationic fullerenes were highly active in killing all tested microbes (4–6 logs) under conditions in which mammalian cells were comparatively unharmed. These compounds performed significantly better than a widely used antimicrobial photosensitizer, toluidine blue O. The high selectivity and efficacy exhibited by these photosensitizers encourage further testing for antimicrobial applications. PMID:16242655

  20. Recombination in polymer-fullerene bulk heterojunction solar cells

    SciTech Connect

    Cowan, Sarah; Roy, Anshuman; Heeger, Alan

    2010-12-16

    Recombination of photogenerated charge carriers in polymer bulk heterojunction (BHJ) solar cells reduces the short circuit current (Jsc ) and the fill factor (FF). Identifying the mechanism of recombination is, therefore, fundamentally important for increasing the power conversion efficiency. Light intensity and temperature-dependent current-voltage measurements on polymer BHJ cells made from a variety of different semiconducting polymers and fullerenes show that the recombination kinetics are voltage dependent and evolve from first-order recombination at short circuit to bimolecular recombination at open circuit as a result of increasing the voltage-dependent charge carrier density in the cell. The “missing 0.3 V” inferred from comparison of the band gaps of the bulk heterojunction materials and the measured open-circuit voltage at room-temperature results from the temperature dependence of the quasi-Fermi levels in the polymer and fullerene domains—a conclusion based on the fundamental statistics of fermions.

  1. Microdosimetry of a 25 keV electron microbeam.

    PubMed

    Wilson, W E; Lynch, D J; Wei, K; Braby, L A

    2001-01-01

    Electron microbeam experiments are planned or under way to explore in part the question regarding whether the bystander effect is a general phenomenon or is restricted to high-LET radiation. Since low-LET radiations scatter more readily compared to high-LET radiations, identifying bystander cells and assessing the potential dose that they may receive will be crucial to the interpretation of radiobiological results. This paper reports on initial calculations of the basic information needed for a stochastic model of the penetration of energetic electrons in tissue-like matter; the model will be used to predict doses delivered to adjacent regions in which bystander cells may reside. Results are presented of calculations of the stochastics of energy deposition by 25 keV electrons slowing down in a homogeneous water medium. Energy deposition distributions were scored for 1-micrometer spheres located at various penetration and radial distances up to 10 micrometer from the point of origin. The energy of 25 keV was selected because experiments are planned for that energy. At 25 keV there is a high probability that the entire electron track will be contained within a typical mammalian cell. Individual tracks are scored because of their primacy; data for higher doses can be obtained by convoluting single-track distributions. The event frequency decreases approximately exponentially after the first micrometer to 1% at about 8 micrometer of penetration. Radially, the 1% contour extends to 3.5 micrometer at a penetration of 5.5 micrometer. The frequency-mean energy deposited decreases from 1.5 to 1 keV/micrometer at a penetration of 3.5 micrometer, then increases back to about 1.5 at a penetration of 6.5 micrometer. The mean energy increases to about 3 keV/micrometer at a radial distance of 8.5 micrometer.

  2. Single or functionalized fullerenes interacting with heme group

    SciTech Connect

    Costa, Wallison Chaves; Diniz, Eduardo Moraes

    2014-09-15

    The heme group is responsible for iron transportation through the bloodstream, where iron participates in redox reactions, electron transfer, gases detection etc. The efficiency of such processes can be reduced if the whole heme molecule or even the iron is somehow altered from its original oxidation state, which can be caused by interactions with nanoparticles as fullerenes. To verify how such particles alter the geometry and electronic structure of heme molecule, here we report first principles calculations based on density functional theory of heme group interacting with single C{sub 60} fullerene or with C{sub 60} functionalized with small functional groups (−CH{sub 3}, −COOH, −NH{sub 2}, −OH). The calculations shown that the system heme + nanoparticle has a different spin state in comparison with heme group if the fullerene is functionalized. Also a functional group can provide a stronger binding between nanoparticle and heme molecule or inhibit the chemical bonding in comparison with single fullerene results. In addition heme molecule loses electrons to the nanoparticles and some systems exhibited a geometry distortion in heme group, depending on the binding energy. Furthermore, one find that such nanoparticles induce a formation of spin up states in heme group. Moreover, there exist modifications in density of states near the Fermi energy. Although of such changes in heme electronic structure and geometry, the iron atom remains in the heme group with the same oxidation state, so that processes that involve the iron might not be affected, only those that depend on the whole heme molecule.

  3. Production and consumption of reactive oxygen species by fullerenes.

    PubMed

    Kong, Lingjun; Zepp, Richard G

    2012-01-01

    Reactive oxygen species (ROS) are one of the most important intermediates in chemical, photochemical, and biological processes. To understand the environmental exposure and toxicity of fullerenes better, the production and consumption of ROS (singlet oxygen, superoxide, hydrogen peroxide, and hydroxyl radicals) by Buckminster fullerene (C(60) ) and fullerenol were investigated in aqueous systems. Fullerenol exhibits higher photoproduction efficiency of singlet oxygen and superoxide than aqueous suspensions of C(60) aggregates (aqu/nC(60) ), and this higher efficiency results in higher steady-state concentrations of these two ROS. Transmission electron microscopy indicates that the C(60) molecules in aqu/nC(60) are much more closely packed than the C(60) cages in fullerenol. These observations provide additional evidence that the lower ROS production efficiency of aqu/nC(60) is attributable primarily to efficient self-quenching of C(60) triplet states. Production of singlet oxygen by aqu/nC(60) is accelerated by increasing oxygen concentration and in part is sensitized by fluorescent photoproducts that accumulate during irradiation. The fullerenes react slowly with singlet oxygen (second-order rate constant <4 × 10(5)  M(-1)  s(-1) ), but react rapidly with hydroxyl radicals (second-order rate constants of 5.4 × 10(9) and 4 × 10(8)  M(-1)  s(-1) for aqu/nC(60) and fullerenol, respectively). These results show that environmental conditions, including light exposure and oxygen concentration, have the potential to impact the generation of toxic ROS by fullerenes.

  4. Stabilities of multiply charged dimers and clusters of fullerenes.

    PubMed

    Zettergren, Henning; Schmidt, Henning T; Reinhed, Peter; Cederquist, Henrik; Jensen, Jens; Hvelplund, Preben; Tomita, Shigeo; Manil, Bruno; Rangama, Jimmy; Huber, Bernd A

    2007-06-14

    The authors find even-odd variations as functions of r (...+[C60]2(r+)([C60C70](r+)) electron-transfer collisions. This even-odd behavior is in sharp contrast to the smooth one for fullerene monomers and may be related to even-odd effects in dimer ionization energies in agreement with results from an electrostatic model. The kinetic energy releases for dimer dissociations [predominantly yielding intact fullerenes [C60]2(r+)-->C60(r1+)+C60(r2+) in the same (r1=r2) or nearby (r1=r2+/-1) charge states] are found to be low in comparison with the corresponding model results indicating that internal excitations of the separating (intact) fullerenes are important. Experimental appearance sizes for the heavier clusters of fullerenes [C60]n(r+) (n>3 and r=2-5) compare well with predictions from a new nearest-neighbor model assuming that r unit charges in [C60]n(r+) are localized to r C60 molecules such that the Coulomb energy of the system is minimized. The system is then taken to be stable if (i) two (singly) charged C60 are not nearest neighbors and (ii) the r C60(+) molecules have binding energies to their neutral nearest neighbors which are larger than the repulsive energies for the (r-1) C60(+)-C60(+) pairs. Essential ingredients in the nearest-neighbor model are cluster geometries and the present results on dimer stabilities.

  5. Photoabsorption spectra of Xe atoms encapsulated inside fullerenes

    NASA Astrophysics Data System (ADS)

    Chen, Zhifan; Msezane, Alfred Z.

    2015-03-01

    The photoabsorption spectra of Xe atoms encapsulated inside the C180 and C240 have been investigated using the time-dependent density-functional theory (TDDFT) and compared with the result of our short range spherical well. The calculations are performed in the energy region of the Xe 4 d giant resonance and assumed the central location of the Xe atom inside the fullerenes. The Xe-C180 and Xe-C240 binding energies along the high symmetry direction, the z axis have been evaluated as well. The obtained curves show the possibility of other Xe positions. The main features of the confinement resonances for the Xe atoms in the center of the C180 and C240 may be estimated by the formula E(eV) = 67.55 + (12.25 n/2 r)2, where r is the radius in Å of the fullerene, n is the integer number 2, 3, 4, 5, ..., and E (eV) is the location of a confinement peak. The calculations indicate that if the radius of a fullerene equals an integer (≥2) × the half wave length of the photoelectron, then at this photon energy we may observe a confinement peak. The photoabsorption spectra of Xe atoms encaged in the center of the C58, C56 and C54 have also been studied. The results demonstrate that, except for the Xe atom inside C58, which has similar confinement resonances as those of the Xe atom inside C60, the Xe atoms inside C54 and C56 have completely different spectra. It is concluded that the quantum confinement resonances will be destroyed if the shape of the fullerene is deformed significantly from a sphere.

  6. Nonlinear optical properties of neutral and anionic fullerenes

    NASA Astrophysics Data System (ADS)

    Lascola, Robert John

    We have developed coherent anti-Stokes Raman spectroscopy (CARS) lineshape analysis as an accurate and definitive technique for third-order optical nonlinearity measurements of materials. This technique is an interferometric four wave mixing method where the lineshape of a Raman resonance reflects the interference between a sample's nonlinearity and the Raman resonance of a standard. By subjecting the sample and standard to the same experimental conditions, problems associated with separate absolute intensity measurements of the two are avoided. We show that this technique can determine third-order nonlinearities within 10-20%, more accurately than other widely used absolute intensity measurement-based techniques. Using CARS lineshape analysis, we have determined the third order nonlinearities for the first, second, and third anions of [60]fullerene. Hyperpolarizabilities of 2.4 (+/-1.0) × 10-33 esu, 4.0 (+/-1.0) × 10-33 esu, and 7.6 (+/-0.5) × 10 -33 esu are observed for the first, second, and third anions, respectively, at 452 nm. These values are 65-200 times greater than the corresponding value for neutral [60]fullerene and comparable to values for highly conjugated organic polymers like polydiacetylene. The observed increase in the nonlinearity with the addition of charge to the fullerene cage is explained by symmetry considerations. Despite the increases, the hyperpolarizabilities are not sufficient for use in practical optical devices. However, larger nonlinearities can be obtained through the use of rare-earth endohedrals and wavelengths that have smaller detunings with electronic state resonances in the near-infrared. We have also measured an upper limit for the hyperpolarizability of neutral [60]fullerene, 3.0 (+/-1.0) × 10-37 esu at 757 nm. This value is three times lower than the previously measured limit. It is consistent with calculations, which predict values that are much lower than other experimental measurements.

  7. Tripodal exTTF-CTV hosts for fullerenes.

    PubMed

    Huerta, Elisa; Isla, Helena; Pérez, Emilio M; Bo, Carles; Martín, Nazario; de Mendoza, Javier

    2010-04-21

    A receptor for fullerenes featuring three exTTF units linked to a CTV scaffold is described. The exTTF-CTV host forms remarkably stable complexes with both C(60) (log K(a) = 5.3 +/- 0.2) and C(70) (log K(a) = 6.3 +/- 0.6). Light-induced ESR spectra demonstrate that intracomplex PET processes take place in solution. PMID:20350004

  8. Astrophysics and cosmology confront the 17-keV neutrino

    NASA Technical Reports Server (NTRS)

    Kolb, Edward W.; Turner, Michael S.

    1991-01-01

    A host of astrophysical and cosmological arguments severely constrain the properties of a 17 keV Dirac neutrino. Such a neutrino must have interactions beyond those of the standard electroweak theory to reduce its cosmic abundance (through decay or annihilation) by a factor of two hundred. A predicament arises because the additional helicity states of the neutrino necessary to construct a Dirac mass must have interactions strong enough to evade the astrophysical bound from SN 1987A, but weak enough to avoid violating the bound from primordial nucleosynthesis.

  9. Astrophysics and cosmology confront the 17 keV neutrino

    NASA Technical Reports Server (NTRS)

    Kolb, Edward W.; Turner, Michael S.

    1991-01-01

    A host of astrophysical and cosmological arguments severely constrain the properties of a 17 keV Dirac neutrino. Such a neutrino must have interactions beyond those of the standard electroweak theory to reduce its cosmic abundance (through decay or annihilation) by a factor of two hundred. A predicament arises because the additional helicity states of the neutrino necessary to construct a Dirac mass must have interactions strong enough to evade the astrophysical bound from SN 1987A, but weak enough to avoid violating the bound from primordial nucleosynthesis.

  10. 511 keV photons from superconducting cosmic strings.

    PubMed

    Ferrer, Francesc; Vachaspati, Tanmay

    2005-12-31

    We show that a tangle of light superconducting strings in the Milky Way could be the source of the observed 511 keV emission from electron-positron annihilation in the Galactic bulge. The scenario predicts a flux that is in agreement with observations if the strings are at the approximately 1 TeV scale, making the particle physics within reach of planned accelerator experiments. The emission is directly proportional to the galactic magnetic field, and future observations should be able to differentiate the superconducting string scenario from other proposals. PMID:16486335

  11. Computational studies on non-covalent interactions of carbon and boron fullerenes with graphene.

    PubMed

    Manna, Arun K; Pati, Swapan K

    2013-06-24

    First-principles DFT calculations are carried out to study the changes in structures and electronic properties of two-dimensional single-layer graphene in the presence of non-covalent interactions induced by carbon and boron fullerenes (C60, C70, C80 and B80). Our study shows that larger carbon fullerene interacts more strongly than the smaller fullerene, and boron fullerene interacts more strongly than that of its carbon analogue with the same nuclearity. We find that van der Waals interactions play a major role in governing non-covalent interactions between the adsorbed fullerenes and graphene. Moreover, a greater extent of van der Waals interactions found for the larger fullerenes, C80 and B80, relative to smaller C60, and consequently, results in higher stabilisation. We find a small amount of electron transfer from graphene to fullerene, which gives rise to a hole-doped material. We also find changes in the graphene electronic band structures in the presence of these surface-decorated fullerenes. The Dirac cone picture, such as that found in pristine graphene, is significantly modified due to the re-hybridisation of graphene carbon orbitals with fullerenes orbitals near the Fermi energy. However, all of the composites exhibit perfect conducting behaviour. The simulated absorption spectra for all of the graphene-fullerene hybrids do not exhibit a significant change in the absorption peak positions with respect to the pristine graphene absorption spectrum. Additionally, we find that the hole-transfer integral between graphene and C60 is larger than the electron-transfer integrals and the extent of these transfer integrals can be significantly tuned by graphene edge functionalisation with carboxylic acid groups. Our understanding of the non-covalent functionalisation of graphene with various fullerenes would promote experimentalists to explore these systems, for their possible applications in electronic and opto-electronic devices.

  12. Is the Use of Fullerene in Photodynamic Therapy Effective for Atherosclerosis?

    SciTech Connect

    Nitta, Norihisa Seko, Ayumi; Sonoda, Akinaga; Ohta, Shinichi; Tanaka, Toyohiko; Takahashi, Masashi; Murata, Kiyoshi; Takemura, Shizuki; Sakamoto, Tsutomu; Tabata, Yasuhiko

    2008-03-15

    The purpose of this study was to evaluate Fullerene as a therapeutic photosensitizer in the treatment of atherosclerosis. An atherosclerotic experimental rabbit model was prepared by causing intimal injury to bilateral external iliac arteries using balloon expansion. In four atherosclerotic rabbits and one normal rabbit, polyethylene glycol-modified Fullerene (Fullerene-PEG) was infused into the left external iliac artery and illuminated by light emitting diode (LED), while the right external iliac artery was only illuminated by LED. Two weeks later, the histological findings for each iliac artery were evaluated quantitatively and comparisons were made among atherosclerotic Fullerene+LED artery (n = 4), atherosclerotic light artery (n = 4), normal Fullerene+LED artery (n = 1), and normal light artery (n = 1). An additional two atherosclerotic rabbits were studied by fluorescence microscopy, after Fullerene-PEG-Cy5 complex infusion into the left external iliac artery, for evaluation of Fullerene-PEG incorporated within the atherosclerotic lesions. The degree of atherosclerosis in the atherosclerotic Fullerene+LED artery was significantly (p < 0.05) more severe than that in the atherosclerotic LED artery. No pathological change was observed in normal Fullerene+LED and LED arteries. In addition, strong accumulation of Fullerene-PEG-Cy5 complex within the plaque of the left iliac artery of the two rabbits was demonstrated, in contrast to no accumulation in the right iliac artery. We conclude that infusion of a high concentration of Fullerene-PEG followed by photo-illumination resulted not in a suppression of atherosclerosis but in a progression of atherosclerosis in experimental rabbit models. However, this intervention showed no adverse effects on the normal iliac artery.

  13. New fullerene-based mixed materials: Synthesis and characterization

    SciTech Connect

    McBranch, D.; Kohlman, R.; Klimov, V.; Grigorova, M.; Shi, X.; Smilowitz, L.; Mattes, B.R.; Wang, H.; Wudl, F.

    1998-11-01

    This is the final report of a three-year, Laboratory Directed Research and Development (LDRD) project at the Los Alamos National Laboratory (LANL). The authors present results of broadband femtosecond transient absorption and broadband nanosecond optical limiting studies of C{sub 60} and derivatized C{sub 60}. They have investigated both solutions and solid-state mixed materials (sol-gel glass hosts doped with fullerene guests). They show that derivatized fullerenes provide enhanced solubility and processability, with a ground-state absorption extended into the infrared compared with C{sub 60}. They have extensively studied both the dynamic optical response and the excited-state absorption cross sections of solutions and solids for multiple wavelengths in the visible to near infrared. Wavelength-dependent studies show that the optical limiting response improves monotonically at longer wavelengths, demonstrating broadband limiting in all 6,6 mono-adducts and neat C{sub 60}. The authors report new approaches to processing sol-gel glass/fullerene composites to improve the optical limiting performance of solid-state materials to approach the response of solution limiters.

  14. The interaction of He{sup −} with fullerenes

    SciTech Connect

    Mauracher, Andreas; Daxner, Matthias; Huber, Stefan E.; Postler, Johannes; Renzler, Michael; Denifl, Stephan; Scheier, Paul E-mail: andrew.ellis@le.ac.uk; Ellis, Andrew M. E-mail: andrew.ellis@le.ac.uk

    2015-03-14

    The effects of interactions between He{sup −} and clusters of fullerenes in helium nanodroplets are described. Electron transfer from He{sup −} to (C{sub 60}){sub n} and (C{sub 70}){sub n} clusters results in the formation of the corresponding fullerene cluster dianions. This unusual double electron transfer appears to be concerted and is most likely guided by electron correlation between the two very weakly bound outer electrons in He{sup −}. We suggest a mechanism which involves long range electron transfer followed by the conversion of He{sup +}into He{sub 2}{sup +}, where formation of the He–He bond in He{sub 2}{sup +} releases sufficient kinetic energy for the cation and the dianion to escape their Coulombic attraction. By analogy with the corresponding dications, the observation of a threshold size of n ≥ 5 for formation of both (C{sub 60}){sub n}{sup 2−} and (C{sub 70}){sub n}{sup 2−} is attributed to Coulomb explosion rather than an energetic constraint. We also find that smaller dianions can be observed if water is added as a co-dopant. Other aspects of He{sup −} chemistry that are explored include its role in the formation of multiply charged fullerene cluster cations and the sensitivity of cluster dianion formation on the incident electron energy.

  15. Optimization of a Genetic Algorithm for the Functionalization of Fullerenes.

    PubMed

    Addicoat, Matthew A; Page, Alister J; Brain, Zoe E; Flack, Lloyd; Morokuma, Keiji; Irle, Stephan

    2012-05-01

    We present the optimization of a genetic algorithm (GA) that is designed to predict the most stable structural isomers of hydrogenated and hydroxylated fullerene cages. Density functional theory (DFT) and density functional tight binding (DFTB) methods are both employed to compute isomer energies. We show that DFTB and DFT levels of theory are in good agreement with each other and that therefore both sets of optimized GA parameters are very similar. As a prototypical fullerene cage, we consider the functionalization of the C20 species, since for this smallest possible fullerene cage it is possible to compute all possible isomer energies for evaluation of the GA performance. An energy decomposition analysis for both C20Hn and C20(OH)n systems reveals that, for only few functional groups, the relative stabilities of different structural isomers may be rationalized simply with recourse to π-Hückel theory. However, upon a greater degree of functionalization, π-electronic effects alone are incapable of describing the interaction between the functional groups and the distorted cage, and both σ- and π-electronic structure must be taken into account in order to understand the relative isomer stabilities.

  16. Fullerenes, fulleranes and PAHs in the Allende meteorite

    NASA Astrophysics Data System (ADS)

    Becker, Luann; Bunch, T. E.

    1997-07-01

    In this paper we confirm our earlier observations of fullerenes (C60 and C70) in the Allende meteorite (Becker et al., 1994a, 1995). C60 was also detected in two separate carbon-rich (~0.5 - 1.0 %) dark inclusions (Heymann et al., 1987) that were hand picked from the Allende sample. The amounts of C60 detected were ~5 and ~10 ppb respectively, considerably less then what was detected in the Allende 15/21 sample (~100 ppb; Becker et al., 1994a, 1995), suggesting that fullerenes are heterogeneously distributed in the meteorite. In addition, we present evidence for fulleranes (C60Hx), detected in separate samples by laser desorption (reflectron) time-of-flight (TOF) mass spectrometry (LDMS). LDMS spectra for the Allende extracts were remarkably similar to the spectra generated for the synthetic fullerane mixtures. Several fullerane products were synthesized using a rhodium catalyst (Becker et al., 1993a) and separated using high performance liquid chromatography (HPLC). Polycyclic aromatic hydrocarbons (PAHs) were also observed (ppm levels) including benzofluoranthene and corannulene, a cup-shaped molecule that has been proposed as a precursor molecule to the formation of fullerenes in the gas phase (Pope et al., 1993).

  17. Nanoscale fullerene compression of an yttrium carbide cluster.

    PubMed

    Zhang, Jianyuan; Fuhrer, Tim; Fu, Wujun; Ge, Jiechao; Bearden, Daniel W; Dallas, Jerry; Duchamp, James; Walker, Kenneth; Champion, Hunter; Azurmendi, Hugo; Harich, Kim; Dorn, Harry C

    2012-05-23

    The nanoscale parameters of metal clusters and lattices have a crucial influence on the macroscopic properties of materials. Herein, we provide a detailed study on the size and shape of isolated yttrium carbide clusters in different fullerene cages. A family of diyttrium endohedral metallofullerenes with the general formula of Y(2)C(2n) (n = 40-59) are reported. The high field (13)C nuclear magnetic resonance (NMR) and density functional theory (DFT) methods are employed to examine this yttrium carbide cluster in certain family members, Y(2)C(2)@D(5)(450)-C(100), Y(2)C(2)@D(3)(85)-C(92), Y(2)C(2)@C(84), Y(2)C(2)@C(3v)(8)-C(82), and Y(2)C(2)@C(s)(6)-C(82). The results of this study suggest that decreasing the size of a fullerene cage with the same (Y(2)C(2))(4+) cluster results in nanoscale fullerene compression (NFC) from a nearly linear stretched geometry to a constrained "butterfly" structure. The (13)C NMR chemical shift and scalar (1)J(YC) coupling parameters provide a very sensitive measure of this NFC effect for the (Y(2)C(2))(4+) cluster. The crystal structural parameters of a previously reported metal carbide, Y(2)C(3) are directly compared to the (Y(2)C(2))(4+) cluster in the current metallofullerene study.

  18. Thermal Transport in Fullerene Derivatives Using Molecular Dynamics Simulations

    PubMed Central

    Chen, Liang; Wang, Xiaojia; Kumar, Satish

    2015-01-01

    In order to study the effects of alkyl chain on the thermal properties of fullerene derivatives, we perform molecular dynamics (MD) simulations to predict the thermal conductivity of fullerene (C60) and its derivative phenyl-C61-butyric acid methyl ester (PCBM). The results of non-equilibrium MD simulations show a length-dependent thermal conductivity for C60 but not for PCBM. The thermal conductivity of C60, obtained from the linear extrapolation of inverse conductivity vs. inverse length curve, is 0.2  W m−1 K−1 at room temperature, while the thermal conductivity of PCBM saturates at ~0.075  W m−1 K−1 around 20 nm. The different length-dependence behavior of thermal conductivity indicates that the long-wavelength and low-frequency phonons have large contribution to the thermal conduction in C60. The decrease in thermal conductivity of fullerene derivatives can be attributed to the reduction in group velocities, the decrease of the frequency range of acoustic phonons, and the strong scattering of low-frequency phonons with the alkyl chains due to the significant mismatch of vibrational density of states in low frequency regime between buckyball and alkyl chains in PCBM. PMID:26238607

  19. Tunneling spectroscopy of multi-shell carbon fullerenes

    NASA Astrophysics Data System (ADS)

    Doore, Keith; Cook, Matt; Clausen, Eric; Kidd, Tim; Ye, Zhipeng; Ye, Gaihua; He, Rui; Stollenwerk, Andrew

    Carbon allotropes such as fullerenes and nanotubes have generated considerable interest due possible exploitation of their mechanical and electrical properties for practical applications. Carbon onions are a type of fullerene consisting of multiple spherically concentric shells of curved graphitic sheets. Compared to single-shell fullerenes, few studies have been directed toward understanding the structural and electrical properties of carbon onions. Because carbon onions have proven difficult to fabricate in a controlled method, most of these studies have focused on synthesis methods. In this study, we investigate the electrical properties of carbon onions using a scanning tunneling microscope. Carbon onions were fabricated using ultrasonic agitation to break down isopropanol facilitated by a MoS2 catalyst. Particles suspended in the remaining solution were deposited onto atomically flat HOPG substrates. Scanning tunneling spectroscopy indicate that carbon onions can exhibit both metallic and semiconducting properties, similar to carbon nanotubes. This work was supported in part by the National Science Foundation, Grants No. DMR-1206530 and No. DMR-1410496.

  20. Study of urological devices coated with fullerene-like nanoparticles

    NASA Astrophysics Data System (ADS)

    Goldbart, Ohad; Elianov, Olga; Shumalinsky, Dmitry; Lobik, Leonid; Cytron, Shmuel; Rosentsveig, Rita; Wagner, H. Daniel; Tenne, Reshef

    2013-08-01

    Insertion of endoscopes and other medical devices into the human body are ubiquitous, especially among aged males. The applied force for the insertion/extraction of the device from the urethra must overcome endoscope-surface-human-tissue interactions. In daily practice a gel is applied on the endoscope surface, in order to facilitate its entry into the urethra, providing also for local anesthesia. In the present work, a new solid-state lubricant has been added to the gel, in order to reduce the metal-urethra interaction and alleviate the potential damage to the epithelial tissue. For that purpose, a urethra model was designed and fabricated, which allowed a quantitative assessment of the applied force for extraction of the endoscope from a soft polymer-based ring. It is shown that the addition of MoS2 nanoparticles with fullerene-like structure (IF-MoS2) and in particular rhenium-doped nanoparticles (Re:IF-MoS2) to Esracain gel applied on the metal-lead reduced the friction substantially. The Re:IF-MoS2 showed better results than the undoped fullerene-like nanoparticles and both performed better than the gel alone. The mechanism of friction reduction is attributed to fullerenes' ability to roll and act as a separator between the active parts of the model.

  1. Fullerene derivatives as electron acceptors for organic photovoltaic cells.

    PubMed

    Mi, Dongbo; Kim, Ji-Hoon; Kim, Hee Un; Xu, Fei; Hwang, Do-Hoon

    2014-02-01

    Energy is currently one of the most important problems humankind faces. Depletion of traditional energy sources such as coal and oil results in the need to develop new ways to create, transport, and store electricity. In this regard, the sun, which can be considered as a giant nuclear fusion reactor, represents the most powerful source of energy available in our solar system. For photovoltaic cells to gain widespread acceptance as a source of clean and renewable energy, the cost per watt of solar energy must be decreased. Organic photovoltaic cells, developed in the past two decades, have potential as alternatives to traditional inorganic semiconductor photovoltaic cells, which suffer from high environmental pollution and energy consumption during production. Organic photovoltaic cells are composed of a blended film of a conjugated-polymer donor and a soluble fullerene-derivative acceptor sandwiched between a poly(3,4-ethylenedioxythiophene):poly(styrenesulfonate)-coated indium tin oxide positive electrode and a low-work-function metal negative electrode. Considerable research efforts aim at designing and synthesizing novel fullerene derivatives as electron acceptors with up-raised lowest unoccupied molecular orbital energy, better light-harvesting properties, higher electron mobility, and better miscibility with the polymer donor for improving the power conversion efficiency of the organic photovoltaic cells. In this paper, we systematically review novel fullerene acceptors synthesized through chemical modification for enhancing the photovoltaic performance by increasing open-circuit voltage, short-circuit current, and fill factor, which determine the performance of organic photovoltaic cells.

  2. Continuous symmetry of C60 fullerene and its derivatives.

    PubMed

    Sheka, E F; Razbirin, B S; Nelson, D K

    2011-04-21

    Conventionally, the I(h) symmetry of fullerene C(60) is accepted, which is supported by numerous calculations. However, this conclusion results from the consideration of the molecule electron system, of its odd electrons in particular, in a closed-shell approximation without taking the electron spin into account. Passing to the open-shell approximation has led to both the energy and the symmetry lowering up to C(i). Seemingly contradicting to a high-symmetry pattern of experimental recording, particularly concerning the molecule electronic spectra, the finding is considered in this Article from the continuous symmetry viewpoint. Exploiting continuous symmetry measure and continuous symmetry level approaches, it was shown that formal C(i) symmetry of the molecule is by 99.99% I(h). A similar continuous symmetry analysis of the fullerene monoderivatives gives a reasonable explanation of a large variety of their optical spectra patterns within the framework of the same C(1) formal symmetry exhibiting a strong stability of the C(60) skeleton. TOC color pictures present chemical portrait of C(60) in terms of atomic chemical susceptibility (Sheka, E. Fullerenes: Nanochemistry, Nanomagnetism, Nanomedicine, Nanophotonics; CRC Press: Taylor and Francis Group, Boca Raton, 2011).

  3. Heads or tails: how do chemically substituted fullerenes melt?

    PubMed

    Armstrong, Jeff; Mukhopadhyay, Sanghamitra; Bresme, Fernando; Fernandez-Alonso, Felix

    2016-06-29

    We address the question as to whether the melting of chemically substituted fullerenes is driven by the dynamics of the fullerene moiety (the head) or the substituted sub-unit (the tail). To this end, we have performed quasielastic neutron-scattering experiments and classical molecular-dynamics simulations as a function of temperature on the prototypical fullerene derivative phenyl-C61-butyric acid methyl ester. To enable a direct and quantitative comparison between experimental and simulation data, dynamic structure factors for the latter have been calculated from atomic trajectories and further convolved with the known instrument response. A detailed analysis of the energy- and momentum-transfer dependence of this observable in the quasielastic regime shows that melting is entirely driven by temperature-activated tail motions. We also provide quantitative estimates of the activation energy for this process as the material first enters a plastic-crystalline phase, followed by the emergence of a genuine liquid at higher temperatures. PMID:27087579

  4. Measurement of back-bombardment temperature rise in microwave thermionic electron guns

    NASA Astrophysics Data System (ADS)

    Kowalczyk, Jeremy M. D.; Hadmack, Michael R.; Madey, John M. J.

    2013-08-01

    We describe a simple method to measure the back-bombardment heating temperature rise as a function of time in pulsed microwave thermionic guns using a fast rise-time InGaAs detector and optical pyrometer. Gaining knowledge of the nature of that temperature rise and the corresponding current out of the gun are the first steps in devising a scheme to counteract the back-bombardment heating which lengthens the micropulses, limits the macropulse length, and increases the energy spread of the emitted electron beam. We measured a temperature rise of 59 K in our LaB6 cathode which delivered a peak of 600 mA over a 5 μs RF pulse in our 0.33 MV/cm peak field, 2.856 GHz thermionic electron gun.

  5. Surface Roughness Effect on Secondary Electron Emission from Beryllium under Electron Bombardment

    NASA Astrophysics Data System (ADS)

    Kawata, Jun; Ohya, Kaoru

    1994-02-01

    A direct Monte Carlo model is developed to simulate secondary electron emission from beryllium with a flat surface and Gaussian-ripple surfaces. The calculated electron yield and energy distribution of secondary electrons are in reasonable agreement with the experimental data. The emphasis is in this study put on the effect of surface roughness on secondary electron emission. The number of secondary electrons emitted largely depends on the position of bombardment of primary electrons on the ripple surface. The energy distribution of secondary electrons emitted from the ripple surface shifts towards low-energy side in comparison with the distribution for the flat surface. The over-cosine and gourd-shaped angular distributions, depending on the position of bombardment, are calculated for emission angle of electrons from the ripple surface; the distribution for the flat surface agrees quite well with the cosine distribution.

  6. Theory of nanoscale pattern formation produced by oblique-incidence ion bombardment of binary compounds

    NASA Astrophysics Data System (ADS)

    Motta, Francis C.; Shipman, Patrick D.; Bradley, R. Mark

    2014-08-01

    The Bradley-Shipman theory explains the genesis of the highly ordered hexagonal arrays of nanodots that can result from normal-incidence ion bombardment of a binary material [R. M. Bradley and P. D. Shipman, Phys. Rev. Lett. 105, 145501 (2010), 10.1103/PhysRevLett.105.145501]. To facilitate experimental testing of the theory, we generalize it to oblique-incidence bombardment with two diametrically opposed beams. Using analytical methods valid in the weakly nonlinear regime and computer simulations, we demonstrate that an unusual "dots-on-ripples" topography can emerge for nonzero angles of ion incidence θ. In such a pattern, nanodots arranged in a hexagonal array sit atop a ripple topography. We find that if dots-on-ripples are supplanted by surface ripples as θ or the ion energy are varied, the transition is continuous rather than hysteretic.

  7. Electronic structure of nitinol surfaces oxidized by low-energy ion bombardment

    SciTech Connect

    Petravic, M. Varasanec, M.; Peter, R.; Kavre, I.; Metikos-Hukovic, M.; Yang, Y.-W.

    2014-06-28

    We have studied the electronic structure of nitinol exposed to low-energy oxygen-ion bombardment, using x-ray photoemission spectroscopy (XPS) and near-edge x-ray absorption fine structure (NEXAFS) spectroscopy. XPS spectra reveal a gradual transformation of nitinol surfaces into TiO{sub 2} with increased dose of implanted oxygen. No oxidation of Ni atoms has been detected. NEXAFS spectra around O K-edge and Ti L{sub 2,3}-edge, reflecting the element-specific partial density of empty electronic states, exhibit features, which can be attributed to the creation of molecular orbitals, crystal field splitting, and the absence of long-range order, characteristic of the amorphous TiO{sub 2}. Based on these results, we discuss the oxidation kinetics of nitinol under low-energy oxygen-ion bombardment.

  8. Measurement of back-bombardment temperature rise in microwave thermionic electron guns.

    PubMed

    Kowalczyk, Jeremy M D; Hadmack, Michael R; Madey, John M J

    2013-08-01

    We describe a simple method to measure the back-bombardment heating temperature rise as a function of time in pulsed microwave thermionic guns using a fast rise-time InGaAs detector and optical pyrometer. Gaining knowledge of the nature of that temperature rise and the corresponding current out of the gun are the first steps in devising a scheme to counteract the back-bombardment heating which lengthens the micropulses, limits the macropulse length, and increases the energy spread of the emitted electron beam. We measured a temperature rise of 59 K in our LaB6 cathode which delivered a peak of 600 mA over a 5 μs RF pulse in our 0.33 MV/cm peak field, 2.856 GHz thermionic electron gun.

  9. Molecular dynamics analysis of metal surface sputtering due to bombardment of high energy particles

    SciTech Connect

    Kumar, K. Kishore; Donbosco, Ferdin Sagai; Kumar, Rakesh

    2014-12-09

    Dependence of sputtering yield of Cu (100) and Ni (100) metal surface by bombardment of 200 Ar ions at various energies and angles of projections is investigated in this paper. The sputtering yield has been calculated by performing molecular dynamics simulation and the same is compared with experiments and theoretical predictions wherever possible. Additionally the kinetic energy, velocity and scattering angle distribution for sputtered and incident atoms are also observed. The results obtained from the present molecular dynamics simulations are found to be in good agreement with experimental data and theoretical estimates. It is observed that the sputtering yield increases as the energy of the bombarding ion increases. Furthermore as the incidence angle increases, the sputtering yield increases until a specific angle and then decreases as normal incidence is approached.

  10. Optical probe for surface and subsurface defects induced by ion bombardment

    PubMed Central

    Sun, L D; Hohage, M; Zeppenfeld, P

    2013-01-01

    We demonstrate that reflectance difference spectroscopy (RDS) is sensitive to defects induced by ion bombardment, located either in the topmost layer or in the subsurface region. Most importantly, these two kinds of defects can be spectrally discriminated, since the corresponding signatures in the RD spectrum arise from perturbations of different types of electronic states: The defects in the topmost surface layer mainly lead to a quenching of the optical anisotropy related to surface states, whereas the subsurface defects strongly affect the optical anisotropy originating from transitions between surface-modified bulk electronic states. Consequently, RDS can be used to simultaneously monitor the defects in the topmost surface layer and in the subsurface region in-situ during ion bombardment and thermal annealing. Characteristic RD spectra and the corresponding STM images for a Cu(110) substrate before and after healing of the subsurface defects. PMID:26089989

  11. Measurement of back-bombardment temperature rise in microwave thermionic electron guns.

    PubMed

    Kowalczyk, Jeremy M D; Hadmack, Michael R; Madey, John M J

    2013-08-01

    We describe a simple method to measure the back-bombardment heating temperature rise as a function of time in pulsed microwave thermionic guns using a fast rise-time InGaAs detector and optical pyrometer. Gaining knowledge of the nature of that temperature rise and the corresponding current out of the gun are the first steps in devising a scheme to counteract the back-bombardment heating which lengthens the micropulses, limits the macropulse length, and increases the energy spread of the emitted electron beam. We measured a temperature rise of 59 K in our LaB6 cathode which delivered a peak of 600 mA over a 5 μs RF pulse in our 0.33 MV/cm peak field, 2.856 GHz thermionic electron gun. PMID:24007094

  12. A low background-rate detector for ions in the 5 to 50 keV energy range to be used for radioisotope dating with a small cyclotron

    SciTech Connect

    Friedman, P.G.

    1986-11-25

    Accelerator mass spectrometry in tandem Van de Graaff accelerators has proven successful for radioisotope dating small samples. We are developing a 20 cm diameter 30 to 40 keV cyclotron dedicated to high-sensitivity radioisotope dating, initially for /sup 14/C. At this energy, range and dE/dx methods of particle identification are impossible. Thus arises the difficult problem of reliably detecting 30 to 40 keV /sup 14/C at 10/sup -2/ counts/sec in the high background environment of the cyclotron, where lower energy ions, electrons, and photons bombard the detector at much higher rates. We have developed and tested an inexpensive, generally useful ion detector that allows dark-count rates below 10/sup -4/ counts/sec and excellent background suppression. With the cyclotron tuned near the /sup 13/CH background peak, to the frequency for /sup 14/C, the detector suppresses the background to 6 x 10/sup -4/ counts/sec. For each /sup 14/C ion the detectors grazing-incidence Al/sub 2/O/sub 3/ conversion dynode emits about 20 secondary electrons, which are independently multiplied in separate pores of a microchannel plate. The output signal is proportional to the number of secondary electrons, allowing pulse-height discrimination of background. We have successfully tested the detector with positive /sup 12/C, /sup 23/Na, /sup 39/K, /sup 41/K, /sup 85/Rb, /sup 87/Rb, and /sup 133/Cs at 5 to 40 keV, and with 36 keV negative /sup 12/C and /sup 13/CH. It should detect ions and neutrals of all species, at energies above 5 keV, with good efficiency and excellent background discrimination. Counting efficiency and background discrimination improve with higher ion energy. The detector can be operated at least up to 2 x 10/sup -7/ Torr and be repeatedly exposed to air. The maximum rate is 10/sup 6.4/ ions/sec in pulse counting mode and 10/sup 9.7/ ions/sec in current integrating mode.

  13. On the possibility of realizing the singlet oxygen generator on the base of optically pumped fullerenes and of fullerene-like nanoparticles

    NASA Astrophysics Data System (ADS)

    Danilov, Oleg B.; Belousova, I. M.; Mak, A. A.; Belousov, V. P.; Grenishin, A. S.; Kiselev, V. I.; Kris'ko, A. V.; Ponomaryev, A. N.; Sosnov, E. N.

    2003-11-01

    We present the experimental results on singlet oxygen generation via interaction of pumping photons (laser or lamp light), fullerenes (or fullerene-like nanoparticles - astralens) and oxygen in solid-state structures, in solutions and in suspensions. It was shown that the singlet oxygen is adsorbed by the solid-state fullerene coating and by powder-like astralen. It was shown that in course of evaporation of the solution (due to the pump action) is observed the singlet oxygen extraction to the gaseous phase, and the lifetime of 1ΔO2 grows significantly.

  14. Width of the 3841-keV level in 17O

    NASA Astrophysics Data System (ADS)

    Moreh, R.; Beck, O.; Kneissl, U.; Margraf, J.; Maser, H.; Pitz, H. H.; Herzberg, R.-D.; Pietralla, N.; Zilges, A.

    1994-10-01

    The width of 3841-keV level in 17O was precisely measured in nuclear resonance fluorescence experiments performed at the Stuttgart Dynamitron facility. The result of Γ(3841 keV)=(92+/-6) meV is compared with upper limits quoted in the literature. Possible particle-hole configurations of the 3841-keV level are discussed.

  15. Magnetic flux density environment of several electron-bombardment ion thrusters

    NASA Technical Reports Server (NTRS)

    Danilowicz, R. L.

    1973-01-01

    Measurements of the external magnetic field of several electron-bombardment mercury ion thrusters were made using a single axis fluxgate magnetometer. The axial dipole moment accounted for most of the external field. In addition, residual fields from an electromagnet thruster were approximately 20 percent of the initial field. Simple degaussing of the axial magnets reduced the residual fields to 1 to 2 percent of the initial field.

  16. Fertile transgenic Brachiaria ruziziensis (ruzigrass) plants by particle bombardment of tetraploidized callus.

    PubMed

    Ishigaki, Genki; Gondo, Takahiro; Suenaga, Kazuhiro; Akashi, Ryo

    2012-03-15

    We have produced transgenic plants of the tropical forage crop Brachiaria ruziziensis (ruzigrass) by particle bombardment-mediated transformation of multiple-shoot clumps and embryogenic calli. Cultures of multiple-shoot clumps and embryogenic calli were induced on solidified MS medium supplemented with 0.5mg/L 2,4-dichlorophenoxyacetic acid (2,4-D) and 2mg/L 6-benzylaminopurine (BAP) or 4mg/L 2,4-D and 0.2mg/L BAP, respectively. Both cultures were bombarded with a vector containing an herbicide resistance gene (bar) as a selectable marker and the β-glucuronidase (GUS) reporter gene. Sixteen hours after bombardment, embryogenic calli showed a significantly higher number of transient GUS expression spots per plate and callus than multiple-shoot clumps, suggesting that embryogenic callus is the more suitable target tissue. Following bombardment and selection with 10mg/L bialaphos, herbicide-resistant embryogenic calli regenerated shoots and roots in vitro, and mature transgenic plants have been raised in the greenhouse. Polymerase chain reaction (PCR) and DNA gel blot analysis verified that the GUS gene was integrated into the genome of the two regenerated lines. In SacI digests, the two transgenic lines showed two or five copies of GUS gene fragments, respectively, and integration at different sites. Histochemical analysis revealed stable expression in roots, shoots and inflorescences. Transgenic plants derived from diploid target callus turned out to be sterile, while transgenics from colchicine-tetraploidized callus were fertile. PMID:22236981

  17. Spectroscopic second-harmonic generation during Ar+ -ion bombardment of Si(100)

    NASA Astrophysics Data System (ADS)

    Gielis, J. J. H.; Gevers, P. M.; Stevens, A. A. E.; Beijerinck, H. C. W.; van de Sanden, M. C. M.; Kessels, W. M. M.

    2006-10-01

    Spectroscopic and real time optical second-harmonic generation (SHG) has been applied to gain insight into the surface and interface processes during low-energy (70-1000eV) Ar+ -ion bombardment of H terminated Si(100). The Ar+ -ion bombardment of the crystalline silicon (c-Si) , which creates a layer of amorphous silicon (a-Si) , has been studied in the SH photon energy range of 2.7-3.5eV . The time-resolved SHG signal has been observed to increase with an order of magnitude upon ion bombardment. Spectroscopic SHG during ion bombardment and after subsequent XeF2 dosing indicates that the SHG signal has both a contribution generated at the buried interface between the a-Si and the c-Si and an additional contribution originating from the a-Si surface. By separating these contributions using a critical point model it has been shown that the SHG spectra consist of a sharp resonance at 3.36eV with a linewidth of 0.1eV at the buried a-Si/c-Si interface and a much broader resonance at a resonance energy of 3.2eV with a linewidth of 0.5eV at the a-Si surface. The former resonance is identified to originate from E0'/E1 transitions between bulk electronic states in the c-Si that are modified due to the vicinity of the interface, while the latter resonance is caused by transitions related to Si-Si bonds in the surface region of the a-Si . The time-resolved dynamics of the SHG signal can help in understanding the mechanism of ion-beam and plasma etching of silicon.

  18. Highly ordered nanoscale patterns produced by masked ion bombardment of a moving solid surface

    NASA Astrophysics Data System (ADS)

    Gelfand, Martin P.; Bradley, R. Mark

    2012-09-01

    We introduce a fabrication method in which a mask with a long, narrow slit is placed between the source of an ion beam and the surface of a solid moving with constant speed. Numerical simulations reveal the method can generate surface ripples and arrays of nanoholes that are virtually defect free. In contrast, the patterns produced by ion bombardment with a broad, unmasked beam are typically rife with defects.

  19. Preliminary results of the mission profile life test of a 30 cm Hg bombardment thruster

    NASA Technical Reports Server (NTRS)

    Bechtel, R. T.; James, E. L.

    1979-01-01

    Long term tests were performed on a 30 cm Hg bombardment thruster and a power processing unit to determine lifetime characteristics. The thruster performance data and other operational characteristics taken at various times during the test segment are presented and evaluated with the life limiting mechanisms: discharge chamber erosion, deposition and spalling, external erosion, cathode degradation, and propellant isolator leakage. The control algorithms for thruster start up, steady state operation, throttle, detection and correction of off normal conditions, and shutdown are discussed.

  20. The change of the electronic structure of alkali halide films on W(110) under electron bombardment

    NASA Astrophysics Data System (ADS)

    Dieckhoff, S.; Maus-Friedrichs, W.; Kempter, V.

    1992-03-01

    NaCl and Csl films of up to four layers were deposited onto W(110) surfaces and investigated by metastable impact electron spectroscopy (MIES), UPS and AES. The electronic structure of the films under electron bombardment was then studied by MIES/UPS. The results are compared with the corresponding ones obtained by thermal desorption spectroscopy (TDS). An interpretation of the results is attempted on the basis of existing theories for desorption induced by electronic transitions (DIET) of alkali halides.