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Sample records for direct real-space observation

  1. Direct real-space observation of nearly stochastic behavior in magnetization reversal process on a nanoscale

    SciTech Connect

    Im, M.-Y.; Kim, D.-H.; Lee, K.-D.; Fischer, P.; Shin, S.-C.

    2007-06-01

    We report a non-deterministic nature in the magnetization reversal of nanograins of CoCrPt alloy film. Magnetization reversal process of CoCrPt alloy film is investigated using high resolution soft X-ray microscopy which provides real space images with a spatial resolution of 15 nm. Domain nucleation sites mostly appear stochastically distributed within repeated hysteretic cycles, where the correlation increases as the strength of the applied magnetic field increases in the descending and ascending branches of the major hysteresis loop. In addition, domain configuration is mostly asymmetric with inversion of an applied magnetic field in the hysteretic cycle. Nanomagnetic simulation considering thermal fluctuations of the magnetic moments of the grains explains the nearly stochastic nature of the domain nucleation behavior observed in CoCrPt alloy film. With the bit size in high-density magnetic recording media approaching nanometer length scale, one of the fundamental and crucial issues is whether the domain nucleation during magnetization reversal process exhibits a deterministic behavior. Repeatability of local domain nucleation and deterministic switching behavior are basic and essential factors for achieving high performance in high-density magnetic recording [1-3]. Most experimental studies on this issue reported so far have been mainly performed by indirect probes through macroscopic hysteresis loop and Barkhausen pattern measurements, which provide the ensemble-average magnetization. Thus, they are inadequate to gain insight into the domain-nucleation behavior on a nanometer length scale during the magnetization reversal process [4-6]. Very recently, coherent X-ray speckle metrology, where the speckle pattern observed in reciprocal space acts as a fingerprint of the domain configurations, was adopted to investigate stochastic behavior in the magnetization reversal of a Co/Pt multilayer film [7,8]. However, no direct observation on the stochastic behavior of

  2. Real Space Observation of Helical Spin Order

    NASA Astrophysics Data System (ADS)

    Uchida, Masaya

    2007-03-01

    When a symmetry gets spontaneously broken in a phase transition, topological defects are routinely formed. There are numerous examples of topological defects in condensed matter systems, such as, vortices in superconductors, vortices in superfluid helium, monopoles and strings in liquid crystals, etc. A similar picture would emerge in helimagnets. It is therefore interesting to deepen our understanding of how, what kind of, and why magnetic defects form and how they evolve after formation in helimagnets. In recent years, there have been significant advances in the experiment [1] and in the theories [2] of phases and textures in helimagnets. This will have a significant impact on our understanding of not only the puzzling behavior of the helimagnet MnSi with non-Fermi-liquid transport properties [3], but also phase transitions and phase diagrams in different condensed matter systems. In this paper, we describe the current status of our experiments. To see the helical spin order and magnetic defects in metal silicides such as (Fe, Co)Si and FeGe in real space, we used Lorentz electron microscopy, combined with the transport of intensity equation (TIE) analysis or holographic interference microscopy. This method has allowed us to find the topological defect similar to atomic dislocations in the crystal lattice. Furthermore, by applying magnetic fields, we directly observed the deformation processes of the helical spin order, accompanied by nucleation, movement, and annihilation of the magnetic defects. [1] M. Uchida et al., Science 311, 359 (2006). [2] U. K. R"oßler, A. N. Bogdanov, and C. Pfleiderer, Nature 442, 797 (2006); B. Binz, A. Vishwanath, and V. Aji, Phys. Rev. Lett., 96, 207202 (2006); S. Tewari, D. Belitz, and T. R. Kirkpatric, Phys. Rev. Lett., 96, 47207 (2006). [3] C. Pfleiderer et al., Nature 427, 227 (2004).

  3. Real-space observation of photonic nanojet in dielectric microspheres

    NASA Astrophysics Data System (ADS)

    Liu, Cheng-Yang; Wang, Yung-Hsun

    2014-07-01

    The three-dimensional real-space observation of photonic nanojet in different microspheres illuminated by a laser is reported. The finite-difference time-domain technique is used to perform the three-dimensional numerical simulation for the dielectric microspheres. The key parameters of photonic nanojet are measured by using a scanning optical microscope system. We reconstruct the three-dimensional real-space photonic nanojets from the collected stack of scanning images for polystyrene microspheres of 3 μm, 5 μm, and 8 μm diameters deposited on a glass substrate. Experimental results are compared to calculations and are found in good agreement with simulation results. The full width at half-maximum of the nanojet is 331 nm for a 3 μm microsphere at an incident wavelength of 633 nm. Our investigations show that photonic nanojets can be efficiently imaged by a microsphere and straightforwardly extended to rapidly distinguish the nano-objects in the far-field optical system.

  4. Towards sub-nanometer real-space observation of spin and orbital magnetism at the Fe/MgO interface

    NASA Astrophysics Data System (ADS)

    Thersleff, Thomas; Muto, Shunsuke; Werwiński, Mirosław; Spiegelberg, Jakob; Kvashnin, Yaroslav; Hjӧrvarsson, Björgvin; Eriksson, Olle; Rusz, Ján; Leifer, Klaus

    2017-03-01

    While the performance of magnetic tunnel junctions based on metal/oxide interfaces is determined by hybridization, charge transfer, and magnetic properties at the interface, there are currently only limited experimental techniques with sufficient spatial resolution to directly observe these effects simultaneously in real-space. In this letter, we demonstrate an experimental method based on Electron Magnetic Circular Dichroism (EMCD) that will allow researchers to simultaneously map magnetic transitions and valency in real-space over interfacial cross-sections with sub-nanometer spatial resolution. We apply this method to an Fe/MgO bilayer system, observing a significant enhancement in the orbital to spin moment ratio that is strongly localized to the interfacial region. Through the use of first-principles calculations, multivariate statistical analysis, and Electron Energy-Loss Spectroscopy (EELS), we explore the extent to which this enhancement can be attributed to emergent magnetism due to structural confinement at the interface. We conclude that this method has the potential to directly visualize spin and orbital moments at buried interfaces in magnetic systems with unprecedented spatial resolution.

  5. Towards sub-nanometer real-space observation of spin and orbital magnetism at the Fe/MgO interface.

    PubMed

    Thersleff, Thomas; Muto, Shunsuke; Werwiński, Mirosław; Spiegelberg, Jakob; Kvashnin, Yaroslav; Hjӧrvarsson, Björgvin; Eriksson, Olle; Rusz, Ján; Leifer, Klaus

    2017-03-24

    While the performance of magnetic tunnel junctions based on metal/oxide interfaces is determined by hybridization, charge transfer, and magnetic properties at the interface, there are currently only limited experimental techniques with sufficient spatial resolution to directly observe these effects simultaneously in real-space. In this letter, we demonstrate an experimental method based on Electron Magnetic Circular Dichroism (EMCD) that will allow researchers to simultaneously map magnetic transitions and valency in real-space over interfacial cross-sections with sub-nanometer spatial resolution. We apply this method to an Fe/MgO bilayer system, observing a significant enhancement in the orbital to spin moment ratio that is strongly localized to the interfacial region. Through the use of first-principles calculations, multivariate statistical analysis, and Electron Energy-Loss Spectroscopy (EELS), we explore the extent to which this enhancement can be attributed to emergent magnetism due to structural confinement at the interface. We conclude that this method has the potential to directly visualize spin and orbital moments at buried interfaces in magnetic systems with unprecedented spatial resolution.

  6. Towards sub-nanometer real-space observation of spin and orbital magnetism at the Fe/MgO interface

    PubMed Central

    Thersleff, Thomas; Muto, Shunsuke; Werwiński, Mirosław; Spiegelberg, Jakob; Kvashnin, Yaroslav; Hjӧrvarsson, Björgvin; Eriksson, Olle; Rusz, Ján; Leifer, Klaus

    2017-01-01

    While the performance of magnetic tunnel junctions based on metal/oxide interfaces is determined by hybridization, charge transfer, and magnetic properties at the interface, there are currently only limited experimental techniques with sufficient spatial resolution to directly observe these effects simultaneously in real-space. In this letter, we demonstrate an experimental method based on Electron Magnetic Circular Dichroism (EMCD) that will allow researchers to simultaneously map magnetic transitions and valency in real-space over interfacial cross-sections with sub-nanometer spatial resolution. We apply this method to an Fe/MgO bilayer system, observing a significant enhancement in the orbital to spin moment ratio that is strongly localized to the interfacial region. Through the use of first-principles calculations, multivariate statistical analysis, and Electron Energy-Loss Spectroscopy (EELS), we explore the extent to which this enhancement can be attributed to emergent magnetism due to structural confinement at the interface. We conclude that this method has the potential to directly visualize spin and orbital moments at buried interfaces in magnetic systems with unprecedented spatial resolution. PMID:28338011

  7. An atomic model of brome mosaic virus using direct electron detection and real-space optimization

    NASA Astrophysics Data System (ADS)

    Wang, Zhao; Hryc, Corey F.; Bammes, Benjamin; Afonine, Pavel V.; Jakana, Joanita; Chen, Dong-Hua; Liu, Xiangan; Baker, Matthew L.; Kao, Cheng; Ludtke, Steven J.; Schmid, Michael F.; Adams, Paul D.; Chiu, Wah

    2014-09-01

    Advances in electron cryo-microscopy have enabled structure determination of macromolecules at near-atomic resolution. However, structure determination, even using de novo methods, remains susceptible to model bias and overfitting. Here we describe a complete workflow for data acquisition, image processing, all-atom modelling and validation of brome mosaic virus, an RNA virus. Data were collected with a direct electron detector in integrating mode and an exposure beyond the traditional radiation damage limit. The final density map has a resolution of 3.8 Å as assessed by two independent data sets and maps. We used the map to derive an all-atom model with a newly implemented real-space optimization protocol. The validity of the model was verified by its match with the density map and a previous model from X-ray crystallography, as well as the internal consistency of models from independent maps. This study demonstrates a practical approach to obtain a rigorously validated atomic resolution electron cryo-microscopy structure.

  8. An atomic model of brome mosaic virus using direct electron detection and real-space optimization.

    PubMed

    Wang, Zhao; Hryc, Corey F; Bammes, Benjamin; Afonine, Pavel V; Jakana, Joanita; Chen, Dong-Hua; Liu, Xiangan; Baker, Matthew L; Kao, Cheng; Ludtke, Steven J; Schmid, Michael F; Adams, Paul D; Chiu, Wah

    2014-09-04

    Advances in electron cryo-microscopy have enabled structure determination of macromolecules at near-atomic resolution. However, structure determination, even using de novo methods, remains susceptible to model bias and overfitting. Here we describe a complete workflow for data acquisition, image processing, all-atom modelling and validation of brome mosaic virus, an RNA virus. Data were collected with a direct electron detector in integrating mode and an exposure beyond the traditional radiation damage limit. The final density map has a resolution of 3.8 Å as assessed by two independent data sets and maps. We used the map to derive an all-atom model with a newly implemented real-space optimization protocol. The validity of the model was verified by its match with the density map and a previous model from X-ray crystallography, as well as the internal consistency of models from independent maps. This study demonstrates a practical approach to obtain a rigorously validated atomic resolution electron cryo-microscopy structure.

  9. Direct real space observation of magneto-electronic inhomogeneity in ultra-thin film La{sub 0.5}Sr{sub 0.5}CoO{sub 3−δ} on SrTiO{sub 3}(001)

    SciTech Connect

    Kelly, S.; Galli, F.; Aarts, J. E-mail: aarts@physics.leidenuniv.nl; Bose, Shameek; Sharma, M.; Leighton, C. E-mail: aarts@physics.leidenuniv.nl

    2014-09-15

    Recent magnetotransport and neutron scattering measurements implicate interfacial magneto-electronic phase separation as the origin of the degradation in transport and magnetism in ultra-thin film La{sub 1−x}Sr{sub x}CoO{sub 3} on SrTiO{sub 3}(001). Here, using low temperature scanning tunneling microscopy and spectroscopy the first direct, real space observation of this nanoscopic electronic inhomogeneity is provided. Films of thickness 12.4 nm (32 unit cells) are found to exhibit spatially uniform conductance, in stark contrast to 4.7 nm (12 unit cell) films that display rich variations in conductance, and thus local density of states. The electronic heterogeneity occurs across a hierarchy of length scales (5–50 nm), with complex correlations with both topography and applied magnetic fields. These results thus provide a direct observation of magneto-electronic inhomogeneity in SrTiO{sub 3}(001)/La{sub 0.5}Sr{sub 0.5}CoO{sub 3} at thicknesses below 6–7 nm, in good agreement with less direct techniques.

  10. Observation of dynamic atom-atom correlation in liquid helium in real space

    NASA Astrophysics Data System (ADS)

    Dmowski, W.; Diallo, S. O.; Lokshin, K.; Ehlers, G.; Ferré, G.; Boronat, J.; Egami, T.

    2017-05-01

    Liquid 4He becomes superfluid and flows without resistance below temperature 2.17 K. Superfluidity has been a subject of intense studies and notable advances were made in elucidating the phenomenon by experiment and theory. Nevertheless, details of the microscopic state, including dynamic atom-atom correlations in the superfluid state, are not fully understood. Here using a technique of neutron dynamic pair-density function (DPDF) analysis we show that 4He atoms in the Bose-Einstein condensate have environment significantly different from uncondensed atoms, with the interatomic distance larger than the average by about 10%, whereas the average structure changes little through the superfluid transition. DPDF peak not seen in the snap-shot pair-density function is found at 2.3 Å, and is interpreted in terms of atomic tunnelling. The real space picture of dynamic atom-atom correlations presented here reveal characteristics of atomic dynamics not recognized so far, compelling yet another look at the phenomenon.

  11. Real-space observation of unbalanced charge distribution inside a perovskite-sensitized solar cell.

    PubMed

    Bergmann, Victor W; Weber, Stefan A L; Javier Ramos, F; Nazeeruddin, Mohammad Khaja; Grätzel, Michael; Li, Dan; Domanski, Anna L; Lieberwirth, Ingo; Ahmad, Shahzada; Berger, Rüdiger

    2014-09-22

    Perovskite-sensitized solar cells have reached power conversion efficiencies comparable to commercially available solar cells used for example in solar farms. In contrast to silicon solar cells, perovskite-sensitized solar cells can be made by solution processes from inexpensive materials. The power conversion efficiency of these cells depends substantially on the charge transfer at interfaces. Here we use Kelvin probe force microscopy to study the real-space cross-sectional distribution of the internal potential within high efficiency mesoscopic methylammonium lead tri-iodide solar cells. We show that the electric field is homogeneous through these devices, similar to that of a p-i-n type junction. On illumination under short-circuit conditions, holes accumulate in front of the hole-transport layer as a consequence of unbalanced charge transport in the device. After light illumination, we find that trapped charges remain inside the active device layers. Removing these traps and the unbalanced charge injection could enable further improvements in performance of perovskite-sensitized solar cells.

  12. Observation of dynamic atom-atom correlation in liquid helium in real space

    DOE PAGES

    Dmowski, W.; Diallo, S. O.; Lokshin, K.; ...

    2017-05-04

    Liquid 4He becomes superfluid and flows without resistance below temperature 2.17 K. Superfluidity has been a subject of intense studies and notable advances were made in elucidating the phenomenon by experiment and theory. Nevertheless, details of the microscopic state, including dynamic atom–atom correlations in the superfluid state, are not fully understood. Here using a technique of neutron dynamic pair-density function (DPDF) analysis we show that 4He atoms in the Bose–Einstein condensate have environment significantly different from uncondensed atoms, with the interatomic distance larger than the average by about 10%, whereas the average structure changes little through the superfluid transition. DPDFmore » peak not seen in the snap-shot pair-density function is found at 2.3 Å, and is interpreted in terms of atomic tunnelling. The real space picture of dynamic atom–atom correlations presented here reveal characteristics of atomic dynamics not recognized so far, compelling yet another look at the phenomenon.« less

  13. Observation of dynamic atom-atom correlation in liquid helium in real space.

    PubMed

    Dmowski, W; Diallo, S O; Lokshin, K; Ehlers, G; Ferré, G; Boronat, J; Egami, T

    2017-05-04

    Liquid (4)He becomes superfluid and flows without resistance below temperature 2.17 K. Superfluidity has been a subject of intense studies and notable advances were made in elucidating the phenomenon by experiment and theory. Nevertheless, details of the microscopic state, including dynamic atom-atom correlations in the superfluid state, are not fully understood. Here using a technique of neutron dynamic pair-density function (DPDF) analysis we show that (4)He atoms in the Bose-Einstein condensate have environment significantly different from uncondensed atoms, with the interatomic distance larger than the average by about 10%, whereas the average structure changes little through the superfluid transition. DPDF peak not seen in the snap-shot pair-density function is found at 2.3 Å, and is interpreted in terms of atomic tunnelling. The real space picture of dynamic atom-atom correlations presented here reveal characteristics of atomic dynamics not recognized so far, compelling yet another look at the phenomenon.

  14. Observation of dynamic atom-atom correlation in liquid helium in real space

    PubMed Central

    Dmowski, W.; Diallo, S. O.; Lokshin, K.; Ehlers, G.; Ferré, G.; Boronat, J.; Egami, T.

    2017-01-01

    Liquid 4He becomes superfluid and flows without resistance below temperature 2.17 K. Superfluidity has been a subject of intense studies and notable advances were made in elucidating the phenomenon by experiment and theory. Nevertheless, details of the microscopic state, including dynamic atom–atom correlations in the superfluid state, are not fully understood. Here using a technique of neutron dynamic pair-density function (DPDF) analysis we show that 4He atoms in the Bose–Einstein condensate have environment significantly different from uncondensed atoms, with the interatomic distance larger than the average by about 10%, whereas the average structure changes little through the superfluid transition. DPDF peak not seen in the snap-shot pair-density function is found at 2.3 Å, and is interpreted in terms of atomic tunnelling. The real space picture of dynamic atom–atom correlations presented here reveal characteristics of atomic dynamics not recognized so far, compelling yet another look at the phenomenon. PMID:28469252

  15. Real-Space Direct Visualization of the Layer-Dependent Roughening Transition in Nanometer-Thick Pb Films

    NASA Astrophysics Data System (ADS)

    Calleja, F.; Passeggi, M. C. G., Jr.; Hinarejos, J. J.; de Parga, A. L. Vázquez; Miranda, R.

    2006-11-01

    By means of variable-temperature scanning tunneling microscopy and spectroscopy we studied the thickness-dependent roughening temperature of Pb films grown on Cu(111), whose electronic structure and total energy is controlled by quantum well states created by the spatial confinement of electrons. Large scale STM images are employed to quantify the layer population, i.e., the fraction of the surface area covered by different Pb thicknesses, directly in the real space as a function of temperature. The roughening temperature oscillates repeatedly with bilayer periodicity plus a longer beating period, mirroring the thickness dependence of surface energy calculations. Conditions have been found to stabilize at 300 K Pb films of particular magic thicknesses, atomically flat over microns.

  16. Real-space observation of molecular motion induced by femtosecond laser pulses.

    PubMed

    Bartels, Ludwig; Wang, Feng; Möller, Dietmar; Knoesel, Ernst; Heinz, Tony F

    2004-07-30

    Femtosecond laser irradiation is used to excite adsorbed CO molecules on a Cu110 surface; the ensuing motion of individual molecules across the surface is characterized on a site-to-site basis by in situ scanning tunneling microscopy. Adsorbate motion both along and perpendicular to the rows of the Cu110 surface occurs readily, in marked contrast to the behavior seen for equilibrium diffusion processes. The experimental findings for the probability and direction of the molecular motion can be understood as a manifestation of strong coupling between the adsorbates' lateral degrees of freedom and the substrate electronic excitation produced by the femtosecond laser radiation.

  17. Real space channelization for generic DBT system image quality evaluation with channelized Hotelling observer

    NASA Astrophysics Data System (ADS)

    Petrov, Dimitar; Cockmartin, Lesley; Marshall, Nicholas; Vancoillie, Liesbeth; Young, Kenneth; Bosmans, Hilde

    2017-03-01

    Digital breast tomosynthesis (DBT) is a relatively new 3D mammography technique that promises better detection of low contrast masses than conventional 2D mammography. The parameter space for DBT is large however and finding an optimal balance between dose and image quality remains challenging. Given the large number of conditions and images required in optimization studies, the use of human observers (HO) is time consuming and certainly not feasible for the tuning of all degrees of freedom. Our goal was to develop a model observer (MO) that could predict human detectability for clinically relevant details embedded within a newly developed structured phantom for DBT applications. DBT series were acquired on GE SenoClaire 3D, Giotto Class, Fujifilm AMULET Innovality and Philips MicroDose systems at different dose levels, Siemens Inspiration DBT acquisitions were reconstructed with different algorithms, while a larger set of DBT series was acquired on Hologic Dimensions system for first reproducibility testing. A channelized Hotelling observer (CHO) with Gabor channels was developed The parameters of the Gabor channels were tuned on all systems at standard scanning conditions and the candidate that produced the best fit for all systems was chosen. After tuning, the MO was applied to all systems and conditions. Linear regression lines between MO and HO scores were calculated, giving correlation coefficients between 0.87 and 0.99 for all tested conditions.

  18. Real-space observation of magnetic excitations and avalanche behavior in artificial quasicrystal lattices

    SciTech Connect

    Brajuskovic, V.; Barrows, F.; Phatak, C.; Petford-Long, A. K.

    2016-10-03

    Artificial spin ice lattices have emerged as model systems for studying magnetic frustration in recent years. Most work to date has looked at periodic artificial spin ice lattices. In this paper, we observe frustration effects in quasicrystal artificial spin ice lattices that lack translational symmetry and contain vertices with different numbers of interacting elements. We find that as the lattice state changes following demagnetizing and annealing, specific vertex motifs retain low-energy configurations, which excites other motifs into higher energy configurations. In addition, we find that unlike the magnetization reversal process for periodic artificial spin ice lattices, which occurs through 1D avalanches, quasicrystal lattices undergo reversal through a dendritic 2D avalanche mechanism.

  19. Real-space observation of magnetic excitations and avalanche behavior in artificial quasicrystal lattices

    DOE PAGES

    Brajuskovic, V.; Barrows, F.; Phatak, C.; ...

    2016-10-03

    Artificial spin ice lattices have emerged as model systems for studying magnetic frustration in recent years. Most work to date has looked at periodic artificial spin ice lattices. In this paper, we observe frustration effects in quasicrystal artificial spin ice lattices that lack translational symmetry and contain vertices with different numbers of interacting elements. We find that as the lattice state changes following demagnetizing and annealing, specific vertex motifs retain low-energy configurations, which excites other motifs into higher energy configurations. In addition, we find that unlike the magnetization reversal process for periodic artificial spin ice lattices, which occurs through 1Dmore » avalanches, quasicrystal lattices undergo reversal through a dendritic 2D avalanche mechanism.« less

  20. Real-space observation of magnetic excitations and avalanche behavior in artificial quasicrystal lattices

    NASA Astrophysics Data System (ADS)

    Brajuskovic, V.; Barrows, F.; Phatak, C.; Petford-Long, A. K.

    2016-10-01

    Artificial spin ice lattices have emerged as model systems for studying magnetic frustration in recent years. Most work to date has looked at periodic artificial spin ice lattices. In this paper, we observe frustration effects in quasicrystal artificial spin ice lattices that lack translational symmetry and contain vertices with different numbers of interacting elements. We find that as the lattice state changes following demagnetizing and annealing, specific vertex motifs retain low-energy configurations, which excites other motifs into higher energy configurations. Additionally, we find that unlike the magnetization reversal process for periodic artificial spin ice lattices, which occurs through 1D avalanches, quasicrystal lattices undergo reversal through a dendritic 2D avalanche mechanism.

  1. Real-space observation of magnetic excitations and avalanche behavior in artificial quasicrystal lattices.

    PubMed

    Brajuskovic, V; Barrows, F; Phatak, C; Petford-Long, A K

    2016-10-03

    Artificial spin ice lattices have emerged as model systems for studying magnetic frustration in recent years. Most work to date has looked at periodic artificial spin ice lattices. In this paper, we observe frustration effects in quasicrystal artificial spin ice lattices that lack translational symmetry and contain vertices with different numbers of interacting elements. We find that as the lattice state changes following demagnetizing and annealing, specific vertex motifs retain low-energy configurations, which excites other motifs into higher energy configurations. Additionally, we find that unlike the magnetization reversal process for periodic artificial spin ice lattices, which occurs through 1D avalanches, quasicrystal lattices undergo reversal through a dendritic 2D avalanche mechanism.

  2. Real-space observation of magnetic excitations and avalanche behavior in artificial quasicrystal lattices

    PubMed Central

    Brajuskovic, V.; Barrows, F.; Phatak, C.; Petford-Long, A. K.

    2016-01-01

    Artificial spin ice lattices have emerged as model systems for studying magnetic frustration in recent years. Most work to date has looked at periodic artificial spin ice lattices. In this paper, we observe frustration effects in quasicrystal artificial spin ice lattices that lack translational symmetry and contain vertices with different numbers of interacting elements. We find that as the lattice state changes following demagnetizing and annealing, specific vertex motifs retain low-energy configurations, which excites other motifs into higher energy configurations. Additionally, we find that unlike the magnetization reversal process for periodic artificial spin ice lattices, which occurs through 1D avalanches, quasicrystal lattices undergo reversal through a dendritic 2D avalanche mechanism. PMID:27694973

  3. Real-space observation of metal-insulator transition at complex oxide heterointerface with cross-sectional STM

    NASA Astrophysics Data System (ADS)

    Chiu, Ya-Ping; Lin, Jheng-Cyuan; Thanh, Tra-Vu; Lin, Tai-Te; Huang, Po-Cheng; Huang, Bo-Chao; Lin, Jiunn-Yuan; Chu, Ying-Hao

    We report the direct observation of tunable electronic property through visible light at LaAlO3 / SrTiO3 (LAO/STO) complex oxide heterointerface using cross-sectional scanning tunneling microscopy and spectroscopy (XSTM/S). Many researches have shown that for the interface to be conducting, the thickness of LAO should be equal to or greater than the critical value 4 unit cells (u.c.). With LAO surface modification by Au clusters, interfacial two-dimensional electron gas presents a giant optical switching effect under visible light illuminated. In this study, through the interaction between photons and electrons system, a direct observation of the evolution of electronic structures from insulating to conducting has been revealed in the LAO (3u.c.)/STO model using the technique of cross-sectional scanning tunneling microscopy and spectroscopy. Results clearly reveal the changes in the built-in electric field in LAO and the band bending in the STO adjacent to the interface after light illumination. National Sun Yat-sen University, Taiwan; Academia Sinica, Taiwan.

  4. Real-Space Observation of Nonvolatile Zero-Field Biskyrmion Lattice Generation in MnNiGa Magnet.

    PubMed

    Peng, Licong; Zhang, Ying; Wang, Wenhong; He, Min; Li, Lailai; Ding, Bei; Li, Jianqi; Sun, Young; Zhang, X-G; Cai, Jianwang; Wang, Shouguo; Wu, Guangheng; Shen, Baogen

    2017-10-09

    Magnetic skyrmions, particular those without the support of external magnetic fields over a wide temperature region, are promising as alternative spintronic units to overcome the fundamental size limitation of conventional magnetic bits. In this study, we use in situ Lorentz microscope to directly demonstrate the generation and sustainability of robust biskyrmion lattice at zero magnetic field over a wide temperature range of 16-338 K in MnNiGa alloy. This procedure includes a simple field-cooling manipulation from 360 K (higher than Curie temperature TC ∼ 350 K), where topological transition easily occurs by adapting the short-range magnetic clusters under a certain magnetic field. The biskyrmion phase is favored upon cooling below TC. Once they are generated, the robust high-density biskyrmions persist even after removing the external magnetic field due to the topological protection and the increased energy barrier.

  5. Real-space observation of nanoscale magnetic phase separation in dysprosium by aberration-corrected Lorentz microscopy

    NASA Astrophysics Data System (ADS)

    Nagai, Takuro; Kimoto, Koji; Inoke, Koji; Takeguchi, Masaki

    2017-09-01

    Magnetic phase separation in single-crystal dysprosium at 97-187 K was investigated using aberration-corrected Lorentz microscopy. The high-resolution Lorentz microscopy combined with the transport-of-intensity equation method successfully visualized the in-plane magnetization distribution of the coexisting magnetic phases. The onset of a phase transition from the ferromagnetic (FM) phase to helical antiferromagnetic (HAFM) phase was observed at ˜100 K , and the two nanoscale phases coexisted up to ˜140 K . The volume fraction of the FM phase decreased with increasing temperature, eventually resulting in the formation of static magnetic solitons, which are isolated single domains of the FM phase, at around 130 K. We also performed the in situ observation of the HAFM phase at 142 K by applying an external magnetic field normal to the helical axis. With increasing field, a distorted HAFM phase emerged and the nanoscale phase separation between the HAFM phase and the fan phase subsequently occurred from ˜6 to ˜11 kOe . It was proven that the boundaries between these nanoscale coexisting phases were perpendicular to the z axis, which is the rotation axis common to the modulated magnetic structures.

  6. Real Space Observation of Inelastic Kondo Effect and Interorbital Spin-Coupling in Molecule-Metal Contacts

    NASA Astrophysics Data System (ADS)

    Mugarza, Aitor; Krull, Cornelius; Robles, Roberto; Lorente, Nicolas; Korytar, Richard; Stepanow, Sebastian; Ceballos, Gustavo; Gambardella, Pietro

    2012-02-01

    We present a comparative scanning tunneling spectroscopy study of four different types of MPc complexes (M = Fe, Co, Ni, Cu) adsorbed on the Ag(100) surface. Their magnetic properties are studied via the Kondo interaction with the substrate. Whereas the spectra of FePc and CoPc near the Fermi level is featureless, CuPc and NiPc show a Kondo resonance arising from the interaction of a ligand spin with conduction electrons. The spin at the organic macrocycle is induced by charge transfer from the Ag substrate. In CuPc, the coexistence of ion and ligand spin gives rise to interorbital coupling and spin excitations. The latter are observed via inelastic tunneling, where the Kondo interaction appears coupled to spin and vibrational excitations. By using the tip as a mobile electron we find that each type of excitation occupy mutually exclusive regions within the molecule, and result in different spin relaxation dynamics, reflecting the need of an atomic control of the molecule-metal interface to obtain reproducible transport properties. Finally, we study the influence of intermolecular interactions on the electronic and magnetic properties by creating artificial clusters in a controlled manner by manipulation of individual molecules.

  7. Real-space finite-difference approach for multi-body systems: path-integral renormalization group method and direct energy minimization method.

    PubMed

    Sasaki, Akira; Kojo, Masashi; Hirose, Kikuji; Goto, Hidekazu

    2011-11-02

    The path-integral renormalization group and direct energy minimization method of practical first-principles electronic structure calculations for multi-body systems within the framework of the real-space finite-difference scheme are introduced. These two methods can handle higher dimensional systems with consideration of the correlation effect. Furthermore, they can be easily extended to the multicomponent quantum systems which contain more than two kinds of quantum particles. The key to the present methods is employing linear combinations of nonorthogonal Slater determinants (SDs) as multi-body wavefunctions. As one of the noticeable results, the same accuracy as the variational Monte Carlo method is achieved with a few SDs. This enables us to study the entire ground state consisting of electrons and nuclei without the need to use the Born-Oppenheimer approximation. Recent activities on methodological developments aiming towards practical calculations such as the implementation of auxiliary field for Coulombic interaction, the treatment of the kinetic operator in imaginary-time evolutions, the time-saving double-grid technique for bare-Coulomb atomic potentials and the optimization scheme for minimizing the total-energy functional are also introduced. As test examples, the total energy of the hydrogen molecule, the atomic configuration of the methylene and the electronic structures of two-dimensional quantum dots are calculated, and the accuracy, availability and possibility of the present methods are demonstrated.

  8. Supramolecular clusters and chains of 2,6-dimethylpyridine on Cu(110): Observation of dynamic configuration change with real-space surface science techniques and DFT calculations

    NASA Astrophysics Data System (ADS)

    Lee, Junseok; C. Sorescu, Dan; Lee, Jae-Gook; Dougherty, Dan

    2016-10-01

    The adsorption of 2,6-dimethylpyridine (2,6-DMP) on Cu(110) has been studied using low temperature scanning tunneling microscopy (LT-STM), time-of-flight electron stimulated desorption ion angular distribution (TOF-ESDIAD), and density functional theory (DFT) calculations. At low temperatures (T < 150 K), the 2,6-DMP adsorbs in a flat configuration on Cu(110) producing clusters and extended domains via weak hydrogen bonding (C-H···N) with the molecular symmetry axis aligned along the < 001 > surface direction. At near-saturation coverage, a c(6 × 2) long-range ordered structure was observed. Upon annealing to T = 200 K, the 2,6-DMP molecules adopt an upright configuration with their pyridine ring plane oriented parallel to the < 1 1 ̅ 0 > azimuth. These upright 2,6-DMP molecules produce extended molecular chains where the repulsive interactions between the molecular chains give rise to coverage-dependent interchain distances.

  9. Supramolecular clusters and chains of 2,6-dimethylpyridine on Cu(110): Observation of dynamic configuration change with real-space surface science techniques and DFT calculations

    SciTech Connect

    Lee, Junseok; Sorescu, Dan C.; Lee, Jae -Gook; Dougherty, Dan

    2016-02-02

    Here, the adsorption of 2,6-dimethylpyridine (2,6-DMP) on Cu(110) has been studied using low temperature scanning tunneling microscopy (LT-STM), time-of-flight electron stimulated desorption ion angular distribution (TOF-ESDIAD), and density functional theory (DFT) calculations. At low temperatures (T < ~ 150 K), the 2,6-DMP adsorbs in a flat configuration on Cu(110) producing clusters and extended domains via weak hydrogen bonding (C—H···N) with the molecular symmetry axis aligned along the < 001 > surface direction.

  10. Direct observation detonator operation

    NASA Astrophysics Data System (ADS)

    Hall, Charles R.

    2001-11-01

    The analysis of detonator-timing performance has involved the use of rotating-mirror cameras (RMC) used in the streak mode and high-speed film. Fiducial timing marks are applied to the film to provide temporal references. The use of a RMC for detonator analysis requires aligning the camera, performing an exposure test, capturing light from the detonation and then processing the film. This procedure can take up to an hour for two technicians. After the film is possessed another technician compares each light streak on the film with the fiducial timing marks also recorded on the film. Capturing light from a detonator and recording it directly to a digitizer can improve detonator-timing measurement in several ways. The digitized signals can then be directly analyzed with software. The direct recording method reduces the need for expensive rotating mirror cameras, film processing and subjective optical measurement comparison. Furthermore, an extensive support facility requiring several specialized technicians is reduced to a single technician in a modest laboratory. This technician is then capable of performing several tests an hour. Tests were preformed to measure light intensity at detonation. An optical method of capturing the light was designed using a remote microscope coupled to optical fiber to bring the light to an optical/electrical converter and a digitizer then records the signal. This system is presently used in parallel with a RMC. The results are compared for accuracy.

  11. Real-space renormalization yields finite correlations.

    PubMed

    Barthel, Thomas; Kliesch, Martin; Eisert, Jens

    2010-07-02

    Real-space renormalization approaches for quantum lattice systems generate certain hierarchical classes of states that are subsumed by the multiscale entanglement renormalization Ansatz (MERA). It is shown that, with the exception of one spatial dimension, MERA states are actually states with finite correlations, i.e., projected entangled pair states (PEPS) with a bond dimension independent of the system size. Hence, real-space renormalization generates states which can be encoded with local effective degrees of freedom, and MERA states form an efficiently contractible class of PEPS that obey the area law for the entanglement entropy. It is further pointed out that there exist other efficiently contractible schemes violating the area law.

  12. Real-space Berry phases: Skyrmion soccer (invited)

    NASA Astrophysics Data System (ADS)

    Everschor-Sitte, Karin; Sitte, Matthias

    2014-05-01

    Berry phases occur when a system adiabatically evolves along a closed curve in parameter space. This tutorial-like article focuses on Berry phases accumulated in real space. In particular, we consider the situation where an electron traverses a smooth magnetic structure, while its magnetic moment adjusts to the local magnetization direction. Mapping the adiabatic physics to an effective problem in terms of emergent fields reveals that certain magnetic textures, skyrmions, are tailormade to study these Berry phase effects.

  13. Real-space Berry phases: Skyrmion soccer (invited)

    SciTech Connect

    Everschor-Sitte, Karin Sitte, Matthias

    2014-05-07

    Berry phases occur when a system adiabatically evolves along a closed curve in parameter space. This tutorial-like article focuses on Berry phases accumulated in real space. In particular, we consider the situation where an electron traverses a smooth magnetic structure, while its magnetic moment adjusts to the local magnetization direction. Mapping the adiabatic physics to an effective problem in terms of emergent fields reveals that certain magnetic textures, skyrmions, are tailormade to study these Berry phase effects.

  14. Car-Parrinello simulations with a real space method.

    PubMed

    Schmid, Rochus

    2004-04-30

    An approach for Car-Parrinello type molecular dynamics simulations using real space discretized wave functions is presented. The implementation uses a higher order finite difference approximation for the Laplacian in the kinetic energy operator and in the Poisson equation for the evaluation of the Hartree energy. Norm conserving pseudopotentials are employed to replace the nucleus-core interactions. Both nuclei and wave functions are propagated with a second-order Verlet propagator with a timestep comparable to standard plane wave implementations. The orthonormality constraints are fulfilled via Lagrange multipliers. Both periodic and nonperiodic boundary conditions can directly be imposed within the real space approach. In order to maintain energy conservation both forces on the nuclei and the wave functions must be sufficiently accurate. It is shown that the spurious energy dependence on the nuclear positions with respect to the grid points, which is an inevitable artifact of the discretization, is mirrored in the nuclear forces, and does not affect energy conservation. In contrast to the plane wave methodology, the Hartree energy is calculated via an iterative solution of the Poisson equation. As a result, the quality of the forces on the wave function crucially depends on its convergence, as well as on the accuracy of the approximation for the boundary values in nonperiodic calculations. The influence of these factors on the energy conservation is investigated. It is shown that Car-Parrinello simulations can be performed with real space wave functions, given a proper prescription to calculate the Hartree potential is used.

  15. A Real Space Cellular Automaton Laboratory

    NASA Astrophysics Data System (ADS)

    Rozier, O.; Narteau, C.

    2013-12-01

    Investigations in geomorphology may benefit from computer modelling approaches that rely entirely on self-organization principles. In the vast majority of numerical models, instead, points in space are characterised by a variety of physical variables (e.g. sediment transport rate, velocity, temperature) recalculated over time according to some predetermined set of laws. However, there is not always a satisfactory theoretical framework from which we can quantify the overall dynamics of the system. For these reasons, we prefer to concentrate on interaction patterns using a basic cellular automaton modelling framework, the Real Space Cellular Automaton Laboratory (ReSCAL), a powerful and versatile generator of 3D stochastic models. The objective of this software suite released under a GNU license is to develop interdisciplinary research collaboration to investigate the dynamics of complex systems. The models in ReSCAL are essentially constructed from a small number of discrete states distributed on a cellular grid. An elementary cell is a real-space representation of the physical environment and pairs of nearest neighbour cells are called doublets. Each individual physical process is associated with a set of doublet transitions and characteristic transition rates. Using a modular approach, we can simulate and combine a wide range of physical, chemical and/or anthropological processes. Here, we present different ingredients of ReSCAL leading to applications in geomorphology: dune morphodynamics and landscape evolution. We also discuss how ReSCAL can be applied and developed across many disciplines in natural and human sciences.

  16. Relativistic real-space multiple scattering calculations of EELS

    NASA Astrophysics Data System (ADS)

    Jorissen, K.; Rehr, J. J.; Sorini, A.; Levine, Z. H.

    2006-03-01

    We present an extension of the real space multiple scattering code FEFF8 for ab initio, relativistic calculations of electron energy loss spectra (EELS), which is applicable both to periodic and non-periodic systems. The approach explains the observed relativistic shifts in the magic angle. In addition, the method can account for experimental parameters such as collection and convergence angles of the microscope and sample orientation. We also discuss relativistic effects on inelastic electron scattering including the density correction to the stopping power. Our results are compared with other approaches and with experiment. B. Jouffrey, P. Schattschneider and C. Hebert, Ultramicroscopy 102, 61 (2004).

  17. Real-space renormalized dynamical mean field theory

    NASA Astrophysics Data System (ADS)

    Kubota, Dai; Sakai, Shiro; Imada, Masatoshi

    2016-05-01

    We propose real-space renormalized dynamical mean field theory (rr-DMFT) to deal with large clusters in the framework of a cluster extension of the DMFT. In the rr-DMFT, large clusters are decomposed into multiple smaller clusters through a real-space renormalization. In this work, the renormalization effect is taken into account only at the lowest order with respect to the intercluster coupling, which nonetheless reproduces exactly both the noninteracting and atomic limits. Our method allows us large cluster-size calculations which are intractable with the conventional cluster extensions of the DMFT with impurity solvers, such as the continuous-time quantum Monte Carlo and exact diagonalization methods. We benchmark the rr-DMFT for the two-dimensional Hubbard model on a square lattice at and away from half filling, where the spatial correlations play important roles. Our results on the spin structure factor indicate that the growth of the antiferromagnetic spin correlation is taken into account beyond the decomposed cluster size. We also show that the self-energy obtained from the large-cluster solver is reproduced by our method better than the solution obtained directly for the smaller cluster. When applied to the Mott metal-insulator transition, the rr-DMFT is able to reproduce the reduced critical value for the Coulomb interaction comparable to the large cluster result.

  18. Real-space renormalization in statistical mechanics

    NASA Astrophysics Data System (ADS)

    Efrati, Efi; Wang, Zhe; Kolan, Amy; Kadanoff, Leo P.

    2014-04-01

    This review compares the conceptualization and practice of early real-space renormalization group methods with the conceptualization of more recent real-space transformations based on tensor networks. For specificity, it focuses upon two basic methods: the "potential-moving" approach most used in the period 1975-1980 and the "rewiring method" as it has been developed in the last five years. The newer method, part of a development called the tensor renormalization group, was originally based on principles of quantum entanglement. It is specialized for computing approximations for tensor products constituting, for example, the free energy or the ground state energy of a large system. It can attack a wide variety of problems, including quantum problems, which would otherwise be intractable. The older method is formulated in terms of spin variables and permits a straightforward construction and analysis of fixed points in rather transparent terms. However, in the form described here it is unsystematic, offers no path for improvement, and of unknown reliability. The new method is formulated in terms of index variables which may be considered as linear combinations of the statistical variables. Free energies emerge naturally, but fixed points are more subtle. Further, physical interpretations of the index variables are often elusive due to a gauge symmetry which allows only selected combinations of tensor entries to have physical significance. In applications, both methods employ analyses with varying degrees of complexity. The complexity is parametrized by an integer called χ (or D in the recent literature). Both methods are examined in action by using them to compute fixed points related to Ising models for small values of the complexity parameter. They behave quite differently. The old method gives a reasonably good picture of the fixed point, as measured, for example, by the accuracy of the measured critical indices. This happens at low values of χ, but there is no

  19. Real-space collapse of a polariton condensate

    NASA Astrophysics Data System (ADS)

    Dominici, L.; Petrov, M.; Matuszewski, M.; Ballarini, D.; de Giorgi, M.; Colas, D.; Cancellieri, E.; Silva Fernández, B.; Bramati, A.; Gigli, G.; Kavokin, A.; Laussy, F.; Sanvitto, D.

    2015-12-01

    Microcavity polaritons are two-dimensional bosonic fluids with strong nonlinearities, composed of coupled photonic and electronic excitations. In their condensed form, they display quantum hydrodynamic features similar to atomic Bose-Einstein condensates, such as long-range coherence, superfluidity and quantized vorticity. Here we report the unique phenomenology that is observed when a pulse of light impacts the polariton vacuum: the fluid which is suddenly created does not splash but instead coheres into a very bright spot. The real-space collapse into a sharp peak is at odd with the repulsive interactions of polaritons and their positive mass, suggesting that an unconventional mechanism is at play. Our modelling devises a possible explanation in the self-trapping due to a local heating of the crystal lattice, that can be described as a collective polaron formed by a polariton condensate. These observations hint at the polariton fluid dynamics in conditions of extreme intensities and ultrafast times.

  20. Real-space collapse of a polariton condensate

    PubMed Central

    Dominici, L.; Petrov, M.; Matuszewski, M.; Ballarini, D.; De Giorgi, M.; Colas, D.; Cancellieri, E.; Silva Fernández, B.; Bramati, A.; Gigli, G.; Kavokin, A.; Laussy, F.; Sanvitto, D.

    2015-01-01

    Microcavity polaritons are two-dimensional bosonic fluids with strong nonlinearities, composed of coupled photonic and electronic excitations. In their condensed form, they display quantum hydrodynamic features similar to atomic Bose–Einstein condensates, such as long-range coherence, superfluidity and quantized vorticity. Here we report the unique phenomenology that is observed when a pulse of light impacts the polariton vacuum: the fluid which is suddenly created does not splash but instead coheres into a very bright spot. The real-space collapse into a sharp peak is at odd with the repulsive interactions of polaritons and their positive mass, suggesting that an unconventional mechanism is at play. Our modelling devises a possible explanation in the self-trapping due to a local heating of the crystal lattice, that can be described as a collective polaron formed by a polariton condensate. These observations hint at the polariton fluid dynamics in conditions of extreme intensities and ultrafast times. PMID:26634817

  1. A brief comparison between grid based real space algorithms andspectrum algorithms for electronic structure calculations

    SciTech Connect

    Wang, Lin-Wang

    2006-12-01

    Quantum mechanical ab initio calculation constitutes the biggest portion of the computer time in material science and chemical science simulations. As a computer center like NERSC, to better serve these communities, it will be very useful to have a prediction for the future trends of ab initio calculations in these areas. Such prediction can help us to decide what future computer architecture can be most useful for these communities, and what should be emphasized on in future supercomputer procurement. As the size of the computer and the size of the simulated physical systems increase, there is a renewed interest in using the real space grid method in electronic structure calculations. This is fueled by two factors. First, it is generally assumed that the real space grid method is more suitable for parallel computation for its limited communication requirement, compared with spectrum method where a global FFT is required. Second, as the size N of the calculated system increases together with the computer power, O(N) scaling approaches become more favorable than the traditional direct O(N{sup 3}) scaling methods. These O(N) methods are usually based on localized orbital in real space, which can be described more naturally by the real space basis. In this report, the author compares the real space methods versus the traditional plane wave (PW) spectrum methods, for their technical pros and cons, and the possible of future trends. For the real space method, the author focuses on the regular grid finite different (FD) method and the finite element (FE) method. These are the methods used mostly in material science simulation. As for chemical science, the predominant methods are still Gaussian basis method, and sometime the atomic orbital basis method. These two basis sets are localized in real space, and there is no indication that their roles in quantum chemical simulation will change anytime soon. The author focuses on the density functional theory (DFT), which is the

  2. RESCU: A real space electronic structure method

    NASA Astrophysics Data System (ADS)

    Michaud-Rioux, Vincent; Zhang, Lei; Guo, Hong

    2016-02-01

    In this work we present RESCU, a powerful MATLAB-based Kohn-Sham density functional theory (KS-DFT) solver. We demonstrate that RESCU can compute the electronic structure properties of systems comprising many thousands of atoms using modest computer resources, e.g. 16 to 256 cores. Its computational efficiency is achieved from exploiting four routes. First, we use numerical atomic orbital (NAO) techniques to efficiently generate a good quality initial subspace which is crucially required by Chebyshev filtering methods. Second, we exploit the fact that only a subspace spanning the occupied Kohn-Sham states is required, and solving accurately the KS equation using eigensolvers can generally be avoided. Third, by judiciously analyzing and optimizing various parts of the procedure in RESCU, we delay the O (N3) scaling to large N, and our tests show that RESCU scales consistently as O (N2.3) from a few hundred atoms to more than 5000 atoms when using a real space grid discretization. The scaling is better or comparable in a NAO basis up to the 14,000 atoms level. Fourth, we exploit various numerical algorithms and, in particular, we introduce a partial Rayleigh-Ritz algorithm to achieve efficiency gains for systems comprising more than 10,000 electrons. We demonstrate the power of RESCU in solving KS-DFT problems using many examples running on 16, 64 and/or 256 cores: a 5832 Si atoms supercell; a 8788 Al atoms supercell; a 5324 Cu atoms supercell and a small DNA molecule submerged in 1713 water molecules for a total 5399 atoms. The KS-DFT is entirely converged in a few hours in all cases. Our results suggest that the RESCU method has reached a milestone of solving thousands of atoms by KS-DFT on a modest computer cluster.

  3. Direct observation of vinyl hydroperoxide.

    PubMed

    Liu, Fang; Fang, Yi; Kumar, Manoj; Thompson, Ward H; Lester, Marsha I

    2015-08-28

    Many alkyl-substituted Criegee intermediates are predicted to undergo an intramolecular 1,4-hydrogen transfer to form isomeric vinyl hydroperoxide species (C[double bond, length as m-dash]COOH moiety), which break apart to release OH and vinoxy radicals. We report direct detection of stabilized vinyl hydroperoxides formed via carboxylic acid-catalyzed tautomerization of Criegee intermediates. A doubly hydrogen-bonded interaction between the Criegee intermediate and carboxylic acid facilitates efficient hydrogen transfer through a double hydrogen shift. Deuteration of formic or acetic acid permits migration of a D atom to yield partially deuterated vinyl hydroperoxides, which are distinguished from the CH3CHOO, (CH3)2COO, and CH3CH2CHOO Criegee intermediates by mass. Using 10.5 eV photoionization, three prototypical vinyl hydroperoxides, CH2[double bond, length as m-dash]CHOOD, CH2[double bond, length as m-dash]C(CH3)OOD, and CH3CH[double bond, length as m-dash]CHOOD, are detected directly. Complementary electronic structure calculations reveal several reaction pathways, including the barrierless acid-catalyzed tautomerization reaction predicted previously and a barrierless addition reaction that yields hydroperoxy alkyl formate.

  4. Chiral anomaly in real space from stable fractional charges at the edge of a quantum spin Hall insulator

    NASA Astrophysics Data System (ADS)

    Fleckenstein, C.; Traverso Ziani, N.; Trauzettel, B.

    2016-12-01

    The chiral anomaly is based on a nonconserved chiral charge and can happen in Dirac fermion systems under the influence of external electromagnetic fields. In this case, the spectral flow leads to a transfer of right- to left-moving excitations or vice versa. The corresponding transfer of chiral particles happens in momentum space. Here we describe an intriguing way to introduce the chiral anomaly into real space. Our system consists of two quantum dots that are formed at the helical edges of a quantum spin Hall insulator by means of magnetic barriers. Such a setup gives rise to fractional charges which we show to be sharp quantum numbers for large barrier strengths. Interestingly, it is possible to map the system onto a quantum spin Hall ring in the presence of a flux pierced through the ring, where the relative angle between the magnetization directions takes the role of the flux. The chiral anomaly in this system is then directly related to the excess occupation of particles in the two quantum dots. This analogy allows us to predict an observable consequence of the chiral anomaly in real space, which is connected to the presence of fractional charges in the very same system.

  5. Cosmological ensemble and directional averages of observables

    SciTech Connect

    Bonvin, Camille; Clarkson, Chris; Durrer, Ruth; Maartens, Roy; Umeh, Obinna E-mail: chris.clarkson@gmail.com E-mail: roy.maartens@gmail.com

    2015-07-01

    We show that at second order, ensemble averages of observables and directional averages do not commute due to gravitational lensing—observing the same thing in many directions over the sky is not the same as taking an ensemble average. In principle this non-commutativity is significant for a variety of quantities that we often use as observables and can lead to a bias in parameter estimation. We derive the relation between the ensemble average and the directional average of an observable, at second order in perturbation theory. We discuss the relevance of these two types of averages for making predictions of cosmological observables, focusing on observables related to distances and magnitudes. In particular, we show that the ensemble average of the distance in a given observed direction is increased by gravitational lensing, whereas the directional average of the distance is decreased. For a generic observable, there exists a particular function of the observable that is not affected by second-order lensing perturbations. We also show that standard areas have an advantage over standard rulers, and we discuss the subtleties involved in averaging in the case of supernova observations.

  6. Toward a Direct Realist Account of Observation.

    ERIC Educational Resources Information Center

    Sievers, K. H.

    1999-01-01

    Criticizes the account of observation given by Alan Chalmers in "What Is This Thing Called Science?" and provides an alternative based on direct realist approaches to perception. Contains 15 references. (Author/WRM)

  7. Toward a Direct Realist Account of Observation.

    ERIC Educational Resources Information Center

    Sievers, K. H.

    1999-01-01

    Criticizes the account of observation given by Alan Chalmers in "What Is This Thing Called Science?" and provides an alternative based on direct realist approaches to perception. Contains 15 references. (Author/WRM)

  8. Direct observation and imaging of a spin-wave soliton with p-like symmetry

    DOE PAGES

    Bonetti, S.; Kukreja, R.; Chen, Z.; ...

    2015-11-16

    Spin waves, the collective excitations of spins, can emerge as nonlinear solitons at the nanoscale when excited by an electrical current from a nanocontact. These solitons are expected to have essentially cylindrical symmetry (that is, s-like), but no direct experimental observation exists to confirm this picture. Using a high-sensitivity time-resolved magnetic X-ray microscopy with 50 ps temporal resolution and 35 nm spatial resolution, we are able to create a real-space spin-wave movie and observe the emergence of a localized soliton with a nodal line, that is, with p-like symmetry. Moreover, micromagnetic simulations explain the measurements and reveal that the symmetrymore » of the soliton can be controlled by magnetic fields. Our results broaden the understanding of spin-wave dynamics at the nanoscale, with implications for the design of magnetic nanodevices.« less

  9. Direct observation and imaging of a spin-wave soliton with p-like symmetry

    SciTech Connect

    Bonetti, S.; Kukreja, R.; Chen, Z.; Macià, F.; Hernàndez, J. M.; Eklund, A.; Backes, D.; Frisch, J.; Katine, J.; Malm, G.; Urazhdin, S.; Kent, A. D.; Stöhr, J.; Ohldag, H.; Dürr, H. A.

    2015-11-16

    Spin waves, the collective excitations of spins, can emerge as nonlinear solitons at the nanoscale when excited by an electrical current from a nanocontact. These solitons are expected to have essentially cylindrical symmetry (that is, s-like), but no direct experimental observation exists to confirm this picture. Using a high-sensitivity time-resolved magnetic X-ray microscopy with 50 ps temporal resolution and 35 nm spatial resolution, we are able to create a real-space spin-wave movie and observe the emergence of a localized soliton with a nodal line, that is, with p-like symmetry. Moreover, micromagnetic simulations explain the measurements and reveal that the symmetry of the soliton can be controlled by magnetic fields. Our results broaden the understanding of spin-wave dynamics at the nanoscale, with implications for the design of magnetic nanodevices.

  10. Direct observation and imaging of a spin-wave soliton with p-like symmetry

    PubMed Central

    Bonetti, S.; Kukreja, R.; Chen, Z.; Macià, F.; Hernàndez, J. M.; Eklund, A.; Backes, D.; Frisch, J.; Katine, J.; Malm, G.; Urazhdin, S.; Kent, A. D.; Stöhr, J.; Ohldag, H.; Dürr, H. A.

    2015-01-01

    Spin waves, the collective excitations of spins, can emerge as nonlinear solitons at the nanoscale when excited by an electrical current from a nanocontact. These solitons are expected to have essentially cylindrical symmetry (that is, s-like), but no direct experimental observation exists to confirm this picture. Using a high-sensitivity time-resolved magnetic X-ray microscopy with 50 ps temporal resolution and 35 nm spatial resolution, we are able to create a real-space spin-wave movie and observe the emergence of a localized soliton with a nodal line, that is, with p-like symmetry. Micromagnetic simulations explain the measurements and reveal that the symmetry of the soliton can be controlled by magnetic fields. Our results broaden the understanding of spin-wave dynamics at the nanoscale, with implications for the design of magnetic nanodevices. PMID:26567699

  11. Direct observation and imaging of a spin-wave soliton with p-like symmetry.

    PubMed

    Bonetti, S; Kukreja, R; Chen, Z; Macià, F; Hernàndez, J M; Eklund, A; Backes, D; Frisch, J; Katine, J; Malm, G; Urazhdin, S; Kent, A D; Stöhr, J; Ohldag, H; Dürr, H A

    2015-11-16

    Spin waves, the collective excitations of spins, can emerge as nonlinear solitons at the nanoscale when excited by an electrical current from a nanocontact. These solitons are expected to have essentially cylindrical symmetry (that is, s-like), but no direct experimental observation exists to confirm this picture. Using a high-sensitivity time-resolved magnetic X-ray microscopy with 50 ps temporal resolution and 35 nm spatial resolution, we are able to create a real-space spin-wave movie and observe the emergence of a localized soliton with a nodal line, that is, with p-like symmetry. Micromagnetic simulations explain the measurements and reveal that the symmetry of the soliton can be controlled by magnetic fields. Our results broaden the understanding of spin-wave dynamics at the nanoscale, with implications for the design of magnetic nanodevices.

  12. Devitrification of colloidal glasses in real space.

    PubMed

    Simeonova, Nikoleta B; Dullens, Roel P A; Aarts, Dirk G A L; de Villeneuve, Volkert W A; Lekkerkerker, Henk N W; Kegel, Willem K

    2006-04-01

    Confocal scanning laser microscopy has been used to quantitatively analyze the structure and dynamics of concentrated suspensions of spherical colloids in which the magnitude of the short-range attractive potential is increased by adding nonadsorbing polymers. These systems undergo a reentrant glass transition upon increasing polymer concentration. We find that melting of the glass is accompanied by significant changes in the displacement distribution and its moments. However, no significant variations have been detected in the shapes of the displacement distributions. Moreover, structural correlation functions and the magnitude of local density fluctuations do not vary significantly between the glass states and the fluid. Considering our experimental setup, these observations imply that local density fluctuations cannot be larger than a few percent of the average density.

  13. Quantum phase transition induced by real-space topology

    NASA Astrophysics Data System (ADS)

    Li, C.; Zhang, G.; Lin, S.; Song, Z.

    2016-12-01

    A quantum phase transition (QPT), including both topological and symmetry breaking types, is usually induced by the change of global parameters, such as external fields or global coupling constants. In this work, we demonstrate the existence of QPT induced by the real-space topology of the system. We investigate the groundstate properties of the tight-binding model on a honeycomb lattice with the torus geometry based on exact results. It is shown that the ground state experiences a second-order QPT, exhibiting the scaling behavior, when the torus switches to a tube, which reveals the connection between quantum phase and the real-space topology of the system.

  14. Attention retargeting in real space with projector camera system

    NASA Astrophysics Data System (ADS)

    Yamamoto, Katsumi; Takimoto, Hironori; Kanagawa, Akihiro

    2017-03-01

    Many attention retargeting methods based on the visual saliency model of bottom-up attention to guide a human's attention to a ROI have recently been proposed. However, conventional attention retargeting methods focus only on modulating an image or a movie presented to a display. In this paper, we propose the use of a projector-camera system to realize attention retargeting in real space. As a first step of our research, we focus on the realization of the appearance control method for attention retargeting to the plane of real space.

  15. Quantum phase transition induced by real-space topology

    PubMed Central

    Li, C.; Zhang, G.; Lin, S.; Song, Z.

    2016-01-01

    A quantum phase transition (QPT), including both topological and symmetry breaking types, is usually induced by the change of global parameters, such as external fields or global coupling constants. In this work, we demonstrate the existence of QPT induced by the real-space topology of the system. We investigate the groundstate properties of the tight-binding model on a honeycomb lattice with the torus geometry based on exact results. It is shown that the ground state experiences a second-order QPT, exhibiting the scaling behavior, when the torus switches to a tube, which reveals the connection between quantum phase and the real-space topology of the system. PMID:28004736

  16. Coupled-Cluster in Real Space II: CC2 Excited States using Multi-Resolution Analysis.

    PubMed

    Kottmann, Jakob Siegfried; Bischoff, Florian Andreas

    2017-09-13

    We report a first quantized approach to calculate approximate coupled-cluster singles and doubles CC2 excitation energies in real space. The cluster functions are directly represented on an adaptive grid using multiresolution analysis. Virtual orbitals are neither calculated nor needed which leads to an improved formal scaling. The nuclear and electronic cusps are taken into account explicitly where our ansatz regularizes the corresponding equations exactly. First calculations on small molecules are in excellent agreement with the best available LCAO approaches.

  17. Real-space imaging of atomic structure with white x rays.

    PubMed

    Korecki, P; Materlik, G

    2001-03-12

    The first real-space x-ray image of an atomic structure was obtained by illuminating a crystal with white synchrotron radiation. The internal photocurrent signal served as a probe of the x-ray interference field strength at the atomic sites and was accordingly measured as a function of illumination direction to record the two-dimensional image. This novel method of real-space imaging makes use of the fact that the interference field intensity is energy independent with respect to contributions from those scattering atoms which are brought via sample rotation into the forward scattering condition. In contrast, contributions from other atoms oscillate with energy and vanish for broadband illumination.

  18. Direct Observation of "Pac-Man" Coarsening.

    PubMed

    Yu, X X; Gulec, A; Yoon, A; Zuo, J M; Voorhees, P W; Marks, L D

    2017-08-09

    We report direct observation of a "Pac-Man" like coarsening mechanism of a self-supporting thin film of nickel oxide. The ultrathin film has an intrinsic morphological instability due to surface stress leading to the development of local thicker regions at step edges. Density functional theory calculations and continuum modeling of the elastic instability support the model for the process.

  19. EDITORIAL: From reciprocal space to real space in surface science From reciprocal space to real space in surface science

    NASA Astrophysics Data System (ADS)

    Bartels, Ludwig; Ernst, Karl-Heinz

    2012-09-01

    This issue is dedicated to Karl-Heinz Rieder on the occasion of his 70th birthday. It contains contributions written by his former students and colleagues from all over the world. Experimental techniques based on free electrons, such as photoelectron spectroscopy, electron microscopy and low energy electron diffraction (LEED), were foundational to surface science. While the first revealed the band structures of materials, the second provided nanometer scale imagery and the latter elucidated the atomic scale periodicity of surfaces. All required an (ultra-)high vacuum, and LEED illustrated impressively that adsorbates, such as carbon monoxide, hydrogen or oxygen, can markedly and periodically restructure surfaces from their bulk termination, even at pressures ten orders of magnitude or more below atmospheric. Yet these techniques were not generally able to reveal atomic scale surface defects, nor could they faithfully show adsorption of light atoms such as hydrogen. Although a complete atom, helium can also be regarded as a wave with a de Broglie wavelength that allows the study of surface atomic periodicities at a delicateness and sensitivity exceeding that of electrons-based techniques. In combination, these and other techniques generated insight into the periodicity of surfaces and their vibrational properties, yet were limited to simple and periodic surface setups. All that changed with the advent of scanning tunneling microscopy (STM) roughly 30 years ago, allowing real space access to surface defects and individual adsorbates. Applied at low temperatures, not only can STM establish a height profile of surfaces, but can also perform spectroscopy and serve as an actuator capable of rearranging individual species at atomic scale resolution. The direct and intuitive manner in which STM provided access as a spectator and as an actor to the atomic scale was foundational to today's surface science and to the development of the concepts of nanoscience in general. The

  20. Direct observation of time reversal violation

    SciTech Connect

    Bernabeu, J.

    2013-06-12

    A direct evidence for Time Reversal Violation (TRV) means an experiment that, considered by itself, clearly shows TRV independent of, and unconnected to, the results for CP Violation. No existing result before the recent BABAR experiment with entangled neutral B mesons had demonstrated TRV in this sense. There is a unique opportunity for a search of TRV with unstable particles thanks to the Einstein-Podolsky-Rosen (EPR) Entanglement between the two neutral mesons in B, and PHI, Factories. The two quantum effects of the first decay as a filtering measurement and the transfer of information to the still living partner allow performing a genuine TRV asymmetry with the exchange of 'in' and 'out' states. With four independent TRV asymmetries, BABAR observes a large deviation of T-invariance with a statistical significance of 14 standard deviations, far more than needed to declare the result as a discovery. This is the first direct observation of TRV in the time evolution of any system.

  1. Direct observation of time reversal violation

    NASA Astrophysics Data System (ADS)

    Bernabéu, J.

    2013-06-01

    A direct evidence for Time Reversal Violation (TRV) means an experiment that, considered by itself, clearly shows TRV independent of, and unconnected to, the results for CP Violation. No existing result before the recent BABAR experiment with entangled neutral B mesons had demonstrated TRV in this sense. There is a unique opportunity for a search of TRV with unstable particles thanks to the Einstein-Podolsky-Rosen (EPR) Entanglement between the two neutral mesons in B, and PHI, Factories. The two quantum effects of the first decay as a filtering measurement and the transfer of information to the still living partner allow performing a genuine TRV asymmetry with the exchange of "in" and "out" states. With four independent TRV asymmetries, BABAR observes a large deviation of T-invariance with a statistical significance of 14 standard deviations, far more than needed to declare the result as a discovery. This is the first direct observation of TRV in the time evolution of any system.

  2. A real-space stochastic density matrix approach for density functional electronic structure.

    PubMed

    Beck, Thomas L

    2015-12-21

    The recent development of real-space grid methods has led to more efficient, accurate, and adaptable approaches for large-scale electrostatics and density functional electronic structure modeling. With the incorporation of multiscale techniques, linear-scaling real-space solvers are possible for density functional problems if localized orbitals are used to represent the Kohn-Sham energy functional. These methods still suffer from high computational and storage overheads, however, due to extensive matrix operations related to the underlying wave function grid representation. In this paper, an alternative stochastic method is outlined that aims to solve directly for the one-electron density matrix in real space. In order to illustrate aspects of the method, model calculations are performed for simple one-dimensional problems that display some features of the more general problem, such as spatial nodes in the density matrix. This orbital-free approach may prove helpful considering a future involving increasingly parallel computing architectures. Its primary advantage is the near-locality of the random walks, allowing for simultaneous updates of the density matrix in different regions of space partitioned across the processors. In addition, it allows for testing and enforcement of the particle number and idempotency constraints through stabilization of a Feynman-Kac functional integral as opposed to the extensive matrix operations in traditional approaches.

  3. Atomically resolved real-space imaging of hot electron dynamics

    PubMed Central

    Lock, D.; Rusimova, K. R.; Pan, T. L.; Palmer, R. E.; Sloan, P. A.

    2015-01-01

    The dynamics of hot electrons are central to understanding the properties of many electronic devices. But their ultra-short lifetime, typically 100 fs or less, and correspondingly short transport length-scale in the nanometre range constrain real-space investigations. Here we report variable temperature and voltage measurements of the nonlocal manipulation of adsorbed molecules on the Si(111)-7 × 7 surface in the scanning tunnelling microscope. The range of the nonlocal effect increases with temperature and, at constant temperature, is invariant over a wide range of electron energies. The measurements probe, in real space, the underlying hot electron dynamics on the 10 nm scale and are well described by a two-dimensional diffusive model with a single decay channel, consistent with 2-photon photo-emission (2PPE) measurements of the real time dynamics. PMID:26387703

  4. Real-space method for highly parallelizable electronic transport calculations

    NASA Astrophysics Data System (ADS)

    Feldman, Baruch; Seideman, Tamar; Hod, Oded; Kronik, Leeor

    2014-07-01

    We present a real-space method for first-principles nanoscale electronic transport calculations. We use the nonequilibrium Green's function method with density functional theory and implement absorbing boundary conditions (ABCs, also known as complex absorbing potentials, or CAPs) to represent the effects of the semi-infinite leads. In real space, the Kohn-Sham Hamiltonian matrix is highly sparse. As a result, the transport problem parallelizes naturally and can scale favorably with system size, enabling the computation of conductance in relatively large molecular junction models. Our use of ABCs circumvents the demanding task of explicitly calculating the leads' self-energies from surface Green's functions, and is expected to be more accurate than the use of the jellium approximation. In addition, we take advantage of the sparsity in real space to solve efficiently for the Green's function over the entire energy range relevant to low-bias transport. We illustrate the advantages of our method with calculations on several challenging test systems and find good agreement with reference calculation results.

  5. Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems

    NASA Astrophysics Data System (ADS)

    Andrade, Xavier; Strubbe, David; De Giovannini, Umberto; Larsen, Ask Hjorth; Oliveira, Micael J. T.; Alberdi-Rodriguez, Joseba; Varas, Alejandro; Theophilou, Iris; Helbig, Nicole; Verstraete, Matthieu J.; Stella, Lorenzo; Nogueira, Fernando; Aspuru-Guzik, Alán; Castro, Alberto; Marques, Miguel A. L.; Rubio, Angel

    Real-space grids are a powerful alternative for the simulation of electronic systems. One of the main advantages of the approach is the flexibility and simplicity of working directly in real space where the different fields are discretized on a grid, combined with competitive numerical performance and great potential for parallelization. These properties constitute a great advantage at the time of implementing and testing new physical models. Based on our experience with the Octopus code, in this article we discuss how the real-space approach has allowed for the recent development of new ideas for the simulation of electronic systems. Among these applications are approaches to calculate response properties, modeling of photoemission, optimal control of quantum systems, simulation of plasmonic systems, and the exact solution of the Schr\\"odinger equation for low-dimensionality systems.

  6. Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems.

    PubMed

    Andrade, Xavier; Strubbe, David; De Giovannini, Umberto; Larsen, Ask Hjorth; Oliveira, Micael J T; Alberdi-Rodriguez, Joseba; Varas, Alejandro; Theophilou, Iris; Helbig, Nicole; Verstraete, Matthieu J; Stella, Lorenzo; Nogueira, Fernando; Aspuru-Guzik, Alán; Castro, Alberto; Marques, Miguel A L; Rubio, Angel

    2015-12-21

    Real-space grids are a powerful alternative for the simulation of electronic systems. One of the main advantages of the approach is the flexibility and simplicity of working directly in real space where the different fields are discretized on a grid, combined with competitive numerical performance and great potential for parallelization. These properties constitute a great advantage at the time of implementing and testing new physical models. Based on our experience with the Octopus code, in this article we discuss how the real-space approach has allowed for the recent development of new ideas for the simulation of electronic systems. Among these applications are approaches to calculate response properties, modeling of photoemission, optimal control of quantum systems, simulation of plasmonic systems, and the exact solution of the Schrödinger equation for low-dimensionality systems.

  7. Direct observation limits on antimatter gravitation

    SciTech Connect

    Fischler, Mark; Lykken, Joe; Roberts, Tom; /Fermilab

    2008-06-01

    The proposed Antihydrogen Gravity experiment at Fermilab (P981) will directly measure the gravitational attraction g between antihydrogen and the Earth, with an accuracy of 1% or better. The following key question has been asked by the PAC: Is a possible 1% difference between g and g already ruled out by other evidence? This memo presents the key points of existing evidence, to answer whether such a difference is ruled out (a) on the basis of direct observational evidence; and/or (b) on the basis of indirect evidence, combined with reasoning based on strongly held theoretical assumptions. The bottom line is that there are no direct observations or measurements of gravitational asymmetry which address the antimatter sector. There is evidence which by indirect reasoning can be taken to rule out such a difference, but the analysis needed to draw that conclusion rests on models and assumptions which are in question for other reasons and are thus worth testing. There is no compelling evidence or theoretical reason to rule out such a difference at the 1% level.

  8. Direct observation of laser guided corona discharges

    PubMed Central

    Wang, Tie-Jun; Wei, Yingxia; Liu, Yaoxiang; Chen, Na; Liu, Yonghong; Ju, Jingjing; Sun, Haiyi; Wang, Cheng; Lu, Haihe; Liu, Jiansheng; Chin, See Leang; Li, Ruxin; Xu, Zhizhan

    2015-01-01

    Laser based lightning control holds a promising way to solve the problem of the long standing disaster of lightning strikes. But it is a challenging project due to insufficient understanding of the interaction between laser plasma channel and high voltage electric filed. In this work, a direct observation of laser guided corona discharge is reported. Laser filament guided streamer and leader types of corona discharges were observed. An enhanced ionization took place in the leader (filament) through the interaction with the high voltage discharging field. The fluorescence lifetime of laser filament guided corona discharge was measured to be several microseconds, which is 3 orders of magnitude longer than the fluorescence lifetime of laser filaments. This work could be advantageous towards a better understanding of laser assisted leader development in the atmosphere. PMID:26679271

  9. Direct observation of laser guided corona discharges.

    PubMed

    Wang, Tie-Jun; Wei, Yingxia; Liu, Yaoxiang; Chen, Na; Liu, Yonghong; Ju, Jingjing; Sun, Haiyi; Wang, Cheng; Lu, Haihe; Liu, Jiansheng; Chin, See Leang; Li, Ruxin; Xu, Zhizhan

    2015-12-18

    Laser based lightning control holds a promising way to solve the problem of the long standing disaster of lightning strikes. But it is a challenging project due to insufficient understanding of the interaction between laser plasma channel and high voltage electric filed. In this work, a direct observation of laser guided corona discharge is reported. Laser filament guided streamer and leader types of corona discharges were observed. An enhanced ionization took place in the leader (filament) through the interaction with the high voltage discharging field. The fluorescence lifetime of laser filament guided corona discharge was measured to be several microseconds, which is 3 orders of magnitude longer than the fluorescence lifetime of laser filaments. This work could be advantageous towards a better understanding of laser assisted leader development in the atmosphere.

  10. Direct observation of reptation at polymer interfaces

    NASA Astrophysics Data System (ADS)

    Russell, T. P.; Deline, V. R.; Dozier, W. D.; Felcher, G. P.; Agrawal, G.; Wool, R. P.; Mays, J. W.

    1993-09-01

    ALTHOUGH the diffusion of polymer chains in the liquid state can be described over long distances by classical diffusion laws, chain entanglements make a description of the short-range behaviour more complex. In the standard 'reptation' model1,2 the polymer chains are considered to move in a curvilinear manner along their own contours, exhibiting snake-like motion through the entangled sea of surrounding molecules. This model successfully explains many observations3-13, yet no direct evidence for reptative motion has been reported. Here we describe the observation of reptation of molecules across the interface between two types of partially deuterated polystyrene polymers. The time evolution of the hyd-rogen and deuterium profiles, determined by dynamic secondary-ion mass spectrometry, can be explained only on the basis of a reptation model. Our results demonstrate that, despite being inevit-ably simplified, the description of polymer diffusion in terms of reptation is essentially correct.

  11. First direct observation of muon antineutrino disappearance

    DOE PAGES

    Adamson, P.

    2011-07-05

    This letter reports the first direct observation of muon antineutrino disappearance. The MINOS experiment has taken data with an accelerator beam optimized for ν¯μ production, accumulating an exposure of 1.71 x 1020 protons on target. In the Far Detector, 97 charged current ν¯μ events are observed. The no-oscillation hypothesis predicts 156 events and is excluded at 6.3σ. The best fit to oscillation yields |Δm¯2| = (3.36-0.40 +0.46(stat.) ± 0.06(syst.)) x 10-3 eV2, sin2(2 θ¯) = 0.86-0.12+0.11 (stat.) ± 0.01(syst.). The MINOS νμ and ν¯μ measurements are consistent at the 2.0% confidence level, assuming identical underlying oscillation parameters.

  12. Direct observation of type 1 fimbrial switching.

    PubMed

    Adiciptaningrum, Aileen M; Blomfield, Ian C; Tans, Sander J

    2009-05-01

    The defining feature of bacterial phase variation is a stochastic 'all-or-nothing' switching in gene expression. However, direct observations of these rare switching events have so far been lacking, obscuring possible correlations between switching events themselves, and between switching and other cellular events, such as division and DNA replication. We monitored the phase variation of type 1 fimbriae in individual Escherichia coli in real time and simultaneously tracked the chromosome replication process. We observed distinctive patterns of fim (fimbriae) expression in multiple genealogically related lineages. These patterns could be explained by a model that combines a single switching event with chromosomal fim replication, as well as the epigenetic inheritance of expressed fim protein and RNA, and their dilution by growth. Analysis of the moment of switching at sub-cell-cycle resolution revealed a correlation between fim switching and cell age, which challenges the traditional idea of phase variation as a random Poissonian phenomenon.

  13. Direct observation of the skyrmion Hall effect

    NASA Astrophysics Data System (ADS)

    Jiang, Wanjun; Zhang, Xichao; Yu, Guoqiang; Zhang, Wei; Wang, Xiao; Benjamin Jungfleisch, M.; Pearson, John E.; Cheng, Xuemei; Heinonen, Olle; Wang, Kang L.; Zhou, Yan; Hoffmann, Axel; Te Velthuis, Suzanne G. E.

    2017-02-01

    The well-known Hall effect describes the transverse deflection of charged particles (electrons/holes) as a result of the Lorentz force. Similarly, it is intriguing to examine if quasi-particles without an electric charge, but with a topological charge, show related transverse motion. Magnetic skyrmions with a well-defined spin texture with a unit topological charge serve as good candidates to test this hypothesis. In spite of the recent progress made on investigating magnetic skyrmions, direct observation of the skyrmion Hall effect has remained elusive. Here, by using a current-induced spin Hall spin torque, we experimentally demonstrate the skyrmion Hall effect, and the resultant skyrmion accumulation, by driving skyrmions from the creep-motion regime (where their dynamics are influenced by pinning defects) into the steady-flow-motion regime. The experimental observation of transverse transport of skyrmions due to topological charge may potentially create many exciting opportunities, such as topological selection.

  14. Direct observation of the skyrmion Hall effect

    SciTech Connect

    Jiang, Wanjun; Zhang, Xichao; Yu, Guoqiang; Zhang, Wei; Wang, Xiao; Jungfleisch, M. Benjamin; Pearson, John E.; Cheng, Xuemei; Heinonen, Olle; Wang, Kang L.; Zhou, Yan; Hoffmann, Axel; te Velthuis, Suzanne G. E.

    2016-09-19

    The well-known Hall effect describes the transverse deflection of charged particles (electrons/holes) as a result of the Lorentz force. Similarly, it is intriguing to examine if quasi-particles without an electric charge, but with a topological charge, show related transverse motion. Magnetic skyrmions with a well-defined spin texture with a unit topological charge serve as good candidates to test this hypothesis. In spite of the recent progress made on investigating magnetic skyrmions, direct observation of the skyrmion Hall effect has remained elusive. Here, by using a current-induced spin Hall spin torque, we experimentally demonstrate the skyrmion Hall effect, and the resultant skyrmion accumulation, by driving skyrmions from the creep-motion regime (where their dynamics are influenced by pinning defects) into the steady-flow-motion regime. Lastly, the experimental observation of transverse transport of skyrmions due to topological charge may potentially create many exciting opportunities, such as topological selection.

  15. Direct observation of laser guided corona discharges

    NASA Astrophysics Data System (ADS)

    Wang, Tie-Jun; Wei, Yingxia; Liu, Yaoxiang; Chen, Na; Liu, Yonghong; Ju, Jingjing; Sun, Haiyi; Wang, Cheng; Lu, Haihe; Liu, Jiansheng; Chin, See Leang; Li, Ruxin; Xu, Zhizhan

    2015-12-01

    Laser based lightning control holds a promising way to solve the problem of the long standing disaster of lightning strikes. But it is a challenging project due to insufficient understanding of the interaction between laser plasma channel and high voltage electric filed. In this work, a direct observation of laser guided corona discharge is reported. Laser filament guided streamer and leader types of corona discharges were observed. An enhanced ionization took place in the leader (filament) through the interaction with the high voltage discharging field. The fluorescence lifetime of laser filament guided corona discharge was measured to be several microseconds, which is 3 orders of magnitude longer than the fluorescence lifetime of laser filaments. This work could be advantageous towards a better understanding of laser assisted leader development in the atmosphere.

  16. Dynamical real space renormalization group applied to sandpile models.

    PubMed

    Ivashkevich, E V; Povolotsky, A M; Vespignani, A; Zapperi, S

    1999-08-01

    A general framework for the renormalization group analysis of self-organized critical sandpile models is formulated. The usual real space renormalization scheme for lattice models when applied to nonequilibrium dynamical models must be supplemented by feedback relations coming from the stationarity conditions. On the basis of these ideas the dynamically driven renormalization group is applied to describe the boundary and bulk critical behavior of sandpile models. A detailed description of the branching nature of sandpile avalanches is given in terms of the generating functions of the underlying branching process.

  17. Entanglement renormalization for quantum fields in real space.

    PubMed

    Haegeman, Jutho; Osborne, Tobias J; Verschelde, Henri; Verstraete, Frank

    2013-03-08

    We show how to construct renormalization group (RG) flows of quantum field theories in real space, as opposed to the usual Wilsonian approach in momentum space. This is achieved by generalizing the multiscale entanglement renormalization ansatz to continuum theories. The variational class of wave functions arising from this RG flow are translation invariant and exhibits an entropy-area law. We illustrate the construction for a free nonrelativistic boson model, and argue that the full power of the construction should emerge in the case of interacting theories.

  18. Direct Observation of Hemithioindigo-Motor Unidirectionality.

    PubMed

    Dube, Henry; Huber, Ludwig Alexander; Hoffmann, Kerstin; Thumser, Stefan; Böcher, Niklas; Mayer, Peter

    2017-09-11

    Hemithioindigo molecular motors undergo very fast unidirectional rotation upon irradiation with visible light, which prevented a complete analysis of their working mechanism. In this work we have considerably slowed down their motion via a new synthesis for sterically hindered motor derivatives. This method allowed for the first time observation of all four intermediate states populated during rotation. The exact order in which each isomeric state is formed under irradiation conditions was elucidated using low temperature 1H NMR spectroscopy in conjunction with other analytic methods. At the same time complete unidirectionality could also directly be shown. Access to slow rotating hemithioindigo motors opens up a plethora of new applications for visible light induced unidirectional motions, especially in areas such as catalysis, smart materials, or supramolecular chemistry. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. Directly observed therapy for treating tuberculosis.

    PubMed

    Karumbi, Jamlick; Garner, Paul

    2015-05-29

    Tuberculosis (TB) requires at least six months of treatment. If treatment is incomplete, patients may not be cured and drug resistance may develop. Directly Observed Therapy (DOT) is a specific strategy, endorsed by the World Health Organization, to improve adherence by requiring health workers, community volunteers or family members to observe and record patients taking each dose. To evaluate DOT compared to self-administered therapy in people on treatment for active TB or on prophylaxis to prevent active disease. We also compared the effects of different forms of DOT. We searched the following databases up to 13 January 2015: the Cochrane Infectious Diseases Group Specialized Register; the Cochrane Central Register of Controlled Trials (CENTRAL), published in the Cochrane Library; MEDLINE; EMBASE; LILACS and mRCT. We also checked article reference lists and contacted relevant researchers and organizations. Randomized controlled trials (RCTs) and quasi-RCTs comparing DOT with routine self-administration of treatment or prophylaxis at home. Two review authors independently assessed risk of bias of each included trial and extracted data. We compared interventions using risk ratios (RR) with 95% confidence intervals (CI). We used a random-effects model if meta-analysis was appropriate but heterogeneity present (I(2) statistic > 50%). We assessed the quality of the evidence using the GRADE approach. Eleven trials including 5662 participants met the inclusion criteria. DOT was performed by a range of people (nurses, community health workers, family members or former TB patients) in a variety of settings (clinic, the patient's home or the home of a community volunteer). DOT versus self-administered Six trials from South Africa, Thailand, Taiwan, Pakistan and Australia compared DOT with self-administered therapy for treatment. Trials included DOT at home by family members, community health workers (who were usually supervised); DOT at home by health staff; and DOT at

  20. Direct observation of a fractional charge

    NASA Astrophysics Data System (ADS)

    de-Picciotto, R.; Reznikov, M.; Heiblum, M.; Umansky, V.; Bunin, G.; Mahalu, D.

    1997-09-01

    Since Millikan's famous oil-drop experiments, it has been well known that electrical charge is quantized in units of the charge of an electron, e. For this reason, the theoretical prediction, by Laughlin of the existence of fractionally charged `quasiparticles'-proposed as an explanation for the fractional quantum Hall (FQH) effect-is very counterintuitive. The FQH effect is a phenomenon observed in the conduction properties of a two-dimensional electron gas subjected to a strong perpendicular magnetic field. This effect results from the strong interaction between electrons, brought about by the magnetic field, giving rise to the aforementioned fractionally charged quasiparticles which carry the current. Here we report the direct observation of these counterintuitive entities by using measurements of quantum shot noise. Quantum shot noise results from the discreteness of the current-carrying charges and so is proportional to both the charge of the quasiparticles and the average current. Our measurements of quantum shot noise show unambiguously that current in a two-dimensional electron gas in the FQH regime is carried by fractional charges-e/3 in the present case-in agreement with Laughlin's prediction.

  1. First direct observation of muon antineutrino disappearance

    SciTech Connect

    Adamson, P.

    2011-07-05

    This letter reports the first direct observation of muon antineutrino disappearance. The MINOS experiment has taken data with an accelerator beam optimized for ν¯μ production, accumulating an exposure of 1.71 x 1020 protons on target. In the Far Detector, 97 charged current ν¯μ events are observed. The no-oscillation hypothesis predicts 156 events and is excluded at 6.3σ. The best fit to oscillation yields |Δm¯2| = (3.36-0.40 +0.46(stat.) ± 0.06(syst.)) x 10-3 eV2, sin2(2 θ¯) = 0.86-0.12+0.11 (stat.) ± 0.01(syst.). The MINOS νμ and ν¯μ measurements are consistent at the 2.0% confidence level, assuming identical underlying oscillation parameters.

  2. WMAP haze: Directly observing dark matter?

    SciTech Connect

    Forbes, Michael McNeil; Zhitnitsky, Ariel R.

    2008-10-15

    In this paper, we show that dark matter in the form of dense matter/antimatter nuggets could provide a natural and unified explanation for several distinct bands of diffuse radiation from the core of the Galaxy spanning over 13 orders of magnitude in frequency. We fix all of the phenomenological properties of this model by matching to x-ray observations in the keV band, and then calculate the unambiguously predicted thermal emission in the microwave band, at frequencies smaller by 11 orders of magnitude. Remarkably, the intensity and spectrum of the emitted thermal radiation are consistent with - and could entirely explain - the so-called 'WMAP haze': a diffuse microwave excess observed from the core of our Galaxy by the Wilkinson Microwave Anisotropy Probe (WMAP). This provides another strong constraint of our proposal, and a remarkable nontrivial validation. If correct, our proposal identifies the nature of the dark matter, explains baryogenesis, and provides a means to directly probe the matter distribution in our Galaxy by analyzing several different types of diffuse emissions.

  3. Direct observation of the skyrmion Hall effect

    DOE PAGES

    Jiang, Wanjun; Zhang, Xichao; Yu, Guoqiang; ...

    2016-09-19

    The well-known Hall effect describes the transverse deflection of charged particles (electrons/holes) as a result of the Lorentz force. Similarly, it is intriguing to examine if quasi-particles without an electric charge, but with a topological charge, show related transverse motion. Magnetic skyrmions with a well-defined spin texture with a unit topological charge serve as good candidates to test this hypothesis. In spite of the recent progress made on investigating magnetic skyrmions, direct observation of the skyrmion Hall effect has remained elusive. Here, by using a current-induced spin Hall spin torque, we experimentally demonstrate the skyrmion Hall effect, and the resultantmore » skyrmion accumulation, by driving skyrmions from the creep-motion regime (where their dynamics are influenced by pinning defects) into the steady-flow-motion regime. Lastly, the experimental observation of transverse transport of skyrmions due to topological charge may potentially create many exciting opportunities, such as topological selection.« less

  4. Real space electrostatics for multipoles. I. Development of methods

    NASA Astrophysics Data System (ADS)

    Lamichhane, Madan; Gezelter, J. Daniel; Newman, Kathie E.

    2014-10-01

    We have extended the original damped-shifted force (DSF) electrostatic kernel and have been able to derive three new electrostatic potentials for higher-order multipoles that are based on truncated Taylor expansions around the cutoff radius. These include a shifted potential (SP) that generalizes the Wolf method for point multipoles, and Taylor-shifted force (TSF) and gradient-shifted force (GSF) potentials that are both generalizations of DSF electrostatics for multipoles. We find that each of the distinct orientational contributions requires a separate radial function to ensure that pairwise energies, forces, and torques all vanish at the cutoff radius. In this paper, we present energy, force, and torque expressions for the new models, and compare these real-space interaction models to exact results for ordered arrays of multipoles. We find that the GSF and SP methods converge rapidly to the correct lattice energies for ordered dipolar and quadrupolar arrays, while the TSF is too severe an approximation to provide accurate convergence to lattice energies. Because real-space methods can be made to scale linearly with system size, SP and GSF are attractive options for large Monte Carlo and molecular dynamics simulations, respectively.

  5. Surface reconstruction of Au(001): High-resolution real-space and reciprocal-space inspection

    NASA Astrophysics Data System (ADS)

    Hammer, R.; Sander, A.; Förster, S.; Kiel, M.; Meinel, K.; Widdra, W.

    2014-07-01

    The hexagonal reconstruction of Au(001) has been a model system for the understanding of complex metal surface reconstructions, and it has been intensively studied over almost five decades. Nevertheless, details of the reconstruction regarding the top layer to substrate matching and alignment are not unambiguously identified due to restricted resolution of previously available analytical tools as well as nonuniform sample quality. We therefore quantitatively reinvestigated the system by applying high-resolution real-space and reciprocal-space inspection using scanning tunneling microscopy and spot profile analysis low-energy electron diffraction in analyzing a high-quality Au(001) sample. We show that the Au(001) reconstruction consists of two rotational domains of a commensurate c(28×48) superstructure. It results from a Moiré-like buckling of a quasihexagonal top layer which is characterized by lattice vectors having a length of 0.9655a and 0.9581a, respectively, where a is the interatomic distance of Au(001). The former vector runs exactly along [110] or [-110], whereas the latter one deviates by 59.75° from those directions. Ar+ ion bombardment at elevated temperatures induces a rotation of the top layers up to angles of ±0.83°. Sample annealing yields a turning back into the initial top layer alignment. Rotation and reorientation proceeds continuously, i.e. all angles between 0 and ±0.83° are observed. Using simple hard sphere models, the main characteristics of the reconstruction are explained. This includes even structural details of the reconstruction at step edges for nonrotated and rotated quasihexagonal top layers.

  6. Study on the mapping of dark matter clustering from real space to redshift space

    NASA Astrophysics Data System (ADS)

    Zheng, Yi; Song, Yong-Seon

    2016-08-01

    The mapping of dark matter clustering from real space to redshift space introduces the anisotropic property to the measured density power spectrum in redshift space, known as the redshift space distortion effect. The mapping formula is intrinsically non-linear, which is complicated by the higher order polynomials due to indefinite cross correlations between the density and velocity fields, and the Finger-of-God effect due to the randomness of the peculiar velocity field. Whilst the full higher order polynomials remain unknown, the other systematics can be controlled consistently within the same order truncation in the expansion of the mapping formula, as shown in this paper. The systematic due to the unknown non-linear density and velocity fields is removed by separately measuring all terms in the expansion directly using simulations. The uncertainty caused by the velocity randomness is controlled by splitting the FoG term into two pieces, 1) the ``one-point" FoG term being independent of the separation vector between two different points, and 2) the ``correlated" FoG term appearing as an indefinite polynomials which is expanded in the same order as all other perturbative polynomials. Using 100 realizations of simulations, we find that the Gaussian FoG function with only one scale-independent free parameter works quite well, and that our new mapping formulation accurately reproduces the observed 2-dimensional density power spectrum in redshift space at the smallest scales by far, up to k~ 0.2 Mpc-1, considering the resolution of future experiments.

  7. Simulating contrast inversion in atomic force microscopy imaging with real-space pseudopotentials

    NASA Astrophysics Data System (ADS)

    Lee, Alex J.; Sakai, Yuki; Chelikowsky, James R.

    2017-02-01

    Atomic force microscopy (AFM) measurements have reported contrast inversions for systems such as Cu2N and graphene that can hamper image interpretation and characterization. Here, we apply a simulation method based on ab initio real-space pseudopotentials to gain an understanding of the tip-sample interactions that influence the inversion. We find that chemically reactive tips induce an attractive binding force that results in the contrast inversion. We find that the inversion is tip height dependent and not observed when using less reactive CO-functionalized tips.

  8. Magnetotelluric distortions directly observed with lightning data

    NASA Astrophysics Data System (ADS)

    Hennessy, Lachlan; Macnae, James

    2017-08-01

    Galvanic distortions complicate magnetotelluric (MT) soundings. In this research, we use lightning network data to identify specific sferics in MT measurements and analyse these events on the basis of the lightning source location. Without source information, identification and removal of galvanic distortion is a fundamentally ill-posed problem, unless data are statistically decomposed into determinable and indeterminable parts. We use realistic assumptions of the earth-ionosphere waveguide propagation velocity to accurately predict the time of arrival, azimuth and amplitude for every significant sferic in our time-series data. For each sferic with large amplitude, we calculate the rotation of the electric field from the measured to the predicted arrival azimuth. This rotation of the electric field is a primary parameter of distortion. Our results demonstrate that a rudimentary model for near-surface galvanic distortion consistently fits observed electric field rotations. When local features rotate regional electric fields, then counter-rotating data to predicted arrival azimuths should correct the directional dependence of static shift. Although we used amplitude thresholds to simplify statistical processing, future developments should incorporate both signal-to-noise improvements and multisite decompositions. Lower amplitude signal may also be useful after the appropriate signal processing for noise reduction. We anticipate our approach will be useful for further work on MT distortion.

  9. ELECTRONIC OBSERVERS FOR RADIO DIRECTION FINDING,

    DTIC Science & Technology

    RADIO EQUIPMENT, DIRECTION FINDING , RADIO SIGNALS, AMPLITUDE MODULATION, MONITORS, DISPLAY SYSTEMS, INFORMATION THEORY, STATISTICAL ANALYSIS, COMPUTER PROGRAMMING, NAVIGATIONAL AIDS, DETECTION, DATA PROCESSING.

  10. Real-space Hopfield diagonalization of inhomogeneous dispersive media

    NASA Astrophysics Data System (ADS)

    Gubbin, Christopher R.; Maier, Stefan A.; De Liberato, Simone

    2016-11-01

    We introduce a real-space technique able to extend the standard Hopfield approach commonly used in quantum polaritonics to the case of inhomogeneous lossless materials interacting with the electromagnetic field. We derive the creation and annihilation polaritonic operators for the system normal modes as linear, space-dependent superpositions of the microscopic light and matter fields. We prove their completeness and invert the Hopfield transformation expressing the microscopic fields as functions of the polaritonic operators. As an example, we apply our approach to the case of a planar interface between vacuum and a polar dielectric, showing how we can consistently treat both propagative and surface modes, and express their nonlinear interactions, arising from phonon anharmonicity, as polaritonic scattering terms. We also show that our theory, including the proof of completeness, can be naturally extended to the case of dissipative materials.

  11. One-electron images in real space: natural adaptive orbitals.

    PubMed

    Menéndez, Marcos; Álvarez Boto, Roberto; Francisco, Evelio; Martín Pendás, Ángel

    2015-04-30

    We introduce a general procedure to construct a set of one-electron functions in chemical bonding theory, which remain physically sound both for correlated and noncorrelated electronic structure descriptions. These functions, which we call natural adaptive orbitals, decompose the n-center bonding indices used in real space theories of the chemical bond into one-electron contributions. For the n = 1 case, they coincide with the domain natural orbitals used in domain-averaged Fermi hole analyses. We examine their interpretation in the two-center case, and show how they behave and evolve in simple cases. Orbital pictures obtained through this technique converge onto the chemist's molecular orbital toolbox if electron correlation may be ignored, and provide new insight if it may not.

  12. Real space renormalization group theory of disordered models of glasses.

    PubMed

    Angelini, Maria Chiara; Biroli, Giulio

    2017-03-28

    We develop a real space renormalization group analysis of disordered models of glasses, in particular of the spin models at the origin of the random first-order transition theory. We find three fixed points, respectively, associated with the liquid state, with the critical behavior, and with the glass state. The latter two are zero-temperature ones; this provides a natural explanation of the growth of effective activation energy scale and the concomitant huge increase of relaxation time approaching the glass transition. The lower critical dimension depends on the nature of the interacting degrees of freedom and is higher than three for all models. This does not prevent 3D systems from being glassy. Indeed, we find that their renormalization group flow is affected by the fixed points existing in higher dimension and in consequence is nontrivial. Within our theoretical framework, the glass transition results in an avoided phase transition.

  13. Direct observation of microbubbles in directional solidification of salol

    SciTech Connect

    Williams, L.M.; Srinivasan, M.R.; Cummins, H.Z. )

    1990-03-26

    Dynamic light scattering at the crystal-melt interface of solidifying salol was followed for 14 days. The hydrodynamic radius deduced from intensity correlation data increased continuously from {approx}1 to {approx}100 {mu}m. When the scattering layer was trapped by the advancing crystal front, microscopic observation revealed bubbles as inclusions whose size agreed with the light-scattering value. Scattering was also observed to disappear after prolonged pumping on the sample.

  14. Direct Observation of Academic Learning Time.

    ERIC Educational Resources Information Center

    Wilson, Rich

    1987-01-01

    Classroom variables associated with academic learning time (ALT)--instructional time, on-task behavior, and student success rate--are positively related to student achievement. Guidelines and forms are provided for teachers and supervisors to gather objective and usable information on these ALT components through direct classroom observation…

  15. Simulation Theory Applied to Direct Systematic Observation

    PubMed Central

    Manolov, Rumen; Losada, José L.

    2017-01-01

    Observational studies entail making several decisions before data collection, such as the observational design to use, the sampling of sessions within the observational period, the need for time sampling within the observation sessions, as well as the observation recording procedures to use. The focus of the present article is on observational recording procedures different from continuous recording (i.e., momentary time sampling, partial and whole interval recording). The main aim is to develop an online software application, constructed using R and the Shiny package, on the basis of simulations using the alternating renewal process (a model implemented in the ARPobservation package). The application offers graphical representations that can be useful to both university students constructing knowledge on Observational Methodology and to applied researchers planning to use discontinuous recording in their studies, because it helps identifying the conditions (e.g., interval length, average duration of the behavior of interest) in which the prevalence of the target behavior is expected to be estimated with less bias or no bias and with more efficiency. The estimation of frequency is another topic covered. PMID:28642721

  16. Real-space formulation of the electrostatic potential and total energy of solids

    SciTech Connect

    Pask, J E; Sterne, P A

    2004-05-12

    We develop expressions for the electrostatic potential and total energy of crystalline solids which are amenable to direct evaluation in real space. Unlike conventional reciprocal space formulations, no Fourier transforms or reciprocal lattice summations are required, and the formulation is well suited for large-scale, parallel computations. The need for reciprocal space expressions is eliminated by replacing long-range potentials by equivalent localized charge distributions and incorporating long-range interactions into boundary conditions on the unit cell. In so doing, a simplification of the conventional reciprocal space formalism is obtained. The equivalence of the real- and reciprocal space formalisms is demonstrated by direct comparison in self-consistent density-functional calculations.

  17. Real-space mean-field approach to polymeric ternary systems

    NASA Astrophysics Data System (ADS)

    Komura, Shigeyuki; Kodama, Hiroya; Tamura, Keizo

    2002-12-01

    Phase separated structure of ternary blends of A and B homopolymers and symmetric AB diblock copolymer is investigated using a lattice (real-space) self-consistent field theory. This paper includes the detailed description of our published results [Kodama, Komura, and Tamura, Europhys. Lett. 53, 46 (2001)] as well as more extended calculations. We consider the symmetric case, namely, (i) both A and B homopolymers have the same degree of polymerization NA=NB; (ii) AB diblock copolymer of length NAB is symmetric; (iii) average volume fractions of A and B homopolymers are equal. We looked into the influence of relative chain lengths α=NA/NAB on the phase separated structure. Our numerical simulations are performed in the real space without assuming the symmetry of the structure a priori. For the fixed copolymer length and α<1, the typical length scale of the microphase separated structure become smaller for relatively shorter homopolymer chains (small α). In other words, the homopolymers becomes more efficient to swell the microphase separated structure for longer homopolymer chains (large α). Detailed free-energy analysis revealed that the stability of the lamellar phase is marginal for small block copolymer volume fraction. For α>1, on the other hand, three-phase coexistence either between the disorder, A-rich and B-rich phases or between the lamellar, A-rich and B-rich phases is observed.

  18. Direct Observation of Spin- and Charge-Density Waves in a Luttinger Liquid

    NASA Astrophysics Data System (ADS)

    Cao, Chenglin; Marcum, Andrew; Mawardi Ismail, Arif; Fonta, Francisco; O'Hara, Kenneth

    2016-05-01

    At low energy, interacting fermions in one dimension (e.g. electrons in quantum wires or fermionic atoms in 1D waveguides) should behave as Luttinger liquids. In stark contrast to Fermi liquids, the low-energy elementary excitations in Luttinger liquids are collective sound-like modes that propagate independently as spin-density and/or charge-density (i.e. particle-density) waves with generally unequal, and interaction-dependent, velocities. Here we aim to unambiguously confirm this hallmark feature of the Luttinger liquid - the phenomenon of spin-charge separation - by directly observing in real space the dynamics of spin-density and ``charge''-density waves excited in an ultracold gas of spin-1/2 fermions confined in an array of 1D optical waveguides. Starting from a two-component mixture of 6 Li atoms harmonically confined along each of the 1D waveguides, we excite low lying normal modes of the trapped system - namely the spin dipole and density dipole and quadrupole modes - and measure their frequency as a function of interaction strength. Luttinger liquid theory predicts that the spin dipole frequency is strongly dependent on interaction strength whereas the density dipole and quadrupole mode frequencies are relatively insensitive. We will also discuss extending our approach to exciting localized spin density and particle density wavepackets which should propagate at different velocities. Supported by AFOSR and NSF.

  19. Real Space Transfer Between Two Semiconductor Channels Connected in Parallel

    NASA Astrophysics Data System (ADS)

    Webb, K.; Cohen, E.; Janes, D.; Melloch, M.; Wilshere, C.

    1997-03-01

    With Real Space Transfer (RST), it is possible to rapidly alter a carrier's transport characteristics by moving it a short vertical distance through a heterostructure. The concept of the Velocity Modulation transistor (VMT), which uses this principle to modulate current, first appeared in 1982; its fast switching capabilities have yet to realized. We present evidence of RST at DC operating conditions in a double-gated, dual-channel transistor amenable to high speed VMT operation. A gate voltage is applied in order to create a potential difference between two channels, which are connected in parallel. Electrons enter one of two channels and undergo RST to a channel of different mobility. MBE growth provides a modulation doped 2-D electron gas which is separated from a lower mobility, doped channel by 70 nm by a digitally graded GaAs/Al_xGa_1-xAs barrier. The mobility ratio is 2.5:1 at room temperature. Further, the heterostructure is designed such that, with appropriate gating, the carriers can be forced back and forth between these channels, having their mobilities and velocities changed accordingly.

  20. 46 CFR 148.03-3 - Direction and observation.

    Code of Federal Regulations, 2010 CFR

    2010-10-01

    ... 46 Shipping 5 2010-10-01 2010-10-01 false Direction and observation. 148.03-3 Section 148.03-3... HAZARDOUS MATERIALS IN BULK Minimum Transportation Requirements § 148.03-3 Direction and observation... be conducted only under the direction and observation of a person assigned or employed for such duty...

  1. Direct Observation of Paramagnons in Palladium

    SciTech Connect

    Doubble, R.; Hayden, S M.; Dai, Pengcheng; Mook Jr, Herbert A; Thompson, James R; Frost, C.

    2010-01-01

    We report an inelastic neutron scattering study of the spin fluctuations in the nearly ferromagnetic element palladium. Dispersive over-damped collective magnetic excitations or 'paramagnons' are observed up to 128 meV. We analyze our results in terms of a Moriya-Lonzarich-type spin-fluctuation model and estimate the contribution of the spin fluctuations to the low-temperature heat capacity. In spite of the paramagnon excitations being relatively strong, their relaxation rates are large. This leads to a small contribution to the low-temperature electronic specific heat.

  2. Direct observation of nanowire growth and decomposition.

    PubMed

    Rackauskas, Simas; Shandakov, Sergey D; Jiang, Hua; Wagner, Jakob B; Nasibulin, Albert G

    2017-09-26

    Fundamental concepts of the crystal formation suggest that the growth and decomposition are determined by simultaneous embedding and removal of the atoms. Apparently, by changing the crystal formation conditions one can switch the regimes from the growth to decomposition. To the best of our knowledge, so far this has been only postulated, but never observed at the atomic level. By means of in situ environmental transmission electron microscopy we monitored and examined the atomic layer transformation at the conditions of the crystal growth and its decomposition using CuO nanowires selected as a model object. The atomic layer growth/decomposition was studied by varying an O2 partial pressure. Three distinct regimes of the atomic layer evolution were experimentally observed: growth, transition and decomposition. The transition regime, at which atomic layer growth/decomposition switch takes place, is characterised by random nucleation of the atomic layers on the growing {111} surface. The decomposition starts on the side of the nanowire by removing the atomic layers without altering the overall crystal structure, which besides the fundamental importance offers new possibilities for the nanowire manipulation. Understanding of the crystal growth kinetics and nucleation at the atomic level is essential for the precise control of 1D crystal formation.

  3. Direct observation of ballistic Andreev reflection

    SciTech Connect

    Klapwijk, T. M.; Ryabchun, S. A.

    2014-12-15

    An overview is presented of experiments on ballistic electrical transport in inhomogeneous superconducting systems which are controlled by the process of Andreev reflection. The initial experiments based on the coexistence of a normal phase and a superconducting phase in the intermediate state led to the concept itself. It was followed by a focus on geometrically inhomogeneous systems like point contacts, which provided a very clear manifestation of the energy and direction dependence of the Andreev reflection process. The point contacts have recently evolved towards the atomic scale owing to the use of mechanical break-junctions, revealing a very detailed dependence of Andreev reflection on the macroscopic phase of the superconducting state. In present-day research, the superconducting in homogeneity is constructed by clean room technology and combines superconducting materials, for example, with low-dimensional materials and topological insulators. Alternatively, the superconductor is combined with nano-objects, such as graphene, carbon nanotubes, or semiconducting nanowires. Each of these “inhomogeneous systems” provides a very interesting range of properties, all rooted in some manifestation of Andreev reflection.

  4. Direct observation of ballistic Andreev reflection

    NASA Astrophysics Data System (ADS)

    Klapwijk, T. M.; Ryabchun, S. A.

    2014-12-01

    An overview is presented of experiments on ballistic electrical transport in inhomogeneous superconducting systems which are controlled by the process of Andreev reflection. The initial experiments based on the coexistence of a normal phase and a superconducting phase in the intermediate state led to the concept itself. It was followed by a focus on geometrically inhomogeneous systems like point contacts, which provided a very clear manifestation of the energy and direction dependence of the Andreev reflection process. The point contacts have recently evolved towards the atomic scale owing to the use of mechanical break-junctions, revealing a very detailed dependence of Andreev reflection on the macroscopic phase of the superconducting state. In present-day research, the superconducting in homogeneity is constructed by clean room technology and combines superconducting materials, for example, with low-dimensional materials and topological insulators. Alternatively, the superconductor is combined with nano-objects, such as graphene, carbon nanotubes, or semiconducting nanowires. Each of these "inhomogeneous systems" provides a very interesting range of properties, all rooted in some manifestation of Andreev reflection.

  5. Real-space imaging of a topologically protected edge state with ultracold atoms in an amplitude-chirped optical lattice

    PubMed Central

    Leder, Martin; Grossert, Christopher; Sitta, Lukas; Genske, Maximilian; Rosch, Achim; Weitz, Martin

    2016-01-01

    To describe a mobile defect in polyacetylene chains, Su, Schrieffer and Heeger formulated a model assuming two degenerate energy configurations that are characterized by two different topological phases. An immediate consequence was the emergence of a soliton-type edge state located at the boundary between two regions of different configurations. Besides giving first insights in the electrical properties of polyacetylene materials, interest in this effect also stems from its close connection to states with fractional charge from relativistic field theory. Here, using a one-dimensional optical lattice for cold rubidium atoms with a spatially chirped amplitude, we experimentally realize an interface between two spatial regions of different topological order in an atomic physics system. We directly observe atoms confined in the edge state at the intersection by optical real-space imaging and characterize the state as well as the size of the associated energy gap. Our findings hold prospects for the spectroscopy of surface states in topological matter and for the quantum simulation of interacting Dirac systems. PMID:27767054

  6. Mapping the Real-space Distributions of Galaxies in SDSS DR7. I. Two-point Correlation Functions

    NASA Astrophysics Data System (ADS)

    Shi, Feng; Yang, Xiaohu; Wang, Huiyuan; Zhang, Youcai; Mo, H. J.; van den Bosch, Frank C.; Li, Shijie; Liu, Chengze; Lu, Yi; Tweed, Dylan; Yang, Lei

    2016-12-01

    Using a method to correct redshift-space distortion (RSD) for individual galaxies, we mapped the real-space distributions of galaxies in the Sloan Digital Sky Survey (SDSS) Data Release 7 (DR7). We use an ensemble of mock catalogs to demonstrate the reliability of our method. Here, in the first paper in a series, we focus mainly on the two-point correlation function (2PCF) of galaxies. Overall the 2PCF measured in the reconstructed real space for galaxies brighter than {}0.1{M}r-5{log}h=-19.0 agrees with the direct measurement to an accuracy better than the measurement error due to cosmic variance, if the reconstruction uses the correct cosmology. Applying the method to the SDSS DR7, we construct a real-space version of the main galaxy catalog, which contains 396,068 galaxies in the North Galactic Cap with redshifts in the range 0.01 ≤ z ≤ 0.12. The Sloan Great Wall, the largest known structure in the nearby universe, is not as dominant an overdense structure as it appears to be in redshift space. We measure the 2PCFs in reconstructed real space for galaxies of different luminosities and colors. All of them show clear deviations from single power-law forms, and reveal clear transitions from one-halo to two-halo terms. A comparison with the corresponding 2PCFs in redshift space nicely demonstrates how RSDs boost the clustering power on large scales (by about 40%-50% at scales ˜ 10 {h}-1 {Mpc}) and suppress it on small scales (by about 70%-80% on a scale of 0.3 {h}-1 {Mpc}).

  7. Keeping it real: revisiting a real-space approach to running ensembles of cosmological N-body simulations

    NASA Astrophysics Data System (ADS)

    Orban, Chris

    2013-05-01

    In setting up initial conditions for ensembles of cosmological N-body simulations there are, fundamentally, two choices: either maximizing the correspondence of the initial density field to the assumed fourier-space clustering or, instead, matching to real-space statistics and allowing the DC mode (i.e. overdensity) to vary from box to box as it would in the real universe. As a stringent test of both approaches, I perform ensembles of simulations using power law and a ``powerlaw times a bump'' model inspired by baryon acoustic oscillations (BAO), exploiting the self-similarity of these initial conditions to quantify the accuracy of the matter-matter two-point correlation results. The real-space method, which was originally proposed by Pen 1997 [1] and implemented by Sirko 2005 [2], performed well in producing the expected self-similar behavior and corroborated the non-linear evolution of the BAO feature observed in conventional simulations, even in the strongly-clustered regime (σ8gtrsim1). In revisiting the real-space method championed by [2], it was also noticed that this earlier study overlooked an important integral constraint correction to the correlation function in results from the conventional approach that can be important in ΛCDM simulations with Lboxlesssim1 h-1Gpc and on scales rgtrsimLbox/10. Rectifying this issue shows that the fourier space and real space methods are about equally accurate and efficient for modeling the evolution and growth of the correlation function, contrary to previous claims. An appendix provides a useful independent-of-epoch analytic formula for estimating the importance of the integral constraint bias on correlation function measurements in ΛCDM simulations.

  8. Keeping it real: revisiting a real-space approach to running ensembles of cosmological N-body simulations

    SciTech Connect

    Orban, Chris

    2013-05-01

    In setting up initial conditions for ensembles of cosmological N-body simulations there are, fundamentally, two choices: either maximizing the correspondence of the initial density field to the assumed fourier-space clustering or, instead, matching to real-space statistics and allowing the DC mode (i.e. overdensity) to vary from box to box as it would in the real universe. As a stringent test of both approaches, I perform ensembles of simulations using power law and a ''powerlaw times a bump'' model inspired by baryon acoustic oscillations (BAO), exploiting the self-similarity of these initial conditions to quantify the accuracy of the matter-matter two-point correlation results. The real-space method, which was originally proposed by Pen 1997 [1] and implemented by Sirko 2005 [2], performed well in producing the expected self-similar behavior and corroborated the non-linear evolution of the BAO feature observed in conventional simulations, even in the strongly-clustered regime (σ{sub 8}∼>1). In revisiting the real-space method championed by [2], it was also noticed that this earlier study overlooked an important integral constraint correction to the correlation function in results from the conventional approach that can be important in ΛCDM simulations with L{sub box}∼<1 h{sup −1}Gpc and on scales r∼>L{sub box}/10. Rectifying this issue shows that the fourier space and real space methods are about equally accurate and efficient for modeling the evolution and growth of the correlation function, contrary to previous claims. An appendix provides a useful independent-of-epoch analytic formula for estimating the importance of the integral constraint bias on correlation function measurements in ΛCDM simulations.

  9. Development and applications of real-space electrostatic interaction methods for charge-multipoles in condensed phase environments

    NASA Astrophysics Data System (ADS)

    Lamichhane, Madan

    Computing electrostatic interactions is usually the most expensive portion of a molecular dynamics simulation. Generally, traditional and modified Ewald methods are used for calculating electrostatic interactions in molecular dynamics (MD) communities. But these methods are computationally very expensive for large systems. There is a growing interest in developing real-space methods, which scale roughly linearly with the system size. The real-space method for charge-charge interaction was originally developed by Wolf and extended by Gezelter et al. In this dissertation, I present three new real-space methods: Shifted Potential (SP), Gradient-Shifted Force (GSF), and Taylor-Shifted Force (TSF), for computing electrostatic interactions between charges, dipoles, and quadrupoles. I also discuss the various static and dynamic properties evaluated using the newly developed real-space methods. Additionally, I use three methods: fluctuation, perturbation, and potentials of mean force (PMF), for computing dielectric properties for multipolar fluids. The SP method is the multipolar version of Wolf's electrostatic method. Similarly, the GSF and TSF method are natural extensions of the original Damped Shifted Force (DSF) method developed. The energies evaluated using the SP method shows quantitative agreement with the Ewald sum, therefore it is a good choice for Monte Carlo (MC) simulations. The energies, forces, and torques calculated from the GSF method agree with the Ewald's result and produce excellent conservation of energy in MD simulations. Both SP and GSF method with a suitable damping parameter perform remarkably well in predicting static and dynamic properties of liquid systems. For the both dipolar and quadrupolar fluids, the dielectric properties predicted using the perturbation method agree with those from the fluctuation formula. Realspace methods need a correction factor to obtain dielectric constants and susceptibilities from the directly measurable

  10. Direct observation of electron propagation and dielectric screening on the atomic length scale.

    PubMed

    Neppl, S; Ernstorfer, R; Cavalieri, A L; Lemell, C; Wachter, G; Magerl, E; Bothschafter, E M; Jobst, M; Hofstetter, M; Kleineberg, U; Barth, J V; Menzel, D; Burgdörfer, J; Feulner, P; Krausz, F; Kienberger, R

    2015-01-15

    The propagation and transport of electrons in crystals is a fundamental process pertaining to the functioning of most electronic devices. Microscopic theories describe this phenomenon as being based on the motion of Bloch wave packets. These wave packets are superpositions of individual Bloch states with the group velocity determined by the dispersion of the electronic band structure near the central wavevector in momentum space. This concept has been verified experimentally in artificial superlattices by the observation of Bloch oscillations--periodic oscillations of electrons in real and momentum space. Here we present a direct observation of electron wave packet motion in a real-space and real-time experiment, on length and time scales shorter than the Bloch oscillation amplitude and period. We show that attosecond metrology (1 as = 10(-18) seconds) now enables quantitative insight into weakly disturbed electron wave packet propagation on the atomic length scale without being hampered by scattering effects, which inevitably occur over macroscopic propagation length scales. We use sub-femtosecond (less than 10(-15) seconds) extreme-ultraviolet light pulses to launch photoelectron wave packets inside a tungsten crystal that is covered by magnesium films of varied, well-defined thicknesses of a few ångströms. Probing the moment of arrival of the wave packets at the surface with attosecond precision reveals free-electron-like, ballistic propagation behaviour inside the magnesium adlayer--constituting the semi-classical limit of Bloch wave packet motion. Real-time access to electron transport through atomic layers and interfaces promises unprecedented insight into phenomena that may enable the scaling of electronic and photonic circuits to atomic dimensions. In addition, this experiment allows us to determine the penetration depth of electrical fields at optical frequencies at solid interfaces on the atomic scale.

  11. Direct Behavioral Observation in School Settings: Bringing Science to Practice

    ERIC Educational Resources Information Center

    Nock, Matthew K.; Kurtz, Steven M. S.

    2005-01-01

    Schools provide a useful, controlled setting for evaluating child behavior problems, yet direct observational coding procedures evaluated by child researchers have not been widely incorporated by practicing clinicians. This article provides a summary of procedures useful to clinicians performing direct behavioral observation in school settings. We…

  12. Direct Behavioral Observation in School Settings: Bringing Science to Practice

    ERIC Educational Resources Information Center

    Nock, Matthew K.; Kurtz, Steven M. S.

    2005-01-01

    Schools provide a useful, controlled setting for evaluating child behavior problems, yet direct observational coding procedures evaluated by child researchers have not been widely incorporated by practicing clinicians. This article provides a summary of procedures useful to clinicians performing direct behavioral observation in school settings. We…

  13. Staging a performance: learners' perceptions about direct observation during residency.

    PubMed

    LaDonna, Kori A; Hatala, Rose; Lingard, Lorelei; Voyer, Stephane; Watling, Christopher

    2017-05-01

    Evidence strongly supports that direct observation is a valid and reliable assessment tool; support for its impact on learning is less compelling, and we know that some learners are ambivalent about being observed. However, learners' perceptions about the impact of direct observation on their learning and professional development remain underexplored. To promote learning, we need to understand what makes direct observation valuable for learners. Informed by constructivist grounded theory, we interviewed 22 learners about their observation experiences. Data collection and analysis occurred iteratively; themes were identified using constant comparative analysis. Direct observation was widely endorsed as an important educational strategy, albeit one that created significant anxiety. Opaque expectations exacerbated participants' discomfort, and participants described that being observed felt like being assessed. Consequently, participants exchanged their 'usual' practice for a 'textbook' approach; alterations to performance generated uncertainty about their role, and raised questions about whether observers saw an authentic portrayal of their knowledge and skill. An 'observer effect' may partly explain learners' ambivalence about direct observation; being observed seemed to magnify learners' role ambiguity, intensify their tensions around professional development and raise questions about the credibility of feedback. In turn, an observer effect may impact learners' receptivity to feedback and may explain, in part, learners' perceptions that useful feedback is scant. For direct observation to be valuable, educators must be explicit about expectations, and they must be aware that how learners perform in the presence of an observer may not reflect what they do as independent practitioners. To nurture learners' professional development, educators must create a culture of observation-based coaching that is divorced from assessment and is tailored to developing learners

  14. Real-space representation of electron correlation in π-conjugated systems

    SciTech Connect

    Wang, Jian E-mail: e.j.baerends@vu.nl; Baerends, Evert Jan E-mail: e.j.baerends@vu.nl

    2015-05-28

    π-electron conjugation and aromaticity are commonly associated with delocalization and especially high mobility of the π electrons. We investigate if also the electron correlation (pair density) exhibits signatures of the special electronic structure of conjugated systems. To that end the shape and extent of the pair density and derived quantities (exchange-correlation hole, Coulomb hole, and conditional density) are investigated for the prototype systems ethylene, hexatriene, and benzene. The answer is that the effects of π electron conjugation are hardly discernible in the real space representations of the electron correlation. We find the xc hole to be as localized (confined to atomic or diatomic regions) in conjugated systems as in small molecules. This result is relevant for density functional theory (DFT). The potential of the electron exchange-correlation hole is the largest part of v{sub xc}, the exchange-correlation Kohn-Sham potential. So the extent of the hole directly affects the orbital energies of both occupied and unoccupied Kohn-Sham orbitals and therefore has direct relevance for the excitation spectrum as calculated with time-dependent DFT calculations. The potential of the localized xc hole is comparatively more attractive than the actual hole left behind by an electron excited from a delocalized molecular orbital of a conjugated system.

  15. Real-space mean-field theory of a spin-1 Bose gas in synthetic dimensions

    NASA Astrophysics Data System (ADS)

    Hurst, Hilary M.; Wilson, Justin H.; Pixley, J. H.; Spielman, I. B.; Natu, Stefan S.

    2016-12-01

    The internal degrees of freedom provided by ultracold atoms provide a route for realizing higher dimensional physics in systems with limited spatial dimensions. Nonspatial degrees of freedom in these systems are dubbed "synthetic dimensions." This connection is useful from an experimental standpoint but complicated by the fact that interactions alter the condensate ground state. Here we use the Gross-Pitaevskii equation to study the ground-state properties of a spin-1 Bose gas under the combined influence of an optical lattice, spatially varying spin-orbit coupling, and interactions at the mean-field level. The associated phases depend on the sign of the spin-dependent interaction parameter and the strength of the spin-orbit field. We find "charge"- and spin-density-wave phases which are directly related to helical spin order in real space and affect the behavior of edge currents in the synthetic dimension. We determine the resulting phase diagram as a function of the spin-orbit coupling and spin-dependent interaction strength, considering both attractive (ferromagnetic) and repulsive (polar) spin-dependent interactions, and we provide a direct comparison of our results with the noninteracting case. Our findings are applicable to current and future experiments, specifically with 87Rb, 7Li, 41K, and 23Na.

  16. Fock-exchange for periodic structures in the real-space formalism and the KLI approximation.

    PubMed

    Natan, Amir

    2015-12-21

    The calculation of Fock-exchange interaction is an important task in the computation of molecule and solid properties. In this work we describe how we implement the Fock exchange in the real-space formalism using the KLI approximation for the OEP equation for 3D periodic systems. The implementation is demonstrated within the PARSEC real-space pseudopotential code that uses a discrete uniform grid and norm conserving pseudopotentials for the ionic potentials.

  17. 29. WEST CONFEDERATE AVENUE, OBSERVATION TOWER, IRON BENCH AND DIRECTION ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    29. WEST CONFEDERATE AVENUE, OBSERVATION TOWER, IRON BENCH AND DIRECTION FINDER, VIEW ACROSS AGRICULTURAL LANDSCAPE TOWARDS THE "HIGHWATER MARK." VIEW NE. - Gettysburg National Military Park Tour Roads, Gettysburg, Adams County, PA

  18. Evidence of Real-Space Transfer in Buried-Channel GexC1-x Devices

    NASA Astrophysics Data System (ADS)

    Liu, En-Shao; Kelly, David; Donnelly, Joseph; Tutuc, Emanuel; Banerjee, Sanjay

    2008-03-01

    We present experimental evidence of real-space transfer (RST) in buried-channel GexC1-x p-type metal-oxide-semiconductor field effect transistors (MOSFET) containing a Si cap layer. The output characteristics of these devices reveal a negative differential resistance (NDR) below 150K, at the onset of the saturation regime. This observation indicates a charge transfer from GexC1-x layer into the Si cap at sufficiently large drain bias values. The lower hole mobility of the Si cap with respect to the GexC1-x, translates into a drain current reduction, hence the observed NDR. Our low-field, temperature-dependent mobility measurements indeed reveal a higher effective carrier mobility in the buried-channel GexC1-x layer with respect to a Si-reference sample, which suggests that the observed NDR is caused by RST of holes from the GexC1-x into the Si layer.

  19. Direct observation and focused feedback for clinical skills training.

    PubMed

    Singh, Tejinder; Kundra, Shaveta; Gupta, Piyush

    2014-09-01

    Direct observation of the medical trainee by an expert assessor and providing authentic feedback is considered an important tool for development of clinical and procedural skills. Mini-clinical evaluation exercise and Direct Observation of Procedural Skills are two important tools to observe the trainee during a clinical encounter or during a procedure, make an expert standardized (though subjective) observation, and use it to provide developmental feedback. Both can be easily integrated into routine work of clinical departments, and both provide a reliable assessment if 6-8 such encounters are used.

  20. Real-space pseudopotential method for computing the vibrational Stark effect

    NASA Astrophysics Data System (ADS)

    Garrett, Benjamin F.; Azuri, Ido; Kronik, Leeor; Chelikowsky, James R.

    2016-11-01

    The vibrational Stark shift is an important effect in determining the electrostatic environment for molecular or condensed matter systems. However, accurate ab initio calculations of the vibrational Stark effect are a technically demanding challenge. We make use of density functional theory constructed on a real-space grid to expedite the computation of this effect. Our format is especially advantageous for the investigation of small molecules in finite fields as cluster boundary conditions eliminate spurious supercell interactions and allow for charged systems, while convergence is controlled by a single parameter, the grid spacing. The Stark tuning rate is highly sensitive to the interaction between anharmonicity in a vibrational mode and the applied field. To ensure this subtle interaction is fully captured, we apply three parallel approaches: a direct finite field, a perturbative method, and a molecular dynamics method. We illustrate this method by applying it to several small molecules containing C-O and C-N bonds and show that a consistent result can be obtained.

  1. Real-space imaging of non-collinear antiferromagnetic order with a single-spin magnetometer.

    PubMed

    Gross, I; Akhtar, W; Garcia, V; Martínez, L J; Chouaieb, S; Garcia, K; Carrétéro, C; Barthélémy, A; Appel, P; Maletinsky, P; Kim, J-V; Chauleau, J Y; Jaouen, N; Viret, M; Bibes, M; Fusil, S; Jacques, V

    2017-09-13

    Although ferromagnets have many applications, their large magnetization and the resulting energy cost for switching magnetic moments bring into question their suitability for reliable low-power spintronic devices. Non-collinear antiferromagnetic systems do not suffer from this problem, and often have extra functionalities: non-collinear spin order may break space-inversion symmetry and thus allow electric-field control of magnetism, or may produce emergent spin-orbit effects that enable efficient spin-charge interconversion. To harness these traits for next-generation spintronics, the nanoscale control and imaging capabilities that are now routine for ferromagnets must be developed for antiferromagnetic systems. Here, using a non-invasive, scanning single-spin magnetometer based on a nitrogen-vacancy defect in diamond, we demonstrate real-space visualization of non-collinear antiferromagnetic order in a magnetic thin film at room temperature. We image the spin cycloid of a multiferroic bismuth ferrite (BiFeO3) thin film and extract a period of about 70 nanometres, consistent with values determined by macroscopic diffraction. In addition, we take advantage of the magnetoelectric coupling present in BiFeO3 to manipulate the cycloid propagation direction by an electric field. Besides highlighting the potential of nitrogen-vacancy magnetometry for imaging complex antiferromagnetic orders at the nanoscale, these results demonstrate how BiFeO3 can be used in the design of reconfigurable nanoscale spin textures.

  2. Real-space imaging of non-collinear antiferromagnetic order with a single-spin magnetometer

    NASA Astrophysics Data System (ADS)

    Gross, I.; Akhtar, W.; Garcia, V.; Martínez, L. J.; Chouaieb, S.; Garcia, K.; Carrétéro, C.; Barthélémy, A.; Appel, P.; Maletinsky, P.; Kim, J.-V.; Chauleau, J. Y.; Jaouen, N.; Viret, M.; Bibes, M.; Fusil, S.; Jacques, V.

    2017-09-01

    Although ferromagnets have many applications, their large magnetization and the resulting energy cost for switching magnetic moments bring into question their suitability for reliable low-power spintronic devices. Non-collinear antiferromagnetic systems do not suffer from this problem, and often have extra functionalities: non-collinear spin order may break space-inversion symmetry and thus allow electric-field control of magnetism, or may produce emergent spin–orbit effects that enable efficient spin–charge interconversion. To harness these traits for next-generation spintronics, the nanoscale control and imaging capabilities that are now routine for ferromagnets must be developed for antiferromagnetic systems. Here, using a non-invasive, scanning single-spin magnetometer based on a nitrogen–vacancy defect in diamond, we demonstrate real-space visualization of non-collinear antiferromagnetic order in a magnetic thin film at room temperature. We image the spin cycloid of a multiferroic bismuth ferrite (BiFeO3) thin film and extract a period of about 70 nanometres, consistent with values determined by macroscopic diffraction. In addition, we take advantage of the magnetoelectric coupling present in BiFeO3 to manipulate the cycloid propagation direction by an electric field. Besides highlighting the potential of nitrogen–vacancy magnetometry for imaging complex antiferromagnetic orders at the nanoscale, these results demonstrate how BiFeO3 can be used in the design of reconfigurable nanoscale spin textures.

  3. Stochastic, real-space, imaginary-time evaluation of third-order Feynman–Goldstone diagrams

    SciTech Connect

    Willow, Soohaeng Yoo; Hirata, So

    2014-01-14

    A new, alternative set of interpretation rules of Feynman–Goldstone diagrams for many-body perturbation theory is proposed, which translates diagrams into algebraic expressions suitable for direct Monte Carlo integrations. A vertex of a diagram is associated with a Coulomb interaction (rather than a two-electron integral) and an edge with the trace of a Green's function in real space and imaginary time. With these, 12 diagrams of third-order many-body perturbation (MP3) theory are converted into 20-dimensional integrals, which are then evaluated by a Monte Carlo method. It uses redundant walkers for convergence acceleration and a weight function for importance sampling in conjunction with the Metropolis algorithm. The resulting Monte Carlo MP3 method has low-rank polynomial size dependence of the operation cost, a negligible memory cost, and a naturally parallel computational kernel, while reproducing the correct correlation energies of small molecules within a few mE{sub h} after 10{sup 6} Monte Carlo steps.

  4. Stochastic, real-space, imaginary-time evaluation of third-order Feynman-Goldstone diagrams

    NASA Astrophysics Data System (ADS)

    Willow, Soohaeng Yoo; Hirata, So

    2014-01-01

    A new, alternative set of interpretation rules of Feynman-Goldstone diagrams for many-body perturbation theory is proposed, which translates diagrams into algebraic expressions suitable for direct Monte Carlo integrations. A vertex of a diagram is associated with a Coulomb interaction (rather than a two-electron integral) and an edge with the trace of a Green's function in real space and imaginary time. With these, 12 diagrams of third-order many-body perturbation (MP3) theory are converted into 20-dimensional integrals, which are then evaluated by a Monte Carlo method. It uses redundant walkers for convergence acceleration and a weight function for importance sampling in conjunction with the Metropolis algorithm. The resulting Monte Carlo MP3 method has low-rank polynomial size dependence of the operation cost, a negligible memory cost, and a naturally parallel computational kernel, while reproducing the correct correlation energies of small molecules within a few mEh after 106 Monte Carlo steps.

  5. Stochastic, real-space, imaginary-time evaluation of third-order Feynman-Goldstone diagrams.

    PubMed

    Willow, Soohaeng Yoo; Hirata, So

    2014-01-14

    A new, alternative set of interpretation rules of Feynman-Goldstone diagrams for many-body perturbation theory is proposed, which translates diagrams into algebraic expressions suitable for direct Monte Carlo integrations. A vertex of a diagram is associated with a Coulomb interaction (rather than a two-electron integral) and an edge with the trace of a Green's function in real space and imaginary time. With these, 12 diagrams of third-order many-body perturbation (MP3) theory are converted into 20-dimensional integrals, which are then evaluated by a Monte Carlo method. It uses redundant walkers for convergence acceleration and a weight function for importance sampling in conjunction with the Metropolis algorithm. The resulting Monte Carlo MP3 method has low-rank polynomial size dependence of the operation cost, a negligible memory cost, and a naturally parallel computational kernel, while reproducing the correct correlation energies of small molecules within a few mEh after 10(6) Monte Carlo steps.

  6. Real-space pseudopotential method for computing the vibrational Stark effect.

    PubMed

    Garrett, Benjamin F; Azuri, Ido; Kronik, Leeor; Chelikowsky, James R

    2016-11-07

    The vibrational Stark shift is an important effect in determining the electrostatic environment for molecular or condensed matter systems. However, accurate ab initio calculations of the vibrational Stark effect are a technically demanding challenge. We make use of density functional theory constructed on a real-space grid to expedite the computation of this effect. Our format is especially advantageous for the investigation of small molecules in finite fields as cluster boundary conditions eliminate spurious supercell interactions and allow for charged systems, while convergence is controlled by a single parameter, the grid spacing. The Stark tuning rate is highly sensitive to the interaction between anharmonicity in a vibrational mode and the applied field. To ensure this subtle interaction is fully captured, we apply three parallel approaches: a direct finite field, a perturbative method, and a molecular dynamics method. We illustrate this method by applying it to several small molecules containing C-O and C-N bonds and show that a consistent result can be obtained.

  7. Direct Observational Assessment during Test Sessions and Child Clinical Interviews

    ERIC Educational Resources Information Center

    McConaughy, Stephanie H.

    2005-01-01

    Test sessions and child clinical interviews offer opportunities for direct observations of children's behavior in controlled settings. Moreover, standardized instruments for test session and interview observations offer more reliable and valid assessment methods than do anecdotal reports. This article reviews characteristics and psychometric…

  8. Plasmon Surface Polariton Dispersion by Direct Optical Observation.

    ERIC Educational Resources Information Center

    Swalen, J. D.; And Others

    1980-01-01

    Describes several simple experiments that can be used to observe directly the dispersion curve of plasmon surface polaritons (PSP) on flat metal surfaces. A method is described of observing the increonental change in the wave vector of the PSP due to coatings that differ in thickness by a few nanometers. (Author/CS)

  9. Plasmon Surface Polariton Dispersion by Direct Optical Observation.

    ERIC Educational Resources Information Center

    Swalen, J. D.; And Others

    1980-01-01

    Describes several simple experiments that can be used to observe directly the dispersion curve of plasmon surface polaritons (PSP) on flat metal surfaces. A method is described of observing the increonental change in the wave vector of the PSP due to coatings that differ in thickness by a few nanometers. (Author/CS)

  10. Interdisciplinary direct observation: impact on precepting, residents, and faculty.

    PubMed

    Ross, Valerie; Mauksch, Larry; Huntington, Jane; Beard, J Mark

    2012-05-01

    Direct observation of residents for training and assessment is a core recommendation in medical education policy initiatives. Limited research exists about the impact of direct observation on precepting, and we are unaware of any research examining the impact of interdisciplinary precepting on trainees or preceptors. Over the past 3 years we have implemented an Interdisciplinary Direct Observation Precepting Model (IDOPM). Residents are directly observed via closed-circuit television by a behavioral scientist and family physician team. Surveys and focus groups were used to examine the impact of the IDOPM. Authors analyzed survey responses and focus group transcripts using an immersion/crystallization approach to arrive at themes. Between February and June 2009, 24 residents, 14 physician faculty, and eight behavioral science faculty members participated in 19 IDOPM clinics. Eighty-two percent of residents and 95% of faculty responded to surveys. Key findings were (1) Residents and faculty report addressing topics that are not usually discussed in traditional precepting, including communication skills, time management, electronic medical record use, responding to emotional complexity, and physical exam skills, (2) The model reinforced a biopsychosocial approach to care, (3) Residents report ambivalent feelings about being observed, and (4) Faculty value the team approach to strengthen training and promote faculty development. The IDOPM addresses many core skills that are overlooked in traditional precepting encounters. Interdisciplinary direct observation may strengthen faculty ability to provide formative competency assessment in preparing residents to work in the complex world of primary care.

  11. First-principles transport calculation method based on real-space finite-difference nonequilibrium Green's function scheme

    NASA Astrophysics Data System (ADS)

    Ono, Tomoya; Egami, Yoshiyuki; Hirose, Kikuji

    2012-11-01

    We demonstrate an efficient nonequilibrium Green's function transport calculation procedure based on the real-space finite-difference method. The direct inversion of matrices for obtaining the self-energy terms of electrodes is computationally demanding in the real-space method because the matrix dimension corresponds to the number of grid points in the unit cell of electrodes, which is much larger than that of sites in the tight-binding approach. The procedure using the ratio matrices of the overbridging boundary-matching technique [Y. Fujimoto and K. Hirose, Phys. Rev. BPRBMDO1098-012110.1103/PhysRevB.67.195315 67, 195315 (2003)], which is related to the wave functions of a couple of grid planes in the matching regions, greatly reduces the computational effort to calculate self-energy terms without losing mathematical strictness. In addition, the present procedure saves computational time to obtain the Green's function of the semi-infinite system required in the Landauer-Büttiker formula. Moreover, the compact expression to relate Green's functions and scattering wave functions, which provide a real-space picture of the scattering process, is introduced. An example of the calculated results is given for the transport property of the BN ring connected to (9,0) carbon nanotubes. The wave-function matching at the interface reveals that the rotational symmetry of wave functions with respect to the tube axis plays an important role in electron transport. Since the states coming from and going to electrodes show threefold rotational symmetry, the states in the vicinity of the Fermi level, the wave function of which exhibits fivefold symmetry, do not contribute to the electron transport through the BN ring.

  12. Direct observation of isolated Damon-Eshbach and backward volume spin-wave packets in ferromagnetic microstripes.

    PubMed

    Wessels, Philipp; Vogel, Andreas; Tödt, Jan-Niklas; Wieland, Marek; Meier, Guido; Drescher, Markus

    2016-02-24

    The analysis of isolated spin-wave packets is crucial for the understanding of magnetic transport phenomena and is particularly interesting for applications in spintronic and magnonic devices, where isolated spin-wave packets implement an information processing scheme with negligible residual heat loss. We have captured microscale magnetization dynamics of single spin-wave packets in metallic ferromagnets in space and time. Using an optically driven high-current picosecond pulse source in combination with time-resolved scanning Kerr microscopy probed by femtosecond laser pulses, we demonstrate phase-sensitive real-space observation of spin-wave packets in confined permalloy (Ni80Fe20) microstripes. Impulsive excitation permits extraction of the dynamical parameters, i.e. phase- and group velocities, frequencies and wave vectors. In addition to well-established Damon-Eshbach modes our study reveals waves with counterpropagating group- and phase-velocities. Such unusual spin-wave motion is expected for backward volume modes where the phase fronts approach the excitation volume rather than emerging out of it due to the negative slope of the dispersion relation. These modes are difficult to excite and observe directly but feature analogies to negative refractive index materials, thus enabling model studies of wave propagation inside metamaterials.

  13. Direct observation of isolated Damon-Eshbach and backward volume spin-wave packets in ferromagnetic microstripes

    NASA Astrophysics Data System (ADS)

    Wessels, Philipp; Vogel, Andreas; Tödt, Jan-Niklas; Wieland, Marek; Meier, Guido; Drescher, Markus

    2016-02-01

    The analysis of isolated spin-wave packets is crucial for the understanding of magnetic transport phenomena and is particularly interesting for applications in spintronic and magnonic devices, where isolated spin-wave packets implement an information processing scheme with negligible residual heat loss. We have captured microscale magnetization dynamics of single spin-wave packets in metallic ferromagnets in space and time. Using an optically driven high-current picosecond pulse source in combination with time-resolved scanning Kerr microscopy probed by femtosecond laser pulses, we demonstrate phase-sensitive real-space observation of spin-wave packets in confined permalloy (Ni80Fe20) microstripes. Impulsive excitation permits extraction of the dynamical parameters, i.e. phase- and group velocities, frequencies and wave vectors. In addition to well-established Damon-Eshbach modes our study reveals waves with counterpropagating group- and phase-velocities. Such unusual spin-wave motion is expected for backward volume modes where the phase fronts approach the excitation volume rather than emerging out of it due to the negative slope of the dispersion relation. These modes are difficult to excite and observe directly but feature analogies to negative refractive index materials, thus enabling model studies of wave propagation inside metamaterials.

  14. Direct observation of isolated Damon-Eshbach and backward volume spin-wave packets in ferromagnetic microstripes

    PubMed Central

    Wessels, Philipp; Vogel, Andreas; Tödt, Jan-Niklas; Wieland, Marek; Meier, Guido; Drescher, Markus

    2016-01-01

    The analysis of isolated spin-wave packets is crucial for the understanding of magnetic transport phenomena and is particularly interesting for applications in spintronic and magnonic devices, where isolated spin-wave packets implement an information processing scheme with negligible residual heat loss. We have captured microscale magnetization dynamics of single spin-wave packets in metallic ferromagnets in space and time. Using an optically driven high-current picosecond pulse source in combination with time-resolved scanning Kerr microscopy probed by femtosecond laser pulses, we demonstrate phase-sensitive real-space observation of spin-wave packets in confined permalloy (Ni80Fe20) microstripes. Impulsive excitation permits extraction of the dynamical parameters, i.e. phase- and group velocities, frequencies and wave vectors. In addition to well-established Damon-Eshbach modes our study reveals waves with counterpropagating group- and phase-velocities. Such unusual spin-wave motion is expected for backward volume modes where the phase fronts approach the excitation volume rather than emerging out of it due to the negative slope of the dispersion relation. These modes are difficult to excite and observe directly but feature analogies to negative refractive index materials, thus enabling model studies of wave propagation inside metamaterials. PMID:26906113

  15. Direct observation of polyelectrolyte brushes under wet and dry conditions by atmospheric scanning electron microscopy.

    PubMed

    Higuchi, Takeshi; Konyuba, Yuji; Nishiyama, Hidetoshi; Suga, Mitsuo; Takahara, Atsushi; Jinnai, Hiroshi

    2016-04-01

    Polyelectrolyte brushes are polyelectrolyte polymers with one end fixed to a substrate. In this study, direct nano-scale visualization of polyelectrolyte brushes was carried out under 'aqueous conditions' by atmospheric scanning electron microscopy. The thickness of the polyelectrolyte brush layer was measured under both dry and aqueous conditions, experimentally confirming the swollen state of the brushes. These experimental findings qualitatively agreed with the results from previous neutron reflectivity experiments using similar polyelectrolyte brushes. Such direct visualization of polymer brushes in real space opens up a new route for better understanding their surface properties, such as friction, adhesion and wettability. © The Author 2015. Published by Oxford University Press on behalf of The Japanese Society of Microscopy. All rights reserved. For permissions, please e-mail: journals.permissions@oup.com.

  16. Comparisons of some parametrizations of wind direction variability with observations

    NASA Astrophysics Data System (ADS)

    Davies, Belinda M.; Thomson, David J.

    An understanding of wind direction variability is important in predicting the dispersion of pollutants in the atmosphere. Parametrizations of wind direction variability over different time scales are compared with turbulence observations made at the Meteorological Research Unit (MRU) at Cardington. Observations of the variability averaged over one hour in stable conditions are compared with the parametrizations proposed by Hanna and by Joffre and Laurila for light winds and show broad agreement with these parametrizations. The formula proposed by Hanna, suitably matched to a similarity approach at strong winds, can be recommended for general use. The direction variability over longer time periods (up to 12 h) has also been investigated. Results show only a weak dependence on averaging time with the wind direction variability roughly proportional to averaging time to the power 1/4.

  17. Real-Space Imaging of the Atomic Structure of Organic-Inorganic Perovskite.

    PubMed

    Ohmann, Robin; Ono, Luis K; Kim, Hui-Seon; Lin, Haiping; Lee, Michael V; Li, Youyong; Park, Nam-Gyu; Qi, Yabing

    2015-12-30

    Organic-inorganic perovskite is a promising class of materials for photovoltaic applications and light emitting diodes. However, so far commercialization is still impeded by several drawbacks. Atomic-scale effects have been suggested to be possible causes, but an unequivocal experimental view at the atomic level is missing. Here, we present a low-temperature scanning tunneling microscopy study of single crystal methylammonium lead bromide CH3NH3PbBr3. Topographic images of the in situ cleaved perovskite surface reveal the real-space atomic structure. Compared to the bulk we observe modified arrangements of atoms and molecules on the surface. With the support of density functional theory we explain these by surface reconstruction and a substantial interplay of the orientation of the polar organic cations (CH3NH3)(+) with the position of the hosting anions. This leads to structurally and electronically distinct domains with ferroelectric and antiferroelectric character. We further demonstrate local probing of defects, which may also impact device performance.

  18. Real-space evidence of the equilibrium ordered bicontinuous double diamond structure of a diblock copolymer.

    PubMed

    Chu, C Y; Jiang, X; Jinnai, H; Pei, R Y; Lin, W F; Tsai, J C; Chen, H L

    2015-03-14

    The ordered bicontinuous double diamond (OBDD) structure has long been believed to be an unstable ordered network nanostructure, which is relative to the ordered bicontinuous double gyroid (OBDG) structure for diblock copolymers. Using electron tomography, we present the first real-space observation of the thermodynamically stable OBDD structure in a diblock copolymer composed of a stereoregular block, syndiotactic polypropylene-block-polystyrene (sPP-b-PS), in which the sPP tetrapods are interconnected via a bicontinuous network with Pn3̄m symmetry. The OBDD structure underwent a thermally reversible order-order transition (OOT) to OBDG upon heating, and the transition was accompanied with a slight reduction of domain spacing, as demonstrated both experimentally and theoretically. The thermodynamic stability of the OBDD structure was attributed to the ability of the configurationally regular sPP block to form helical segments, even above its melting point, as the reduction of internal energy associated with the helix formation may effectively compensate the greater packing frustration in OBDD relative to that in the tripods of OBDG.

  19. Retinex Image Processing: Improved Fidelity To Direct Visual Observation

    NASA Technical Reports Server (NTRS)

    Jobson, Daniel J.; Rahman, Zia-Ur; Woodell, Glenn A.

    1996-01-01

    Recorded color images differ from direct human viewing by the lack of dynamic range compression and color constancy. Research is summarized which develops the center/surround retinex concept originated by Edwin Land through a single scale design to a multi-scale design with color restoration (MSRCR). The MSRCR synthesizes dynamic range compression, color constancy, and color rendition and, thereby, approaches fidelity to direct observation.

  20. Direct observation of electronic-liquid-crystal phase transitions and their microscopic origin in La1/3Ca2/3MnO3.

    PubMed

    Tao, J; Sun, K; Yin, W-G; Wu, L; Xin, H; Wen, J G; Luo, W; Pennycook, S J; Tranquada, J M; Zhu, Y

    2016-11-22

    The ground-state electronic order in doped manganites is frequently associated with a lattice modulation, contributing to their many interesting properties. However, measuring the thermal evolution of the lattice superstructure with reciprocal-space probes alone can lead to ambiguous results with competing interpretations. Here we provide direct observations of the evolution of the superstructure in La1/3Ca2/3MnO3 in real space, as well as reciprocal space, using transmission electron microscopic (TEM) techniques. We show that the transitions are the consequence of a proliferation of dislocations plus electronic phase separation. The resulting states are well described by the symmetries associated with electronic-liquid-crystal (ELC) phases. Moreover, our results resolve the long-standing controversy over the origin of the incommensurate superstructure and suggest a new structural model that is consistent with recent theoretical calculations.

  1. Direct observation of electronic-liquid-crystal phase transitions and their microscopic origin in La1/3Ca2/3MnO3

    NASA Astrophysics Data System (ADS)

    Tao, J.; Sun, K.; Yin, W.-G.; Wu, L.; Xin, H.; Wen, J. G.; Luo, W.; Pennycook, S. J.; Tranquada, J. M.; Zhu, Y.

    2016-11-01

    The ground-state electronic order in doped manganites is frequently associated with a lattice modulation, contributing to their many interesting properties. However, measuring the thermal evolution of the lattice superstructure with reciprocal-space probes alone can lead to ambiguous results with competing interpretations. Here we provide direct observations of the evolution of the superstructure in La1/3Ca2/3MnO3 in real space, as well as reciprocal space, using transmission electron microscopic (TEM) techniques. We show that the transitions are the consequence of a proliferation of dislocations plus electronic phase separation. The resulting states are well described by the symmetries associated with electronic-liquid-crystal (ELC) phases. Moreover, our results resolve the long-standing controversy over the origin of the incommensurate superstructure and suggest a new structural model that is consistent with recent theoretical calculations.

  2. Direct observation of electronic-liquid-crystal phase transitions and their microscopic origin in La1/3Ca2/3MnO3

    PubMed Central

    Tao, J.; Sun, K.; Yin, W.-G.; Wu, L.; Xin, H.; Wen, J. G.; Luo, W.; Pennycook, S. J.; Tranquada, J. M.; Zhu, Y.

    2016-01-01

    The ground-state electronic order in doped manganites is frequently associated with a lattice modulation, contributing to their many interesting properties. However, measuring the thermal evolution of the lattice superstructure with reciprocal-space probes alone can lead to ambiguous results with competing interpretations. Here we provide direct observations of the evolution of the superstructure in La1/3Ca2/3MnO3 in real space, as well as reciprocal space, using transmission electron microscopic (TEM) techniques. We show that the transitions are the consequence of a proliferation of dislocations plus electronic phase separation. The resulting states are well described by the symmetries associated with electronic-liquid-crystal (ELC) phases. Moreover, our results resolve the long-standing controversy over the origin of the incommensurate superstructure and suggest a new structural model that is consistent with recent theoretical calculations. PMID:27874069

  3. Direct observation of electronic-liquid-crystal phase transitions and their microscopic origin in La1/3Ca2/3MnO3

    DOE PAGES

    Tao, J.; Sun, K.; Yin, W. -G.; ...

    2016-11-22

    The ground-state electronic order in doped manganites is frequently associated with a lattice modulation, contributing to their many interesting properties. However, measuring the thermal evolution of the lattice superstructure with reciprocal-space probes alone can lead to ambiguous results with competing interpretations. Here, we provide direct observations of the evolution of the superstructure in La1/3Ca2/3MnO3 in real space, as well as reciprocal space, using transmission electron microscopic (TEM) techniques. We show that the transitions are the consequence of a proliferation of dislocations plus electronic phase separation. The resulting states are well described by the symmetries associated with electronic-liquid-crystal (ELC) phases. Furthermore,more » our results resolve the long-standing controversy over the origin of the incommensurate superstructure and suggest a new structural model that is consistent with recent theoretical calculations.« less

  4. Ensemble Monte Carlo simulation of velocity modulation transistors (VMT) and real space transfer (NERFET, CHINT) devices

    NASA Astrophysics Data System (ADS)

    Kizilyalli, Isik C.; Hess, Karl

    Numerical simulation of velocity-modulation field effect transistors and real-space transfer transistors are presented. Using self-consistent particle-field Monte Carlo analyses, we assess possible advantages of these novel device structures with respect to their switching speed. Our study shows that current switching can be achieved by the velocity modulation concept. The simulations performed for real space transfer devices are in agreement with experiments and reproduce all prominent features of real space transfer structures such as, negative differential resistance, saturation of drain and substrate (injection) current at high source-to-drain voltages, and the negative transconductance ( {Δ I D,sat}/{Δ V sub<0 }) in the saturated drain current.

  5. Incorporation of an Adaptive Real Space Grid in the Projector Augmented Wave Method

    NASA Astrophysics Data System (ADS)

    Tackett, A. R.; Dunning, R. B.; Matthews, G. Eric; Holzwarth, N. A. W.

    1997-03-01

    We report initial efforts to incorporate a real space adaptive grid into the projector augmented wave (PAW) method developed by Blöchl(P. Blöchl, Phys. Rev. B50,17953 (1994).). The PAW method allows straightforward treatment of valence electrons while offering computational efficiency similar to pseudopotential methods. Real space adaptive grid methods have been shown to improve speed and decrease storage requirements. The adaptive grid also allows an effective increased plane wave energy cutoff in the vicinity of the ions. In this work, we use a real space adapative grid to solve for the potential, while using a transformed plane wave basis for the wavefunctions, as described by Gygi(F. Gygi, Europhysics Letters 19, 617 (1992).).

  6. Direct observation of Barkhausen avalanche in Co thin films.

    PubMed

    Kim, Dong-Hyun; Choe, Sug-Bong; Shin, Sung-Chul

    2003-02-28

    We report direct full-field magneto-optical observations of Barkhausen avalanches in Co polycrystalline thin films at criticality. We provide experimental evidence for the validity of a phenomenological model of the Barkhausen avalanche originally proposed by Cizeau, Zapperi, Durin, and Stanley [Phys. Rev. Lett. 79, 4669 (1997)

  7. Simulated imaging of intermolecular bonds using high throughput real-space density functional calculations

    NASA Astrophysics Data System (ADS)

    Lee, Alex; Kim, Minjung; Chelikowsky, James

    2015-03-01

    Recent experimental noncontact atomic force microscopy (AFM) studies on 8-hydroxyquinoline (8-hq) assemblies have imaged distinct lines between molecules that are thought to represent intermolecular bonding. To aid the interpretation of these images, we calculate simulated AFM images of an 8-hq dimer with a CO functionalized tip using a real-space pseudopotential formalism. We examine the effects of Pauli repulsion and tip probe relaxation as explanations for the enhanced resolution that resolves these intermolecular force lines. Our study aims to compute ab initio real-space images of intermolecular interactions.

  8. Direct observation of OH production from the ozonolysis of olefins

    NASA Astrophysics Data System (ADS)

    Donahue, Neil M.; Kroll, Jesse H.; Anderson, James G.; Demerjian, Kenneth L.

    Ozone olefin reactions may be a significant source of OH in the urban atmosphere, but current evidence for OH production is indirect and contested. We report the first direct observation of OH radicals from the reaction of ozone with a series of olefins (ethene, isoprene, trans-2-butene and 2,3 dimethyl-2-butene) in 4-6 torr of nitrogen. Using LIF to directly observe the steady-state of OH produced by the initial ozone-olefin reaction and subsequently destroyed by the OH-olefin reaction, we are able to establish OH yields broadly consistent with indirect values. The identification of the OH is unequivocal, and there is no indication that it is produced by a secondary process. To support these observations, we present a complete ab-initio potential energy surface for the O3-ethene reaction, extending from the reactants to available products.

  9. New Directions: Emerging Satellite Observations of Above-cloud Aerosols and Direct Radiative Forcing

    NASA Technical Reports Server (NTRS)

    Yu, Hongbin; Zhang, Zhibo

    2013-01-01

    Spaceborne lidar and passive sensors with multi-wavelength and polarization capabilities onboard the A-Train provide unprecedented opportunities of observing above-cloud aerosols and direct radiative forcing. Significant progress has been made in recent years in exploring these new aerosol remote sensing capabilities and generating unique datasets. The emerging observations will advance the understanding of aerosol climate forcing.

  10. Kohn-Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space.

    PubMed

    Flick, Johannes; Ruggenthaler, Michael; Appel, Heiko; Rubio, Angel

    2015-12-15

    The density-functional approach to quantum electrodynamics extends traditional density-functional theory and opens the possibility to describe electron-photon interactions in terms of effective Kohn-Sham potentials. In this work, we numerically construct the exact electron-photon Kohn-Sham potentials for a prototype system that consists of a trapped electron coupled to a quantized electromagnetic mode in an optical high-Q cavity. Although the effective current that acts on the photons is known explicitly, the exact effective potential that describes the forces exerted by the photons on the electrons is obtained from a fixed-point inversion scheme. This procedure allows us to uncover important beyond-mean-field features of the effective potential that mark the breakdown of classical light-matter interactions. We observe peak and step structures in the effective potentials, which can be attributed solely to the quantum nature of light; i.e., they are real-space signatures of the photons. Our findings show how the ubiquitous dipole interaction with a classical electromagnetic field has to be modified in real space to take the quantum nature of the electromagnetic field fully into account.

  11. Kohn–Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space

    PubMed Central

    Flick, Johannes; Ruggenthaler, Michael; Appel, Heiko; Rubio, Angel

    2015-01-01

    The density-functional approach to quantum electrodynamics extends traditional density-functional theory and opens the possibility to describe electron–photon interactions in terms of effective Kohn–Sham potentials. In this work, we numerically construct the exact electron–photon Kohn–Sham potentials for a prototype system that consists of a trapped electron coupled to a quantized electromagnetic mode in an optical high-Q cavity. Although the effective current that acts on the photons is known explicitly, the exact effective potential that describes the forces exerted by the photons on the electrons is obtained from a fixed-point inversion scheme. This procedure allows us to uncover important beyond-mean-field features of the effective potential that mark the breakdown of classical light–matter interactions. We observe peak and step structures in the effective potentials, which can be attributed solely to the quantum nature of light; i.e., they are real-space signatures of the photons. Our findings show how the ubiquitous dipole interaction with a classical electromagnetic field has to be modified in real space to take the quantum nature of the electromagnetic field fully into account. PMID:26627715

  12. Real-space renormalization group flow in quantum impurity systems: Local moment formation and the Kondo screening cloud

    NASA Astrophysics Data System (ADS)

    Mitchell, Andrew K.; Becker, Michael; Bulla, Ralf

    2011-09-01

    The existence of a length scale ξK˜1/TK (with TK the Kondo temperature) has long been predicted in quantum impurity systems. At low temperatures T≪TK, the standard interpretation is that a spin-(1)/(2) impurity is screened by a surrounding “Kondo cloud” of spatial extent ξK. We argue that renormalization group (RG) flow between any two fixed points (FPs) results in a characteristic length scale, observed in real space as a crossover between physical behavior typical of each FP. In the simplest example of the Anderson impurity model, three FPs arise, and we show that “free orbital,” “local moment,” and “strong coupling” regions of space can be identified at zero temperature. These regions are separated by two crossover length scales ξLM and ξK, with the latter diverging as the Kondo effect is destroyed on increasing temperature through TK. One implication is that moment formation occurs inside the “Kondo cloud”, while the screening process itself occurs on flowing to the strong coupling FP at distances ˜ξK. Generic aspects of the real-space physics are exemplified by the two-channel Kondo model, where ξK now separates local moment and overscreening clouds.

  13. Survival of Bacillus pumilus spores for a prolonged period of time in real space conditions.

    PubMed

    Vaishampayan, Parag A; Rabbow, Elke; Horneck, Gerda; Venkateswaran, Kasthuri J

    2012-05-01

    To prevent forward contamination and maintain the scientific integrity of future life-detection missions, it is important to characterize and attempt to eliminate terrestrial microorganisms associated with exploratory spacecraft and landing vehicles. Among the organisms isolated from spacecraft-associated surfaces, spores of Bacillus pumilus SAFR-032 exhibited unusually high resistance to decontamination techniques such as UV radiation and peroxide treatment. Subsequently, B. pumilus SAFR-032 was flown to the International Space Station (ISS) and exposed to a variety of space conditions via the European Technology Exposure Facility (EuTEF). After 18 months of exposure in the EXPOSE facility of the European Space Agency (ESA) on EuTEF under dark space conditions, SAFR-032 spores showed 10-40% survivability, whereas a survival rate of 85-100% was observed when these spores were kept aboard the ISS under dark simulated martian atmospheric conditions. In contrast, when UV (>110 nm) was applied on SAFR-032 spores for the same time period and under the same conditions used in EXPOSE, a ∼7-log reduction in viability was observed. A parallel experiment was conducted on Earth with identical samples under simulated space conditions. Spores exposed to ground simulations showed less of a reduction in viability when compared with the "real space" exposed spores (∼3-log reduction in viability for "UV-Mars," and ∼4-log reduction in viability for "UV-Space"). A comparative proteomics analysis indicated that proteins conferring resistant traits (superoxide dismutase) were present in higher concentration in space-exposed spores when compared to controls. Also, the first-generation cells and spores derived from space-exposed samples exhibited elevated UVC resistance when compared with their ground control counterparts. The data generated are important for calculating the probability and mechanisms of microbial survival in space conditions and assessing microbial contaminants

  14. Direct Observation of Thymine Dimer Repair in DNA by Photolyase

    NASA Astrophysics Data System (ADS)

    Zhong, Dongping

    2006-03-01

    Departments of Physics, Chemistry, and Biochemistry, Programs of Biophysics, Chemical Physics, and Biochemistry, The Ohio State University, Columbus, 191 West Woodruff Avenue, OH 43210. Photolyase uses light energy to split ultraviolet-induced cyclobutane pyrimidine dimers in damaged DNA, but its molecular mechanism has never been directly revealed. We report here the direct mapping of catalytic processes through femtosecond synchronization of the enzymatic dynamics with the repair function. We observed direct electron transfer from the excited flavin cofactor to the dimer in 170 ps and back electron transfer from the repaired thymines in 560 ps. Both reactions are strongly modulated by active-site solvation to achieve maximum repair efficiency. These results show that the photocycle of DNA repair by photolyase is through a radical mechanism and completed on subnanosecond time scale at the dynamic active site with no net electron change in redox states of the flavin cofactor.

  15. Direct observation of amyloid nucleation under nanomechanical stretching

    NASA Astrophysics Data System (ADS)

    Varongchayakul, Nitinun

    Self-assembly of amyloid nanofiber is associated with functional and pathological processes such as in neurodegenerative diseases. Despite intensive studies, stochastic nature of the process has made it difficult to elucidate molecular mechanisms for the key amyloid nucleation. Here, we investigated the amyloid nucleation of silk-elastin-like peptide (SELP) using time-lapse lateral force microscopy (LFM). By repeated scanning a single line on a SELP-coated mica surface, we observed sudden stepwise height increases, corresponds to nucleation of an amyloid fiber. The lateral force profiles followed either a worm-like chain model or an exponential function, suggesting that the atomic force microscopy (AFM) tip stretches a single or multiple SELP molecules along the scanning direction, serves as the template for further self-assembly perpendicular to the scan direction. Such mechanically induced nucleation of amyloid fibrils allows positional and directional control of amyloid assembly in vitro , which we demonstrate by generating single nanofibers at predetermined nucleation sites.

  16. Comparison of variational real-space representations of the kinetic energy operator

    NASA Astrophysics Data System (ADS)

    Skylaris, Chris-Kriton; Diéguez, Oswaldo; Haynes, Peter D.; Payne, Mike C.

    2002-08-01

    We present a comparison of real-space methods based on regular grids for electronic structure calculations that are designed to have basis set variational properties, using as a reference the conventional method of finite differences (a real-space method that is not variational) and the reciprocal-space plane-wave method which is fully variational. We find that a definition of the finite-difference method [P. Maragakis, J. Soler, and E. Kaxiras, Phys. Rev. B 64, 193101 (2001)] satisfies one of the two properties of variational behavior at the cost of larger errors than the conventional finite-difference method. On the other hand, a technique which represents functions in a number of plane waves which is independent of system size closely follows the plane-wave method and therefore also the criteria for variational behavior. Its application is only limited by the requirement of having functions strictly localized in regions of real space, but this is a characteristic of an increasing number of modern real-space methods, as they are designed to have a computational cost that scales linearly with system size.

  17. Multipole-preserving quadratures for the discretization of functions in real-space electronic structure calculations.

    PubMed

    Genovese, Luigi; Deutsch, Thierry

    2015-12-21

    Discretizing an analytic function on a uniform real-space grid is often done via a straightforward collocation method. This is ubiquitous in all areas of computational physics and quantum chemistry. An example in density functional theory (DFT) is given by the external potential or the pseudo-potential describing the interaction between ions and electrons. The accuracy of the collocation method used is therefore very important for the reliability of subsequent treatments like self-consistent field solutions of the electronic structure problems. By construction, the collocation method introduces numerical artifacts typical of real-space treatments, like the so-called egg-box error, which may spoil the numerical stability of the description when the real-space grid is too coarse. As the external potential is an input of the problem, even a highly precise computational treatment cannot cope this inconvenience. We present in this paper a new quadrature scheme that is able to exactly preserve the moments of a given analytic function even for large grid spacings, while reconciling with the traditional collocation method when the grid spacing is small enough. In the context of real-space electronic structure calculations, we show that this method improves considerably the stability of the results for large grid spacings, opening up the path towards reliable low-accuracy DFT calculations with a reduced number of degrees of freedom.

  18. Real-space renormalization-group approach to field evolution equations.

    PubMed

    Degenhard, Andreas; Rodríguez-Laguna, Javier

    2002-03-01

    An operator formalism for the reduction of degrees of freedom in the evolution of discrete partial differential equations (PDE) via real-space renormalization group is introduced, in which cell overlapping is the key concept. Applications to (1+1)-dimensional PDEs are presented for linear and quadratic equations that are first order in time.

  19. Directly observed therapy for tuberculosis: the Harlem Hospital experience, 1993.

    PubMed Central

    el-Sadr, W; Medard, F; Berthaud, V; Barthaud, V

    1996-01-01

    OBJECTIVES. A directly observed therapy program was established at Harlem Hospital, New York, NY, in 1993 to promote high tuberculosis treatment completion rates. METHODS. The Harlem program used an on-site surrogate family model. Treatment completion rate, visit adherence rate, human immuno-deficiency virus seroprevalence, and time to sputum culture conversion were assessed. RESULTS. Out of 145 enrolled patients with suspected and confirmed tuberculosis, 95 (92 confirmed and 3 suspected) continued treatment. The visit adherence rate was 91.1 +/- 7.9%, with one patient (1%) lost to follow-up. CONCLUSION. High rates of treatment completion and visit adherence were achieved because of unique program characteristics. Thus, directly observed therapy is advocated as a means of ensuring treatment completion. PMID:8712276

  20. Molecular oxygen observed by direct photoproduction from carbon dioxide

    NASA Astrophysics Data System (ADS)

    Larimian, Seyedreza; Erattupuzha, Sonia; Mai, Sebastian; Marquetand, Philipp; González, Leticia; Baltuška, Andrius; Kitzler, Markus; Xie, Xinhua

    2017-01-01

    We report experiments on the direct observation of molecular oxygen formation from CO2 in strong laser fields with a reaction microscope. Our accompanying simulations and pump-probe measurements suggest that CO2 molecules undergo bending motion during strong-field ionization which supports the molecular oxygen formation process. The observation of molecular oxygen formation from CO2 may trigger further experimental and theoretical studies on such processes with laser pulses, and provides hints in studies of the O2 and O2+ abundance in CO2-dominated planetary atmospheres.

  1. Direct Observations of the Evolution of Polar Cap Ionization Patches

    NASA Astrophysics Data System (ADS)

    Zhang, Q.; Zhang, B.; Lockwood, M. M.; Hu, H.; Moen, J. I.; Ruohoniemi, J.; Thomas, E. G.; Zhang, S.; Yang, H.; Liu, R.; McWilliams, K. A.; Baker, J. B.

    2013-12-01

    Patches of ionization are common in the polar ionosphere where their motion and associated density gradients give variable disturbances to High Frequency (HF) radio communications, over-the-horizon radar location errors, and disruption and errors to satellite navigation and communication. Their formation and evolution are poorly understood, particularly under disturbed space weather conditions. We report direct observations of the full evolution of patches during a geomagnetic storm, including formation, polar cap entry, transpolar evolution, polar cap exit, and sunward return flow. Our observations show that modulation of nightside reconnection in the substorm cycle of the magnetosphere helps form the gaps between patches where steady convection would give a 'tongue' of ionization (TOI).

  2. Survival of Bacillus pumilus SAFR-032 in simulated Mars atmosphere in real space conditions

    NASA Astrophysics Data System (ADS)

    Vaishampayan, Parag A.; Fox, George E.; Venkateswaran, Kasthuri

    2010-09-01

    To prevent forward contamination and maintain the scientific integrity of future life detection missions, it is important to characterize and attempt to eliminate terrestrial microorganisms associated with exploratory spacecraft and landing vehicles. Among the organisms isolated from spacecraft-associated habitats, spores of Bacillus pumilus SAFR-032 exhibited unusually high resistance to decontamination techniques such as UVradiation and peroxide treatment. Subsequently, Bacillus pumilus SAFR-032 was flown to the International Space Station (ISS) and exposed to a variety of space conditions using the European Technology Exposure Platform and Experiment Facility (EuTEF). After 18 months exposure in the EuTEF facility under dark space conditions, SAFR-032 spores showed 10 to 40% survivability, whereas a survival rate of 85 to 100% was observed when these spores were kept aboard the ISS under dark simulated-Mars atmospheric conditions. In contrast, when UV (>110nm) was exerted on SAFR-032 spores for the same time period and conditions using the EuTEF, a ~7-log reduction in viability was noticed. However, the UV exposure still did not inactivate all the spores as 19 CFUs were later isolated via cultivation. A parallel experiment was conducted on Earth with identical samples but under simulated conditions. Spores exposed to ground simulations showed less of a reduction in viability when compared with the "real space" exposed spores (~3-log reduction in viability for Mars UV, and ~4-log reduction in viability for Space UV). The data generated is important to assess the probability and mechanisms of microbial survival, microbial contaminants of risk for forward contamination, in situ life detection, and to safeguard the integrity of sample return missions.

  3. Real-space investigation of energy transfer in heterogeneous molecular dimers

    NASA Astrophysics Data System (ADS)

    Imada, Hiroshi; Miwa, Kuniyuki; Imai-Imada, Miyabi; Kawahara, Shota; Kimura, Kensuke; Kim, Yousoo

    2016-10-01

    Given its central role in photosynthesis and artificial energy-harvesting devices, energy transfer has been widely studied using optical spectroscopy to monitor excitation dynamics and probe the molecular-level control of energy transfer between coupled molecules. However, the spatial resolution of conventional optical spectroscopy is limited to a few hundred nanometres and thus cannot reveal the nanoscale spatial features associated with such processes. In contrast, scanning tunnelling luminescence spectroscopy has revealed the energy dynamics associated with phenomena ranging from single-molecule electroluminescence, absorption of localized plasmons and quantum interference effects to energy delocalization and intervalley electron scattering with submolecular spatial resolution in real space. Here we apply this technique to individual molecular dimers that comprise a magnesium phthalocyanine and a free-base phthalocyanine (MgPc and H2Pc) and find that locally exciting MgPc with the tunnelling current of the scanning tunnelling microscope generates a luminescence signal from a nearby H2Pc molecule as a result of resonance energy transfer from the former to the latter. A reciprocating resonance energy transfer is observed when exciting the second singlet state (S2) of H2Pc, which results in energy transfer to the first singlet state (S1) of MgPc and final funnelling to the S1 state of H2Pc. We also show that tautomerization of H2Pc changes the energy transfer characteristics within the dimer system, which essentially makes H2Pc a single-molecule energy transfer valve device that manifests itself by blinking resonance energy transfer behaviour.

  4. Real-space investigation of energy transfer in heterogeneous molecular dimers.

    PubMed

    Imada, Hiroshi; Miwa, Kuniyuki; Imai-Imada, Miyabi; Kawahara, Shota; Kimura, Kensuke; Kim, Yousoo

    2016-10-20

    Given its central role in photosynthesis and artificial energy-harvesting devices, energy transfer has been widely studied using optical spectroscopy to monitor excitation dynamics and probe the molecular-level control of energy transfer between coupled molecules. However, the spatial resolution of conventional optical spectroscopy is limited to a few hundred nanometres and thus cannot reveal the nanoscale spatial features associated with such processes. In contrast, scanning tunnelling luminescence spectroscopy has revealed the energy dynamics associated with phenomena ranging from single-molecule electroluminescence, absorption of localized plasmons and quantum interference effects to energy delocalization and intervalley electron scattering with submolecular spatial resolution in real space. Here we apply this technique to individual molecular dimers that comprise a magnesium phthalocyanine and a free-base phthalocyanine (MgPc and H2Pc) and find that locally exciting MgPc with the tunnelling current of the scanning tunnelling microscope generates a luminescence signal from a nearby H2Pc molecule as a result of resonance energy transfer from the former to the latter. A reciprocating resonance energy transfer is observed when exciting the second singlet state (S2) of H2Pc, which results in energy transfer to the first singlet state (S1) of MgPc and final funnelling to the S1 state of H2Pc. We also show that tautomerization of H2Pc changes the energy transfer characteristics within the dimer system, which essentially makes H2Pc a single-molecule energy transfer valve device that manifests itself by blinking resonance energy transfer behaviour.

  5. Incorporating photometric redshift probability density information into real-space clustering measurements

    NASA Astrophysics Data System (ADS)

    Myers, Adam D.; White, Martin; Ball, Nicholas M.

    2009-11-01

    The use of photometric redshifts in cosmology is increasing. Often, however these photo-z are treated like spectroscopic observations, in that the peak of the photometric redshift, rather than the full probability density function (PDF), is used. This overlooks useful information inherent in the full PDF. We introduce a new real-space estimator for one of the most used cosmological statistics, the two-point correlation function, that weights by the PDF of individual photometric objects in a manner that is optimal when Poisson statistics dominate. As our estimator does not bin based on the PDF peak, it substantially enhances the clustering signal by usefully incorporating information from all photometric objects that overlap the redshift bin of interest. As a real-world application, we measure quasi-stellar object (QSO) clustering in the Sloan Digital Sky Survey (SDSS). We find that our simplest binned estimator improves the clustering signal by a factor equivalent to increasing the survey size by a factor of 2-3. We also introduce a new implementation that fully weights between pairs of objects in constructing the cross-correlation and find that this pair-weighted estimator improves clustering signal in a manner equivalent to increasing the survey size by a factor of 4-5. Our technique uses spectroscopic data to anchor the distance scale and it will be particularly useful where spectroscopic data (e.g. from BOSS) overlap deeper photometry (e.g. from Pan-STARRS, DES or the LSST). We additionally provide simple, informative expressions to determine when our estimator will be competitive with the autocorrelation of spectroscopic objects. Although we use QSOs as an example population, our estimator can and should be applied to any clustering estimate that uses photometric objects.

  6. Microcrack closure in rocks under stress - Direct observation

    NASA Technical Reports Server (NTRS)

    Batzle, M. L.; Simmons, G.; Siegfried, R. W.

    1980-01-01

    Direct observations of the closure of microcracks in rocks under increasing stress are reported. Uniaxial stresses up to 300 bars were applied to untreated and previously heated samples of Westerly granite and Frederick diabase by a small hydraulic press which fit entirely within a scanning electron microscope. Crack closure characteristics are found to depend on crack orientation, with cracks perpendicular to the applied stress closing and those parallel tending to open, as well as crack aspect ratio, crack intersection properties, stress concentrations and surface roughness. Uniaxial and hydrostatic stress measurements are found to be strongly dependent on fracture content as observed by SEM, and the observed hysteresis in strain measurements in the first stress cycles is also related to microscopic processes

  7. Microcrack closure in rocks under stress - Direct observation

    NASA Technical Reports Server (NTRS)

    Batzle, M. L.; Simmons, G.; Siegfried, R. W.

    1980-01-01

    Direct observations of the closure of microcracks in rocks under increasing stress are reported. Uniaxial stresses up to 300 bars were applied to untreated and previously heated samples of Westerly granite and Frederick diabase by a small hydraulic press which fit entirely within a scanning electron microscope. Crack closure characteristics are found to depend on crack orientation, with cracks perpendicular to the applied stress closing and those parallel tending to open, as well as crack aspect ratio, crack intersection properties, stress concentrations and surface roughness. Uniaxial and hydrostatic stress measurements are found to be strongly dependent on fracture content as observed by SEM, and the observed hysteresis in strain measurements in the first stress cycles is also related to microscopic processes

  8. Coupled-Cluster in Real Space I: CC2 Ground State Energies using Multi-Resolution Analysis.

    PubMed

    Kottmann, Jakob Siegfried; Bischoff, Florian Andreas

    2017-09-13

    A framework to calculate approximate coupled-cluster CC2 ground-state correlation energies in a multiresolution basis is derived and implemented into the MADNESS library. The CC2 working equations are rederived in first quantization which makes them suitable for real-space methods. The first-quantized equations can be interpreted diagrammatically using the usual diagrams from second quantization with adjusted interpretation rules. Singularities arising form the nuclear and electronic potentials are regularized by explicitly taking the nuclear and electronic cusps into account. The regularized three- and six-dimensional cluster functions are represented directly on a grid. The resulting equations are free of singularities and virtual orbitals, which results into a lower intrinsic scaling of N^3. Correlation energies close to the basis set limit are computed for small molecules. This work is the first step towards CC2 excitation energies in a multiresolution basis.

  9. Direct observation of intermolecular interactions mediated by hydrogen bonding

    SciTech Connect

    De Marco, Luigi; Reppert, Mike; Thämer, Martin; Tokmakoff, Andrei

    2014-07-21

    Although intermolecular interactions are ubiquitous in physicochemical phenomena, their dynamics have proven difficult to observe directly, and most experiments rely on indirect measurements. Using broadband two-dimensional infrared spectroscopy (2DIR), we have measured the influence of hydrogen bonding on the intermolecular vibrational coupling between dimerized N-methylacetamide molecules. In addition to strong intramolecular coupling between N–H and C=O oscillators, cross-peaks in the broadband 2DIR spectrum appearing upon dimerization reveal strong intermolecular coupling that changes the character of the vibrations. In addition, dimerization changes the effects of intramolecular coupling, resulting in Fermi resonances between high and low-frequency modes. These results illustrate how hydrogen bonding influences the interplay of inter- and intramolecular vibrations, giving rise to correlated nuclear motions and significant changes in the vibrational structure of the amide group. These observations have direct impact on modeling and interpreting the IR spectra of proteins. In addition, they illustrate a general approach to direct molecular characterization of intermolecular interactions.

  10. Direct observation of microbial inhibition of calcite dissolution.

    PubMed

    Lüttge, Andreas; Conrad, Pamela G

    2004-03-01

    Vertical scanning interferometry (VSI) provides a method for quantification of surface topography at the angstrom to nanometer level. Time-dependent VSI measurements can be used to study the surface-normal retreat across crystal and other solid surfaces during dissolution or corrosion processes. Therefore, VSI can be used to directly and nondestructively measure mineral dissolution rates with high precision. We have used this method to compare the abiotic dissolution behavior of a representative calcite (CaCO(3)) cleavage face with that observed upon addition of an environmental microbe, Shewanella oneidensis MR-1, to the crystal surface. From our direct observations, we have concluded that the presence of the microbes results in a significant inhibition of the rate of calcite dissolution. This inhibition appears to be a 2nd-order effect that is related to the formation of etch pits. The opening of etch pits was greatly inhibited in the presence of added bacteria, suggesting that the bacterial cells exert their effect by inhibiting the formation of etch pits at high-energy sites at the crystal surface caused by lattice defects, e.g., screw or point dislocations. The experimental methodology thus provides a nondestructive, directly quantifiable, and easily visualized view of the interactions of microbes and minerals during weathering (or corrosion) processes or during mineral precipitation.

  11. Direct Observation of Teacher and Student Behavior in School Settings: Trends, Issues and Future Directions

    ERIC Educational Resources Information Center

    Lewis, Timothy J.; Scott, Terrance M.; Wehby, Joseph H.; Wills, Howard P.

    2014-01-01

    Across the modern history of the field of special education and emotional/behavioral disorders (EBD), direct observation of student and educator behavior has been an essential component of the diagnostic process, student progress monitoring, and establishing functional and statistical relationships within research. This article provides an…

  12. Direct Observation of Teacher and Student Behavior in School Settings: Trends, Issues and Future Directions

    ERIC Educational Resources Information Center

    Lewis, Timothy J.; Scott, Terrance M.; Wehby, Joseph H.; Wills, Howard P.

    2014-01-01

    Across the modern history of the field of special education and emotional/behavioral disorders (EBD), direct observation of student and educator behavior has been an essential component of the diagnostic process, student progress monitoring, and establishing functional and statistical relationships within research. This article provides an…

  13. Direct observation of stepwise movement of a synthetic molecular transporter

    NASA Astrophysics Data System (ADS)

    Wickham, Shelley F. J.; Endo, Masayuki; Katsuda, Yousuke; Hidaka, Kumi; Bath, Jonathan; Sugiyama, Hiroshi; Turberfield, Andrew J.

    2011-03-01

    Controlled motion at the nanoscale can be achieved by using Watson-Crick base-pairing to direct the assembly and operation of a molecular transport system consisting of a track, a motor and fuel, all made from DNA. Here, we assemble a 100-nm-long DNA track on a two-dimensional scaffold, and show that a DNA motor loaded at one end of the track moves autonomously and at a constant average speed along the full length of the track, a journey comprising 16 consecutive steps for the motor. Real-time atomic force microscopy allows direct observation of individual steps of a single motor, revealing mechanistic details of its operation. This precisely controlled, long-range transport could lead to the development of systems that could be programmed and routed by instructions encoded in the nucleotide sequences of the track and motor. Such systems might be used to create molecular assembly lines modelled on the ribosome.

  14. Direct state reconstruction with coupling-deformed pointer observables

    NASA Astrophysics Data System (ADS)

    Zhu, Xuanmin; Zhang, Yu-Xiang; Wu, Shengjun

    2016-06-01

    Direct state tomography (DST) using weak measurements has received wide attention. Based on the concept of coupling-deformed pointer observables presented by Zhang et al. [Y.-X. Zhang, S. Wu, and Z.-B. Chen, Phys. Rev. A 93, 032128 (2016), 10.1103/PhysRevA.93.032128], a modified direct state tomography (MDST) is proposed, examined, and compared with other typical state tomography schemes. MDST has exact validity for measurements of any strength. We identify the strength needed to attain the highest efficiency level of MDST by using statistical theory. MDST is much more efficient than DST in the sense that far fewer samples are needed to reach DST's level of reconstruction accuracy. Moreover, MDST has no inherent bias when compared to DST.

  15. Direct observation of lubricant additives using tomography techniques

    NASA Astrophysics Data System (ADS)

    Chen, Yunyun; Sanchez, Carlos; Parkinson, Dilworth Y.; Liang, Hong

    2016-07-01

    Lubricants play important roles in daily activities such as driving, walking, and cooking. The current understanding of mechanisms of lubrication, particularly in mechanical systems, has been limited by the lack of capability in direct observation. Here, we report an in situ approach to directly observe the motion of additive particles in grease under the influence of shear. Using the K-edge tomography technique, it is possible to detect particular additives in a grease and observe their distribution through 3D visualization. A commercial grease as a reference was studied with and without an inorganic additive of Fe3O4 microparticles. The results showed that it was possible to identify these particles and track their movement. Under a shear stress, Fe3O4 particles were found to adhere to the edge of calcium complex thickeners commonly used in grease. Due to sliding, the grease formed a film with increased density. This approach enables in-line monitoring of a lubricant and future investigation in mechanisms of lubrication.

  16. Direct observation of lubricant additives using tomography techniques

    SciTech Connect

    Chen, Yunyun; Sanchez, Carlos; Parkinson, Dilworth Y.; Liang, Hong

    2016-07-25

    Lubricants play important roles in daily activities such as driving, walking, and cooking. The current understanding of mechanisms of lubrication, particularly in mechanical systems, has been limited by the lack of capability in direct observation. Here, we report an in situ approach to directly observe the motion of additive particles in grease under the influence of shear. Using the K-edge tomography technique, it is possible to detect particular additives in a grease and observe their distribution through 3D visualization. A commercial grease as a reference was studied with and without an inorganic additive of Fe{sub 3}O{sub 4} microparticles. The results showed that it was possible to identify these particles and track their movement. Under a shear stress, Fe{sub 3}O{sub 4} particles were found to adhere to the edge of calcium complex thickeners commonly used in grease. Due to sliding, the grease formed a film with increased density. This approach enables in-line monitoring of a lubricant and future investigation in mechanisms of lubrication.

  17. Direct observation of Kelvin waves excited by quantized vortex reconnection

    PubMed Central

    Fonda, Enrico; Meichle, David P.; Ouellette, Nicholas T.; Hormoz, Sahand; Lathrop, Daniel P.

    2014-01-01

    Quantized vortices are key features of quantum fluids such as superfluid helium and Bose–Einstein condensates. The reconnection of quantized vortices and subsequent emission of Kelvin waves along the vortices are thought to be central to dissipation in such systems. By visualizing the motion of submicron particles dispersed in superfluid 4He, we have directly observed the emission of Kelvin waves from quantized vortex reconnection. We characterize one event in detail, using dimensionless similarity coordinates, and compare it with several theories. Finally, we give evidence for other examples of wavelike behavior in our system. PMID:24704878

  18. Direct observation of resonance scattering patterns in single silicon nanoparticles

    NASA Astrophysics Data System (ADS)

    Valuckas, Vytautas; Paniagua-Domínguez, Ramón; Fu, Yuan Hsing; Luk'yanchuk, Boris; Kuznetsov, Arseniy I.

    2017-02-01

    We present the first direct observation of the scattering patterns of electric and magnetic dipole resonances excited in a single silicon nanosphere. Almost perfectly spherical silicon nanoparticles were fabricated and deposited on a 30 nm-thick silicon nitride membrane in an attempt to minimize particle—substrate interaction. Measurements were carried out at visible wavelengths by means of the Fourier microscopy in a dark-field illumination setup. The obtained back-focal plane images clearly reveal the characteristic scattering patterns associated with each resonance and are found to be in a good agreement with the simulated results.

  19. Direct infrared observation of hydrogen chloride anions in solid argon.

    PubMed

    Huang, Tzu-Ping; Chen, Hui-Fen; Liu, Meng-Chen; Chin, Chih-Hao; Durrant, Marcus C; Lee, Yin-Yu; Wu, Yu-Jong

    2017-09-21

    To facilitate direct spectroscopic observation of hydrogen chloride anions (HCl(-)), electron bombardment of CH3Cl diluted in excess Ar during matrix deposition was used to generate this anion. Subsequent characterization were performed by IR spectroscopy and quantum chemical calculations. Moreover the band intensity of HCl(-) decays slowly when the matrix sample is maintained in the dark for a prolonged time. High-level ab inito calculation suggested that HCl(-) is only weakly bound. Atom-in-molecule charge analysis indicated that both atoms of HCl(-) are negatively charged and the Cl atom is hypervalent.

  20. Direct Observation of Correlated Interdomain Motion in Alcohol Dehydrogenase

    NASA Astrophysics Data System (ADS)

    Biehl, Ralf; Hoffmann, Bernd; Monkenbusch, Michael; Falus, Peter; Préost, Sylvain; Merkel, Rudolf; Richter, Dieter

    2008-09-01

    Interdomain motions in proteins are essential to enable or promote biochemical function. Neutron spin-echo spectroscopy is used to directly observe the domain dynamics of the protein alcohol dehydrogenase. The collective motion of domains as revealed by their coherent form factor relates to the cleft opening dynamics between the binding and the catalytic domains enabling binding and release of the functional important cofactor. The cleft opening mode hardens as a result of an overall stiffening of the domain complex due to the binding of the cofactor.

  1. Direct infrared observation of hydrogen chloride anions in solid argon

    NASA Astrophysics Data System (ADS)

    Huang, Tzu-Ping; Chen, Hui-Fen; Liu, Meng-Chen; Chin, Chih-Hao; Durrant, Marcus C.; Lee, Yin-Yu; Wu, Yu-Jong

    2017-09-01

    To facilitate direct spectroscopic observation of hydrogen chloride anions (HCl-), electron bombardment of CH3Cl diluted in excess Ar during matrix deposition was used to generate this anion. Subsequent characterization were performed by IR spectroscopy and quantum chemical calculations. Moreover the band intensity of HCl- decays slowly when the matrix sample is maintained in the dark for a prolonged time. High-level ab inito calculation suggested that HCl- is only weakly bound. Atom-in-molecule charge analysis indicated that both atoms of HCl- are negatively charged and the Cl atom is hypervalent.

  2. Direct observation of thitherto unobservable quantum phenomena by using electrons.

    PubMed

    Tonomura, Akira

    2005-10-18

    Fundamental aspects of quantum mechanics, which were discussed only theoretically as "thought experiments" in the 1920s and 1930s, have begun to frequently show up in nanoscopic regions owing to recent rapid progress in advanced technologies. Quantum phenomena were once regarded as the ultimate factors limiting further miniaturization trends of microstructured electronic devices, but now they have begun to be actively used as the principles for new devices such as quantum computers. To directly observe what had been unobservable quantum phenomena, we have tried to develop bright and monochromatic electron beams for the last 35 years. Every time the brightness of an electron beam improved, fundamental experiments in quantum mechanics became possible, and quantum phenomena became observable by using the wave nature of electrons.

  3. Direct observations of the evolution of polar cap ionization patches.

    PubMed

    Zhang, Qing-He; Zhang, Bei-Chen; Lockwood, Michael; Hu, Hong-Qiao; Moen, Jøran; Ruohoniemi, J Michael; Thomas, Evan G; Zhang, Shun-Rong; Yang, Hui-Gen; Liu, Rui-Yuan; McWilliams, Kathryn A; Baker, Joseph B H

    2013-03-29

    Patches of ionization are common in the polar ionosphere, where their motion and associated density gradients give variable disturbances to high-frequency (HF) radio communications, over-the-horizon radar location errors, and disruption and errors to satellite navigation and communication. Their formation and evolution are poorly understood, particularly under disturbed space weather conditions. We report direct observations of the full evolution of patches during a geomagnetic storm, including formation, polar cap entry, transpolar evolution, polar cap exit, and sunward return flow. Our observations show that modulation of nightside reconnection in the substorm cycle of the magnetosphere helps form the gaps between patches where steady convection would give a "tongue" of ionization (TOI).

  4. Direct Observations of PMC Local Time Variations by Aura OMI

    NASA Technical Reports Server (NTRS)

    DeLand, Matthew T.; Shettle, Eric P.; Thomas, Gary E.; Olivero, John J.

    2010-01-01

    The Ozone Monitoring Instrument (OMI) on the Aura satellite obtains unique measurements for polar mesospheric cloud (PMC) analysis. Its wide cross-track viewing swath and high along-track spatial resolution makes it possible to directly evaluate PMC occurrence frequency and brightness variations between 6S" and 8S' latitude as a function of local time over a 12-14 h continuous period. OMI PMC local time variations are closely coupled to concurrent variations in measurement scattering angle, so that ice phase function effects must be considered when interpreting the observations. Two different phase functions corresponding to bright and faint clouds are examined in this analysis. OMI observations show maximum frequency and albedo values at 8-10 h local time in the Northern Hemisphere, with decreasing amplitude at higher latitudes. Southern Hemisphere values reach a minimum at 18-20 h LT. Larger variations are seen in Northern Hemisphere data. No statistically significant longitudinal dependence was seen.

  5. Direct Observations of PMC Local Time Variations by Aura OMI

    NASA Technical Reports Server (NTRS)

    DeLand, Matthew T.; Shettle, Eric P.; Thomas, Gary E.; Olivero, John J.

    2010-01-01

    The Ozone Monitoring Instrument (OMI) on the Aura satellite obtains unique measurements for polar mesospheric cloud (PMC) analysis. Its wide cross-track viewing swath and high along-track spatial resolution makes it possible to directly evaluate PMC occurrence frequency and brightness variations between 6S" and 8S' latitude as a function of local time over a 12-14 h continuous period. OMI PMC local time variations are closely coupled to concurrent variations in measurement scattering angle, so that ice phase function effects must be considered when interpreting the observations. Two different phase functions corresponding to bright and faint clouds are examined in this analysis. OMI observations show maximum frequency and albedo values at 8-10 h local time in the Northern Hemisphere, with decreasing amplitude at higher latitudes. Southern Hemisphere values reach a minimum at 18-20 h LT. Larger variations are seen in Northern Hemisphere data. No statistically significant longitudinal dependence was seen.

  6. Directly observable optical properties of sprites in Central Europe

    NASA Astrophysics Data System (ADS)

    Bór, József

    2013-04-01

    Luminous optical emissions accompanying streamer-based natural electric breakdown processes initiating in the mesosphere are called sprites. 489 sprite events have been observed with a TV frame rate video system in Central Europe from Sopron (47.68N, 16.58E, 230 m MSL), Hungary between 2007 and 2009. On the basis of these observations, characteristic morphological properties of sprites, i.e. basic forms (e.g. column, carrot, angel, etc.) as well as common morphological features (e.g. tendrils, glows, puffs, beads, etc.), have been identified. Probable time sequences of streamer propagation directions were associated with each of the basic sprite forms. It is speculated that different sequences of streamer propagation directions can result in very similar final sprite shapes. The number and type variety of sprite elements appearing in an event as well as the total optical duration of an event was analyzed statistically. Jellyfish and dancing sprite events were considered as special subsets of sprite clusters. It was found that more than 90% of the recorded sprite elements appeared in clusters rather than alone and more than half of the clusters contained more than one basic sprite forms. The analysis showed that jellyfish sprites and clusters of column sprites featuring glows and tendrils do not tend to have optical lifetimes longer than 80 ms. Such very long optical lifetimes have not been observed in sprite clusters containing more than 25 elements of any type, either. In contrast to clusters containing sprite entities of only one form, sprite events showing more sprite forms seem to have extended optical durations more likely. The need for further investigation and for finding theoretical concepts to link these observations to electric conditions ambient for sprite formation is emphasized.

  7. Direct observation of amyloid nucleation under nanomechanical stretching.

    PubMed

    Varongchayakul, Nitinun; Johnson, Sara; Quabili, Trina; Cappello, Joseph; Ghandehari, Hamidreza; Solares, Santiago De Jesus; Hwang, Wonmuk; Seog, Joonil

    2013-09-24

    Self-assembly of amyloid nanofiber is associated with both functional biological and pathological processes such as those in neurodegenerative diseases. Despite intensive studies, the stochastic nature of the process has made it difficult to elucidate a molecular mechanism for the key amyloid nucleation event. Here we investigated nucleation of the silk-elastin-like peptide (SELP) amyloid using time-lapse lateral force microscopy (LFM). By repeated scanning of a single line on a SELP-coated mica surface, we observed a sudden stepwise height increase. This corresponds to nucleation of an amyloid fiber, which subsequently grew perpendicular to the scanning direction. The lateral force profiles followed either a worm-like chain model or an exponential function, suggesting that the atomic force microscopy (AFM) tip stretches a single or multiple SELP molecules along the scanning direction. The probability of nucleation correlated with the maximum stretching force and extension, implying that stretching of SELP molecules is a key molecular event for amyloid nucleation. The mechanically induced nucleation allows for positional and directional control of amyloid assembly in vitro, which we demonstrate by generating single nanofibers at predetermined nucleation sites.

  8. Direct observation of photoinduced bent nitrosyl excited-state complexes

    SciTech Connect

    Sawyer, Karma R.; Steele, Ryan P.; Glascoe, Elizabeth A.; Cahoon, James F.; Schlegel, Jacob P.; Head-Gordon, Martin; Harris, Charles B.

    2008-06-28

    Ground state structures with side-on nitrosyl ({eta}{sup 2}-NO) and isonitrosyl (ON) ligands have been observed in a variety of transition-metal complexes. In contrast, excited state structures with bent-NO ligands have been proposed for years but never directly observed. Here we use picosecond time-resolved infrared spectroscopy and density functional theory (DFT) modeling to study the photochemistry of Co(CO){sub 3}(NO), a model transition-metal-NO compound. Surprisingly, we have observed no evidence for ON and {eta}{sup 2}-NO structural isomers, but have observed two bent-NO complexes. DFT modeling of the ground and excited state potentials indicates that the bent-NO complexes correspond to triplet excited states. Photolysis of Co(CO){sub 3}(NO) with a 400-nm pump pulse leads to population of a manifold of excited states which decay to form an excited state triplet bent-NO complex within 1 ps. This structure relaxes to the ground triplet state in ca. 350 ps to form a second bent-NO structure.

  9. Direct microscopic observation of forward osmosis membrane fouling.

    PubMed

    Wang, Yining; Wicaksana, Filicia; Tang, Chuyang Y; Fane, Anthony G

    2010-09-15

    This study describes the application of a noninvasive direct microscopic observation method for characterizing fouling of a forward osmosis (FO) membrane. The effect of the draw solution concentration, membrane orientation, and feed spacer on FO fouling was systematically investigated in a cross-flow setup using latex particles as model foulant in the feedwater. Higher draw solution (DS) concentrations (and thus increased flux levels) resulted in dramatic increase in the surface coverage by latex particles, suggesting that the critical flux concept might be applicable even for the osmotically driven FO process. Under identical draw solution concentrations, the active-layer-facing-the-feed-solution orientation (AL-FS) experienced significantly less fouling compared to the alternative orientation. This may be explained by the lower water flux in AL-FS, which is consistent with the critical flux concept. The use of a feed spacer not only dramatically enhanced the initial flux of the FO membrane, but also significantly improved the flux stability during FO fouling. Despite such beneficial effects of using the feed spacer, a significant amount of particle accumulation was found near the spacer filament, suggesting further opportunities for improved spacer design. To the best of the authors' knowledge, this is the first direct microscopic observation study on FO fouling.

  10. Imaging the real space structure of the spin fluctuations in an iron-based superconductor.

    PubMed

    Chi, Shun; Aluru, Ramakrishna; Grothe, Stephanie; Kreisel, A; Singh, Udai Raj; Andersen, Brian M; Hardy, W N; Liang, Ruixing; Bonn, D A; Burke, S A; Wahl, Peter

    2017-06-29

    Spin fluctuations are a leading candidate for the pairing mechanism in high temperature superconductors, supported by the common appearance of a distinct resonance in the spin susceptibility across the cuprates, iron-based superconductors and many heavy fermion materials. The information we have about the spin resonance comes almost exclusively from neutron scattering. Here we demonstrate that by using low-temperature scanning tunnelling microscopy and spectroscopy we can characterize the spin resonance in real space. We show that inelastic tunnelling leads to the characteristic dip-hump feature seen in tunnelling spectra in high temperature superconductors and that this feature arises from excitations of the spin fluctuations. Spatial mapping of this feature near defects allows us to probe non-local properties of the spin susceptibility and to image its real space structure.

  11. Excited calculations of large scale multiwalled nanotubes using real-space pseudopotential methods

    NASA Astrophysics Data System (ADS)

    Lena, Charles; Chelikowsky, James; Deslippe, Jack; Saad, Yousef; Yang, Chao; Louie, Steven G.

    2015-03-01

    One method for calculating excited states is the GW method. The GW method has many computational requirements. One of the bottlenecks is the calculation of numerous empty states. Within density functional theory, we use a real-space pseudopotential method (PARSEC) to calculate these empty states for multiwalled nanotubes. We illustrate the use of these empty states for calculating excited states using the GW method (BerkeleyGW). We demonstrate why using real-space density functional theory is advantageous for calculating empty states. Support provided by the SciDAC program, Department of Energy, Office of Science, Advanced Scientific Computing Research and Basic Energy Sciences. Grant Numbers DE-SC0008877 (Austin) and DE-FG02-12ER4 (Berkeley)

  12. Suppressing Ionic Terms with Number-Counting Jastrow Factors in Real Space

    DOE PAGES

    Goetz, Brett Van Der; Neuscamman, Eric

    2017-04-06

    Here, we demonstrate that four-body real-space Jastrow factors are, with the right type of Jastrow basis function, capable of performing successful wave function stenciling to remove unwanted ionic terms from an overabundant Fermionic reference without unduly modifying the remaining components. In addition to greatly improving size consistency (restoring it exactly in the case of a geminal power), real-space wave function stenciling is, unlike its Hilbert-space predecessors, immediately compatible with diffusion Monte Carlo, allowing it to be used in the pursuit of compact, strongly correlated trial functions with reliable nodal surfaces. Furthermore, we demonstrate the efficacy of this approach in themore » context of a double bond dissociation by using it to extract a qualitatively correct nodal surface despite being paired with a restricted Slater determinant, that, due to ionic term errors, produces a ground state with a qualitatively incorrect nodal surface when used in the absence of the Jastrow.« less

  13. Imaging the real space structure of the spin fluctuations in an iron-based superconductor

    NASA Astrophysics Data System (ADS)

    Chi, Shun; Aluru, Ramakrishna; Grothe, Stephanie; Kreisel, A.; Singh, Udai Raj; Andersen, Brian M.; Hardy, W. N.; Liang, Ruixing; Bonn, D. A.; Burke, S. A.; Wahl, Peter

    2017-06-01

    Spin fluctuations are a leading candidate for the pairing mechanism in high temperature superconductors, supported by the common appearance of a distinct resonance in the spin susceptibility across the cuprates, iron-based superconductors and many heavy fermion materials. The information we have about the spin resonance comes almost exclusively from neutron scattering. Here we demonstrate that by using low-temperature scanning tunnelling microscopy and spectroscopy we can characterize the spin resonance in real space. We show that inelastic tunnelling leads to the characteristic dip-hump feature seen in tunnelling spectra in high temperature superconductors and that this feature arises from excitations of the spin fluctuations. Spatial mapping of this feature near defects allows us to probe non-local properties of the spin susceptibility and to image its real space structure.

  14. Imaging the real space structure of the spin fluctuations in an iron-based superconductor

    PubMed Central

    Chi, Shun; Aluru, Ramakrishna; Grothe, Stephanie; Kreisel, A.; Singh, Udai Raj; Andersen, Brian M.; Hardy, W. N.; Liang, Ruixing; Bonn, D. A.; Burke, S. A.; Wahl, Peter

    2017-01-01

    Spin fluctuations are a leading candidate for the pairing mechanism in high temperature superconductors, supported by the common appearance of a distinct resonance in the spin susceptibility across the cuprates, iron-based superconductors and many heavy fermion materials. The information we have about the spin resonance comes almost exclusively from neutron scattering. Here we demonstrate that by using low-temperature scanning tunnelling microscopy and spectroscopy we can characterize the spin resonance in real space. We show that inelastic tunnelling leads to the characteristic dip-hump feature seen in tunnelling spectra in high temperature superconductors and that this feature arises from excitations of the spin fluctuations. Spatial mapping of this feature near defects allows us to probe non-local properties of the spin susceptibility and to image its real space structure. PMID:28660875

  15. Determining the structure of the real-space entanglement spectrum from approximate conditional independence

    NASA Astrophysics Data System (ADS)

    Kim, Isaac H.

    2013-04-01

    We study the ground state of a gapped quantum many-body system whose entanglement entropy SA can be expressed as SA=a|∂A|-γ, where a,γ are some constants and |∂A| is an area of the subsystem A. By using a recently proved operator extension of strong subadditivity of entropy [I. H. Kim, J. Math. Phys.JMAPAQ0022-248810.1063/1.4769176 53, 122204 (2012)], we show that a certain linear combination of the real-space entanglement spectrum has a small correlation with almost any local operator. Our result implies that there exists a structure relating the real-space entanglement spectrum over different subsystems. Further, this structure is inherited from the generic property of the ground state alone, suggesting that the locality of the entanglement spectrum may be attributed to the area law of entanglement entropy.

  16. The Redshift and Real-Space Correlation Functions from the ESP Galaxy Redshift Survey

    NASA Astrophysics Data System (ADS)

    Guzzo, Luigi; Bartlett, J. G.; Cappi, A.; Maurogordato, S.; Zucca, E.; Zamorani, G.; Balkowski, C.; Blanchard, A.; Cayatte, V.; Chincarini, G.; Collins, C.; Maccagni, D.; MacGillivray, H.; Merighi, R.; Mignoli, M.; Proust, D.; Ramella, M.; Scaramella, R.; Stirpe, G. M.; Vettolani, G.

    We discuss the behaviour of the redshift- and real-space correlation functions from the ESO Slice Project (ESP) galaxy redshift survey. xis for the whole survey is positive out to ~80hmpc, with a smooth break from a power law. By projecting xip, we recover the real-space correlation function xir, which below 10hmpc is reasonably well described by a power law xi(r) = (r/r_circ)^{-gamma}, with r_circ = 4.15^{+0.20}_{-0.21} h^{-1} Mpc and gamma = 1.67^{+0.07}_{-0.09}. The same analysis, applied to four volume-limited subsamples, evidences a small but significant growth of clustering with luminosity (r_circ varies from 3.4 to 5.2hmpc, when the luminosity threshold is increased from -18.5 to -20).

  17. Orbital tomography: Molecular band maps, momentum maps and the imaging of real space orbitals of adsorbed molecules.

    PubMed

    Offenbacher, Hannes; Lüftner, Daniel; Ules, Thomas; Reinisch, Eva Maria; Koller, Georg; Puschnig, Peter; Ramsey, Michael G

    2015-10-01

    The frontier orbitals of molecules are the prime determinants of their chemical, optical and electronic properties. Arguably, the most direct method of addressing the (filled) frontier orbitals is ultra-violet photoemission spectroscopy (UPS). Although UPS is a mature technique from the early 1970s on, the angular distribution of the photoemitted electrons was thought to be too complex to be analysed quantitatively. Recently angle resolved UPS (ARUPS) work on conjugated molecules both, in ordered thick films and chemisorbed monolayers, has shown that the angular (momentum) distribution of the photocurrent from orbital emissions can be simply understood. The approach, based on the assumption of a plane wave final state is becoming known as orbital tomography. Here we will demonstrate, with selected examples of pentacene (5A) and sexiphenyl (6P), the potential of orbital tomography. First it will be shown how the full angular distribution of the photocurrent (momentum map) from a specific orbital is related to the real space orbital by a Fourier transform. Examples of the reconstruction of 5A orbitals will be given and the procedure for recovering the lost phase information will be outlined. We then move to examples of sexiphenyl where we interrogate the original band maps of thick sexiphenyl in the light of our understanding of orbital tomography that has developed since then. With comparison to theoretical simulations of the molecular band maps, the molecular conformation and orientation will be concluded. New results for the sexiphenyl monolayer on Al(1 1 0) will then be presented. From the band maps it will be concluded that the molecule is planarised and adopts a tilted geometry. Finally the momentum maps down to HOMO-11 will be analysed and real space orbitals reconstructed.

  18. Real-space presentation of the magnetic anisotropy of metallic ferromagnets

    NASA Astrophysics Data System (ADS)

    Inoue, Jun-ichiro; Yoshioka, Takuya; Tsuchiura, Hiroki

    2015-05-01

    A real-space representation of the uniaxial magnetic anisotropy (MA) of metallic ferromagnets is formulated using the full-orbital tight-binding model. By adopting a second-order perturbation for the spin-orbit interaction, numerical calculations of the uniaxial MA are performed for the L10 FePt and Y2Fe14B compounds to evaluate the validity and applicability of the present method.

  19. Real-space presentation of the magnetic anisotropy of metallic ferromagnets

    SciTech Connect

    Inoue, Jun-ichiro; Yoshioka, Takuya; Tsuchiura, Hiroki

    2015-05-07

    A real-space representation of the uniaxial magnetic anisotropy (MA) of metallic ferromagnets is formulated using the full-orbital tight-binding model. By adopting a second-order perturbation for the spin-orbit interaction, numerical calculations of the uniaxial MA are performed for the L1{sub 0} FePt and Y{sub 2}Fe{sub 14}B compounds to evaluate the validity and applicability of the present method.

  20. Charge density wave depinning transition: a real space renormalization group approach

    NASA Astrophysics Data System (ADS)

    Caglioti, E.; Celino, M.

    1993-01-01

    We study analytically and numerically the depinning transition of a pinned charge density wave. We introduce a real space renormalization group approach with the method of decimation, which allows to determine the threshold both in the strong and weak pinning limit. We also perform a numerical renormalization of the system that allows to avoid the difficulties due to the large fluctuations in the weak pinning limit. The analytical results turn out to be in good agreement with the simulations.

  1. Disembodiment is a cyberspace myth: discourse and the self in real space.

    PubMed

    Stanley, S

    2001-02-01

    Much social science writing about the Internet is disembodied. This paper will try show how this is rhetorically practiced by the cyberfeminist author Sadie Plant. From the work of Fred Newman, Michael Billig, and also from discourse work, comes the idea that it is not views that should be studied per se, but rather, the giving of views. To understand people, one needs to understand them when they are in dialogue with one another. Not to test them in isolation, but to study their interrelatedness as they perform social life. A social space was constructed through which embodiment could be revealed. This reality is "real space," the space that is on the other side of the screen, so to speak. To understand the psychology of the Internet is to enter into dialogue with people, and real space constitutes the embodied practice of social talk, specifically in the context of the interview. Two semistructured interviews were carried out with a student from the Ukraine. These interviews were transcribed closely. Just as real space constitutes interviews, cyberspace constitutes E-mailing. An international student born in New Zealand was questioned through E-mail. A discourse analysis was performed on selected extracts. The sequences were typified by diversity and multiplicity of theme, which included the drawing upon of embodied resources. The experience of being internationals in a U.K. academic institution were perpetually being negotiated, concomitantly to the giving of views about the Internet. The problematic issues of writing about social life are practically addressed in the discussion. I explore the realities created by real space and cyberspace by deconstructing them. Discourse work allowed for a critical self-reflection concerning the meanings that were given to the performance of the Internet.

  2. Evolution of the real-space correlation function from next generation cluster surveys. Recovering the real-space correlation function from photometric redshifts

    NASA Astrophysics Data System (ADS)

    Sridhar, Srivatsan; Maurogordato, Sophie; Benoist, Christophe; Cappi, Alberto; Marulli, Federico

    2017-04-01

    Context. The next generation of galaxy surveys will provide cluster catalogues probing an unprecedented range of scales, redshifts, and masses with large statistics. Their analysis should therefore enable us to probe the spatial distribution of clusters with high accuracy and derive tighter constraints on the cosmological parameters and the dark energy equation of state. However, for the majority of these surveys, redshifts of individual galaxies will be mostly estimated by multiband photometry which implies non-negligible errors in redshift resulting in potential difficulties in recovering the real-space clustering. Aims: We investigate to which accuracy it is possible to recover the real-space two-point correlation function of galaxy clusters from cluster catalogues based on photometric redshifts, and test our ability to detect and measure the redshift and mass evolution of the correlation length r0 and of the bias parameter b(M,z) as a function of the uncertainty on the cluster redshift estimate. Methods: We calculate the correlation function for cluster sub-samples covering various mass and redshift bins selected from a 500 deg2 light-cone limited to H < 24. In order to simulate the distribution of clusters in photometric redshift space, we assign to each cluster a redshift randomly extracted from a Gaussian distribution having a mean equal to the cluster cosmological redshift and a dispersion equal to σz. The dispersion is varied in the range σ(z=0)=\\frac{σz{1+z_c} = 0.005,0.010,0.030} and 0.050, in order to cover the typical values expected in forthcoming surveys. The correlation function in real-space is then computed through estimation and deprojection of wp(rp). Four mass ranges (from Mhalo > 2 × 1013h-1M⊙ to Mhalo > 2 × 1014h-1M⊙) and six redshift slices covering the redshift range [0, 2] are investigated, first using cosmological redshifts and then for the four photometric redshift configurations. Results: From the analysis of the light-cone in

  3. Real-space electron transfer in III-nitride metal-oxide-semiconductor-heterojunction structures

    NASA Astrophysics Data System (ADS)

    Saygi, S.; Koudymov, A.; Adivarahan, V.; Yang, J.; Simin, G.; Khan, M. Asif; Deng, J.; Gaska, R.; Shur, M. S.

    2005-07-01

    The real-space transfer effect in a SiO2/AlGaN /GaN metal-oxide-semiconductor heterostructure (MOSH) from the two-dimensional (2D) electron gas at the heterointerface to the oxide-semiconductor interface has been demonstrated and explained. The effect occurs at high positive gate bias and manifests itself as an additional step in the capacitance-voltage (C-V) characteristic. The real-space transfer effect limits the achievable maximum 2D electron gas density in the device channel. We show that in MOSH structures the maximum electron gas density exceeds up to two times that at the equilibrium (zero bias) condition. Correspondingly, a significant increase in the maximum channel current (up to two times compared to conventional Schottky-gate structures) can be achieved. The real-space charge transfer effect in MOSH structures also opens up a way to design novel devices such as variable capacitors, multistate switches, memory cells, etc.

  4. Direct observation of the strange b baryon Xib-.

    PubMed

    Abazov, V M; Abbott, B; Abolins, M; Acharya, B S; Adams, M; Adams, T; Aguilo, E; Ahn, S H; Ahsan, M; Alexeev, G D; Alkhazov, G; Alton, A; Alverson, G; Alves, G A; Anastasoaie, M; Ancu, L S; Andeen, T; Anderson, S; Andrieu, B; Anzelc, M S; Arnoud, Y; Arov, M; Arthaud, M; Askew, A; Asman, B; Assis Jesus, A C S; Atramentov, O; Autermann, C; Avila, C; Ay, C; Badaud, F; Baden, A; Bagby, L; Baldin, B; Bandurin, D V; Banerjee, S; Banerjee, P; Barberis, E; Barfuss, A-F; Bargassa, P; Baringer, P; Barreto, J; Bartlett, J F; Bassler, U; Bauer, D; Beale, S; Bean, A; Begalli, M; Begel, M; Belanger-Champagne, C; Bellantoni, L; Bellavance, A; Benitez, J A; Beri, S B; Bernardi, G; Bernhard, R; Berntzon, L; Bertram, I; Besançon, M; Beuselinck, R; Bezzubov, V A; Bhat, P C; Bhatnagar, V; Biscarat, C; Blazey, G; Blekman, F; Blessing, S; Bloch, D; Bloom, K; Boehnlein, A; Boline, D; Bolton, T A; Borissov, G; Bos, K; Bose, T; Brandt, A; Brock, R; Brooijmans, G; Bross, A; Brown, D; Buchanan, N J; Buchholz, D; Buehler, M; Buescher, V; Burdin, S; Burke, S; Burnett, T H; Buszello, C P; Butler, J M; Calfayan, P; Calvet, S; Cammin, J; Caron, S; Carvalho, W; Casey, B C K; Cason, N M; Castilla-Valdez, H; Chakrabarti, S; Chakraborty, D; Chan, K M; Chan, K; Chandra, A; Charles, F; Cheu, E; Chevallier, F; Cho, D K; Choi, S; Choudhary, B; Christofek, L; Christoudias, T; Cihangir, S; Claes, D; Clément, C; Clément, B; Coadou, Y; Cooke, M; Cooper, W E; Corcoran, M; Couderc, F; Cousinou, M-C; Crépé-Renaudin, S; Cutts, D; Cwiok, M; da Motta, H; Das, A; Davies, G; De, K; de Jong, S J; de Jong, P; De La Cruz-Burelo, E; De Oliveira Martins, C; Degenhardt, J D; Déliot, F; Demarteau, M; Demina, R; Denisov, D; Denisov, S P; Desai, S; Diehl, H T; Diesburg, M; Dominguez, A; Dong, H; Dudko, L V; Duflot, L; Dugad, S R; Duggan, D; Duperrin, A; Dyer, J; Dyshkant, A; Eads, M; Edmunds, D; Ellison, J; Elvira, V D; Enari, Y; Eno, S; Ermolov, P; Evans, H; Evdokimov, A; Evdokimov, V N; Ferapontov, A V; Ferbel, T; Fiedler, F; Filthaut, F; Fisher, W; Fisk, H E; Ford, M; Fortner, M; Fox, H; Fu, S; Fuess, S; Gadfort, T; Galea, C F; Gallas, E; Galyaev, E; Garcia, C; Garcia-Bellido, A; Gavrilov, V; Gay, P; Geist, W; Gelé, D; Gerber, C E; Gershtein, Y; Gillberg, D; Ginther, G; Gollub, N; Gómez, B; Goussiou, A; Grannis, P D; Greenlee, H; Greenwood, Z D; Gregores, E M; Grenier, G; Gris, Ph; Grivaz, J-F; Grohsjean, A; Grünendahl, S; Grünewald, M W; Guo, J; Guo, F; Gutierrez, P; Gutierrez, G; Haas, A; Hadley, N J; Haefner, P; Hagopian, S; Haley, J; Hall, I; Hall, R E; Han, L; Hanagaki, K; Hansson, P; Harder, K; Harel, A; Harrington, R; Hauptman, J M; Hauser, R; Hays, J; Hebbeker, T; Hedin, D; Hegeman, J G; Heinmiller, J M; Heinson, A P; Heintz, U; Hensel, C; Herner, K; Hesketh, G; Hildreth, M D; Hirosky, R; Hobbs, J D; Hoeneisen, B; Hoeth, H; Hohlfeld, M; Hong, S J; Hooper, R; Hossain, S; Houben, P; Hu, Y; Hubacek, Z; Hynek, V; Iashvili, I; Illingworth, R; Ito, A S; Jabeen, S; Jaffré, M; Jain, S; Jakobs, K; Jarvis, C; Jesik, R; Johns, K; Johnson, C; Johnson, M; Jonckheere, A; Jonsson, P; Juste, A; Käfer, D; Kahn, S; Kajfasz, E; Kalinin, A M; Kalk, J R; Kalk, J M; Kappler, S; Karmanov, D; Kasper, J; Kasper, P; Katsanos, I; Kau, D; Kaur, R; Kaushik, V; Kehoe, R; Kermiche, S; Khalatyan, N; Khanov, A; Kharchilava, A; Kharzheev, Y M; Khatidze, D; Kim, H; Kim, T J; Kirby, M H; Kirsch, M; Klima, B; Kohli, J M; Konrath, J-P; Kopal, M; Korablev, V M; Kothari, B; Kozelov, A V; Krop, D; Kryemadhi, A; Kuhl, T; Kumar, A; Kunori, S; Kupco, A; Kurca, T; Kvita, J; Lacroix, F; Lam, D; Lammers, S; Landsberg, G; Lazoflores, J; Lebrun, P; Lee, W M; Leflat, A; Lehner, F; Lellouch, J; Lesne, V; Leveque, J; Lewis, P; Li, J; Li, Q Z; Li, L; Lietti, S M; Lima, J G R; Lincoln, D; Linnemann, J; Lipaev, V V; Lipton, R; Liu, Y; Liu, Z; Lobo, L; Lobodenko, A; Lokajicek, M; Lounis, A; Love, P; Lubatti, H J; Lyon, A L; Maciel, A K A; Mackin, D; Madaras, R J; Mättig, P; Magass, C; Magerkurth, A; Makovec, N; Mal, P K; Malbouisson, H B; Malik, S; Malyshev, V L; Mao, H S; Maravin, Y; Martin, B; McCarthy, R; Melnitchouk, A; Mendes, A; Mendoza, L; Mercadante, P G; Merekov, Y P; Merkin, M; Merritt, K W; Meyer, J; Meyer, A; Michaut, M; Millet, T; Mitrevski, J; Molina, J; Mommsen, R K; Mondal, N K; Moore, R W; Moulik, T; Muanza, G S; Mulders, M; Mulhearn, M; Mundal, O; Mundim, L; Nagy, E; Naimuddin, M; Narain, M; Naumann, N A; Neal, H A; Negret, J P; Neustroev, P; Nilsen, H; Nomerotski, A; Novaes, S F; Nunnemann, T; O'Dell, V; O'Neil, D C; Obrant, G; Ochando, C; Onoprienko, D; Oshima, N; Osta, J; Otec, R; Otero y Garzón, G J; Owen, M; Padley, P; Pangilinan, M; Panov, G; Parashar, N; Park, S-J; Park, S K; Parsons, J; Partridge, R; Parua, N; Patwa, A; Pawloski, G; Penning, B; Perea, P M; Peters, K; Peters, Y; Pétroff, P; Petteni, M; Piegaia, R; Piper, J; Pleier, M-A; Podesta-Lerma, P L M; Podstavkov, V M; Pogorelov, Y; Pol, M-E; Polozov, P; Pompos, A; Pope, B G; Popov, A V; Potter, C; Prado da Silva, W L; Prosper, H B; Protopopescu, S; Qian, J; Quadt, A; Quinn, B; Rakitine, A; Rangel, M S; Rani, K J; Ranjan, K; Ratoff, P N; Renkel, P; Reucroft, S; Rich, P; Rijssenbeek, M; Ripp-Baudot, I; Rizatdinova, F; Robinson, S; Rodrigues, R F; Royon, C; Rozhdestvenski, A; Rubinov, P; Ruchti, R; Safronov, G; Sajot, G; Sánchez-Hernández, A; Sanders, M P; Santoro, A; Savage, G; Sawyer, L; Scanlon, T; Schaile, D; Schamberger, R D; Scheglov, Y; Schellman, H; Schieferdecker, P; Schliephake, T; Schmitt, C; Schwanenberger, C; Schwartzman, A; Schwienhorst, R; Sekaric, J; Sengupta, S; Severini, H; Shabalina, E; Shamim, M; Shary, V; Shchukin, A A; Shivpuri, R K; Shpakov, D; Siccardi, V; Simak, V; Sirotenko, V; Skubic, P; Slattery, P; Smirnov, D; Smith, R P; Snow, J; Snow, G R; Snyder, S; Söldner-Rembold, S; Sonnenschein, L; Sopczak, A; Sosebee, M; Soustruznik, K; Souza, M; Spurlock, B; Stark, J; Steele, J; Stolin, V; Stone, A; Stoyanova, D A; Strandberg, J; Strandberg, S; Strang, M A; Strauss, M; Strauss, E; Ströhmer, R; Strom, D; Strovink, M; Stutte, L; Sumowidagdo, S; Svoisky, P; Sznajder, A; Talby, M; Tamburello, P; Tanasijczuk, A; Taylor, W; Telford, P; Temple, J; Tiller, B; Tissandier, F; Titov, M; Tokmenin, V V; Tomoto, M; Toole, T; Torchiani, I; Trefzger, T; Tsybychev, D; Tuchming, B; Tully, C; Tuts, P M; Unalan, R; Uvarov, S; Uvarov, L; Uzunyan, S; Vachon, B; van den Berg, P J; van Eijk, B; Van Kooten, R; van Leeuwen, W M; Varelas, N; Varnes, E W; Vartapetian, A; Vasilyev, I A; Vaupel, M; Verdier, P; Vertogradov, L S; Vertogradova, Y; Verzocchi, M; Villeneuve-Seguier, F; Vint, P; Vokac, P; Von Toerne, E; Voutilainen, M; Vreeswijk, M; Wagner, R; Wahl, H D; Wang, L; Wang, M H L S; Warchol, J; Watts, G; Wayne, M; Weber, M; Weber, G; Weerts, H; Wenger, A; Wermes, N; Wetstein, M; White, A; Wicke, D; Wilson, G W; Wimpenny, S J; Wobisch, M; Wood, D R; Wyatt, T R; Xie, Y; Yacoob, S; Yamada, R; Yan, M; Yasuda, T; Yatsunenko, Y A; Yip, K; Yoo, H D; Youn, S W; Yu, J; Yu, C; Yurkewicz, A; Zatserklyaniy, A; Zeitnitz, C; Zhang, D; Zhao, T; Zhou, B; Zhu, J; Zielinski, M; Zieminska, D; Zieminski, A; Zivkovic, L; Zutshi, V; Zverev, E G

    2007-08-03

    We report the first direct observation of the strange b baryon Xi(b)- (Xi(b)+). We reconstruct the decay Xi(b)- -->J/psiXi-, with J/psi-->mu+mu-, and Xi--->Lambdapi--->ppi-pi- in pp collisions at square root of s =1.96 TeV. Using 1.3 fb(-1) of data collected by the D0 detector, we observe 15.2 +/- 4.4(stat)(-0.4)(+1.9)(syst) Xi(b)- candidates at a mass of 5.774 +/- 0.011(stat) +/- 0.015(syst) GeV. The significance of the observed signal is 5.5 sigma, equivalent to a probability of 3.3 x 10(-8) of it arising from a background fluctuation. Normalizing to the decay Lambda(b)-->J/psiLambda, we measure the relative rate sigma(Xi(b-) x B(Xi)b})- -->J/psiXi-)/sigma(Lambda(b)) x B(Lambda(b)-->J/psiLambda) = 0.28+/-0.09(stat)(-0.08)(+0.09)(syst).

  5. Direct observation of spoke evolution in magnetron sputtering

    NASA Astrophysics Data System (ADS)

    Anders, André; Yang, Yuchen

    2017-08-01

    Ionization zones, also known as spokes, are plasma instabilities manifested as locations of intensified excitation and ionization over a sputtering magnetron's racetrack. Using a linear magnetron and a streak camera, we were able to observe and quantify spoke dynamics. The technique allows us to image the onset and changes for both direct current magnetron sputtering (dcMS) and high power impulse magnetron sputtering (HiPIMS). Spokes in dcMS exhibit substructures. Spokes in HiPIMS are not stable as they shift along the racetrack; rather, they tend to grow or diminish, and they may split and merge. Their evolution can be interpreted in the context of localized electric fields and associated electron heating.

  6. Direct observation of athermal photofluidisation in azo-polymer films.

    PubMed

    Hurduc, Nicolae; Donose, Bogdan C; Macovei, Alina; Paius, Cristina; Ibanescu, Constanta; Scutaru, Dan; Hamel, Matthieu; Branza-Nichita, Norica; Rocha, Licinio

    2014-07-14

    The surface relief gratings (SRGs) can be generated when azo-polymer films are exposed to laser beam interference as a result of mass migration. Despite considerable research effort over the past two decades this complex phenomenon remains incompletely understood. Here we show, for the first time, the athermal photofluidisation of azo-polysiloxane films exposed to 488 nm light, directly monitored by optical microscopy. A process of surface relief erasure occurring in parallel with its inscription was also observed during laser irradiation. We therefore propose a new mechanism of SRG formation, based on three different processes: (1) the polymer photo-fluidization in illuminated regions, (2) the mass displacement from illuminated to dark regions and (3) the inverse mass displacement, from dark to illuminated regions. The mechanical properties of the films during UV light irradiation were investigated by classical rheology and, for the first time, by using amplitude modulation-frequency modulation atomic force microscopy (AM-FM AFM).

  7. Direct observations of field-induced assemblies in magnetite ferrofluids

    NASA Astrophysics Data System (ADS)

    Mousavi, N. S. Susan; Khapli, Sachin D.; Kumar, Sunil

    2015-03-01

    Evolution of microstructures in magnetite-based ferrofluids with weak dipolar moments (particle size ≤ 10 nm) is studied with an emphasis on examining the effects of particle concentration (ϕ) and magnetic field strength (H) on the structures. Nanoparticles are dispersed in water at three different concentrations, ϕ = 0.15%, 0.48%, and 0.59% (w/v) [g/ml%] and exposed to uniform magnetic fields in the range of H = 0.05-0.42 T. Cryogenic transmission electron microscopy is employed to provide in-situ observations of the field-induced assemblies in such systems. As the magnetic field increases, the Brownian colloids are observed to form randomly distributed chains aligned in the field direction, followed by head-to-tail chain aggregation and then lateral aggregation of chains termed as zippering. By increasing the field in low concentration samples, the number of chains increases, though their length does not change dramatically. Increasing concentration increases the length of the linear particle assemblies in the presence of a fixed external magnetic field. Thickening of the chains due to zippering is observed at relatively high fields. Through a systematic variation of concentration and magnetic field strength, this study shows that both magnetic field strength and change in concentration can strongly influence formation of microstructures even in weak dipolar systems. Additionally, the results of two commonly used support films on electron microscopy grids, continuous carbon and holey carbon films, are compared. Holey carbon film allows us to create local regions of high concentrations that further assist the development of field-induced assemblies. The experimental observations provide a validation of the zippering effect and can be utilized in the development of models for thermophysical properties such as thermal conductivity.

  8. Direct observations of field-induced assemblies in magnetite ferrofluids

    SciTech Connect

    Mousavi, N. S. Susan; Khapli, Sachin D.; Kumar, Sunil

    2015-03-14

    Evolution of microstructures in magnetite-based ferrofluids with weak dipolar moments (particle size ≤ 10 nm) is studied with an emphasis on examining the effects of particle concentration (ϕ) and magnetic field strength (H) on the structures. Nanoparticles are dispersed in water at three different concentrations, ϕ = 0.15%, 0.48%, and 0.59% (w/v) [g/ml%] and exposed to uniform magnetic fields in the range of H = 0.05–0.42 T. Cryogenic transmission electron microscopy is employed to provide in-situ observations of the field-induced assemblies in such systems. As the magnetic field increases, the Brownian colloids are observed to form randomly distributed chains aligned in the field direction, followed by head-to-tail chain aggregation and then lateral aggregation of chains termed as zippering. By increasing the field in low concentration samples, the number of chains increases, though their length does not change dramatically. Increasing concentration increases the length of the linear particle assemblies in the presence of a fixed external magnetic field. Thickening of the chains due to zippering is observed at relatively high fields. Through a systematic variation of concentration and magnetic field strength, this study shows that both magnetic field strength and change in concentration can strongly influence formation of microstructures even in weak dipolar systems. Additionally, the results of two commonly used support films on electron microscopy grids, continuous carbon and holey carbon films, are compared. Holey carbon film allows us to create local regions of high concentrations that further assist the development of field-induced assemblies. The experimental observations provide a validation of the zippering effect and can be utilized in the development of models for thermophysical properties such as thermal conductivity.

  9. Direct observations of field-induced assemblies in magnetite ferrofluids

    PubMed Central

    Mousavi, N. S. Susan

    2015-01-01

    Evolution of microstructures in magnetite-based ferrofluids with weak dipolar moments (particle size ≤ 10 nm) is studied with an emphasis on examining the effects of particle concentration (ϕ) and magnetic field strength (H) on the structures. Nanoparticles are dispersed in water at three different concentrations, ϕ = 0.15%, 0.48%, and 0.59% (w/v) [g/ml%] and exposed to uniform magnetic fields in the range of H = 0.05–0.42 T. Cryogenic transmission electron microscopy is employed to provide in-situ observations of the field-induced assemblies in such systems. As the magnetic field increases, the Brownian colloids are observed to form randomly distributed chains aligned in the field direction, followed by head-to-tail chain aggregation and then lateral aggregation of chains termed as zippering. By increasing the field in low concentration samples, the number of chains increases, though their length does not change dramatically. Increasing concentration increases the length of the linear particle assemblies in the presence of a fixed external magnetic field. Thickening of the chains due to zippering is observed at relatively high fields. Through a systematic variation of concentration and magnetic field strength, this study shows that both magnetic field strength and change in concentration can strongly influence formation of microstructures even in weak dipolar systems. Additionally, the results of two commonly used support films on electron microscopy grids, continuous carbon and holey carbon films, are compared. Holey carbon film allows us to create local regions of high concentrations that further assist the development of field-induced assemblies. The experimental observations provide a validation of the zippering effect and can be utilized in the development of models for thermophysical properties such as thermal conductivity. PMID:25829566

  10. Direct observations of field-induced assemblies in magnetite ferrofluids.

    PubMed

    Mousavi, N S Susan; Khapli, Sachin D; Kumar, Sunil

    2015-03-14

    Evolution of microstructures in magnetite-based ferrofluids with weak dipolar moments (particle size ≤ 10 nm) is studied with an emphasis on examining the effects of particle concentration (ϕ) and magnetic field strength (H) on the structures. Nanoparticles are dispersed in water at three different concentrations, ϕ = 0.15%, 0.48%, and 0.59% (w/v) [g/ml%] and exposed to uniform magnetic fields in the range of H = 0.05-0.42 T. Cryogenic transmission electron microscopy is employed to provide in-situ observations of the field-induced assemblies in such systems. As the magnetic field increases, the Brownian colloids are observed to form randomly distributed chains aligned in the field direction, followed by head-to-tail chain aggregation and then lateral aggregation of chains termed as zippering. By increasing the field in low concentration samples, the number of chains increases, though their length does not change dramatically. Increasing concentration increases the length of the linear particle assemblies in the presence of a fixed external magnetic field. Thickening of the chains due to zippering is observed at relatively high fields. Through a systematic variation of concentration and magnetic field strength, this study shows that both magnetic field strength and change in concentration can strongly influence formation of microstructures even in weak dipolar systems. Additionally, the results of two commonly used support films on electron microscopy grids, continuous carbon and holey carbon films, are compared. Holey carbon film allows us to create local regions of high concentrations that further assist the development of field-induced assemblies. The experimental observations provide a validation of the zippering effect and can be utilized in the development of models for thermophysical properties such as thermal conductivity.

  11. Dental injury after conventional direct laryngoscopy: a prospective observational study.

    PubMed

    Mourão, J; Neto, J; Luís, C; Moreno, C; Barbosa, J; Carvalho, J; Tavares, J

    2013-10-01

    This observational study assessed the frequency and risk factors of dental damage after classic direct laryngoscopy for tracheal intubation in 536 adult patients. The patients' sex, age, height, weight, dental condition, dental mobility, Mallampati class, interincisor gap, thyromental distance, neck circumference, and head and neck extension were recorded. From anaesthesia records, the difficulty of intubation, the number of attempts, type of neuromuscular blocking agent used and duration of anaesthesia were recorded. After anaesthesia, examination revealed that 134 patients (25.0%) had dental damage affecting 162 teeth (147 maxillary; 15 mandibular). Enamel fracture was the commonest injury. In tooth number 21, the interincisor gap (OR 2.5 (95% CI 1.0-5.9)) and in tooth number 22, the number of intubation attempts (OR 5.3 (95% CI 1.3-22.0)) were considered a risk factor for dental injury. Conventional direct laryngoscopy is associated with a strikingly high incidence of dental damage, although specific risk factors remain unclear. © 2013 The Association of Anaesthetists of Great Britain and Ireland.

  12. Direct Observation of Tropomyosin Binding to Actin Filaments

    PubMed Central

    Schmidt, William M.; Lehman, William; Moore, Jeffrey R.

    2015-01-01

    Tropomyosin is an elongated α-helical coiled-coil that binds to seven consecutive actin subunits along the long-pitch helix of actin filaments. Once bound, tropomyosin polymerizes end-to-end and both stabilizes F-actin and regulates access of various actin binding proteins including myosin in muscle and non-muscle cells. Single tropomyosin molecules bind weakly to F-actin with millimolar Kd, whereas the end-to-end linked tropomyosin associates with about a one thousand-fold greater affinity. Despite years of study, the assembly mechanism of tropomyosin onto actin filaments remains unclear. In the current study, we used total internal reflection fluorescence (TIRF) microscopy to directly monitor the cooperative binding of fluorescently labeled tropomyosin molecules to phalloidin-stabilized actin filaments. We find that tropomyosin molecules assemble from multiple growth sites following random low affinity binding of single molecules to actin. As the length of the tropomyosin chain increases, the probability of detachment decreases, which leads to further chain growth. Tropomyosin chain extension is linearly dependent on tropomyosin concentration, occurring at approximately 100 monomers/(μM*s). The random tropomyosin binding to F-actin leads to discontinuous end-to-end association where gaps in the chain continuity smaller than the required seven sequential actin monomers are available. Direct observation of tropomyosin detachment revealed the number of gaps in actin-bound tropomyosin, the time course of gap annealing, and the eventual filament saturation process. PMID:26033920

  13. Enabling direct nanoscale observations of biological reactions with dynamic TEM

    SciTech Connect

    Evans, James E.; Browning, Nigel D.

    2013-02-18

    Biological processes can occur over a wide range of spatial and temporal scales; from femtoseconds to hours and from angstroms to meters. Although no single experimental method can fully cover this entire phase space, many new biological insights can be expected from a better understanding of the processes that occur on the very fast timescales and very small length scales. In this regard, new instruments that use fast x-ray or electron pulses are now available that are expected to reveal new mechanistic insights for macromolecular protein dynamics. To ensure that any observed conformational change is physiologically relevant and not constrained by three-dimensional crystal packing, it would be preferable for experiments to utilize smaller protein samples such as single particles or two-dimensional crystals that mimic the target protein’s native environment. These samples aren’t typically amenable to x-ray analysis, but transmission electron microscopy has successfully imaged such sample geometries for over 40 years and permits data acquisition using both direct imaging and diffraction modes. While conventional transmission electron microscopes (TEM) have only visualized biological samples with atomic resolution in an arrested or frozen state, the recent development of the dynamic TEM (DTEM) extends electron microscopy capabilities into dynamics. A new 2nd generation DTEM that is currently being constructed has the potential to observe live biological processes with unprecedented spatiotemporal resolution by using pulsed electron packets to probe the sample on the micro- and nanosecond timescale. In addition to the enhanced temporal resolution, the DTEM also operates in the pump-probe regime that can permit visualizing reactions propagating in real-time. This article reviews the experimental parameters necessary for coupling DTEM with in situ liquid microscopy to allow direct imaging of protein conformational dynamics in a fully hydrated environment.

  14. Enabling direct nanoscale observations of biological reactions with dynamic TEM

    PubMed Central

    Evans, James E.; Browning, Nigel D.

    2013-01-01

    Biological processes occur on a wide range of spatial and temporal scales: from femtoseconds to hours and from angstroms to meters. Many new biological insights can be expected from a better understanding of the processes that occur on these very fast and very small scales. In this regard, new instruments that use fast X-ray or electron pulses are expected to reveal novel mechanistic details for macromolecular protein dynamics. To ensure that any observed conformational change is physiologically relevant and not constrained by 3D crystal packing, it would be preferable for experiments to utilize small protein samples such as single particles or 2D crystals that mimic the target protein's native environment. These samples are not typically amenable to X-ray analysis, but transmission electron microscopy has imaged such sample geometries for over 40 years using both direct imaging and diffraction modes. While conventional transmission electron microscopes (TEM) have visualized biological samples with atomic resolution in an arrested or frozen state, the recent development of the dynamic TEM (DTEM) extends electron microscopy into a dynamic regime using pump-probe imaging. A new second-generation DTEM, which is currently being constructed, has the potential to observe live biological processes with unprecedented spatiotemporal resolution by using pulsed electron packets to probe the sample on micro- and nanosecond timescales. This article reviews the experimental parameters necessary for coupling DTEM with in situ liquid microscopy to enable direct imaging of protein conformational dynamics in a fully hydrated environment and visualize reactions propagating in real time. PMID:23315566

  15. Real-Space Renormalization-Group Approach to the Integer Quantum Hall Effect

    NASA Astrophysics Data System (ADS)

    Cain, Philipp; Römer, Rudolf A.

    We review recent results based on an application of the real-space renormalization group (RG) approach to a network model for the integer quantum Hall (QH) transition. We demonstrate that this RG approach reproduces the critical distribution of the power transmission coefficients, i.e., two-terminal conductances, Pc(G), with very high accuracy. The RG flow of P(G) at energies away from the transition yields a value of the critical exponent ν that agrees with most accurate large-size lattice simulations. A description of how to obtain other relevant transport coefficients such as RL and RH is given. From the non-trivial fixed point of the RG flow we extract the critical level-spacing distribution (LSD). This distribution is close, but distinctively different from the earlier large-scale simulations. We find that the LSD obeys scaling behavior around the QH transition with ν = 2.37±0.02. Away from the transition it crosses over towards the Poisson distribution. We next investigate the plateau-to-insulator transition at strong magnetic fields. For a fully quantum coherent situation, we find a quantized Hall insulator with RH≈h/e2 up to RL 20h/e2 when interpreting the results in terms of most probable value of the distribution function P(RH). Upon further increasing RL→∞, the Hall insulator with diverging Hall resistance R H∝ R Lκ is seen. The crossover between these two regimes depends on the precise nature of the averaging procedure for the distributions P(RL) and P(RH). We also study the effect of long-ranged inhomogeneities on the critical properties of the QH transition. Inhomogeneities are modeled by a smooth random potential with a correlator which falls off with distance as a power law r-α. Similar to the classical percolation, we observe an enhancement of ν with decreasing α. These results exemplify the surprising fact that a small RG unit, containing only five nodes, accurately captures most of the correlations responsible for the localization

  16. Direct observation of individual dislocation interaction processes with grain boundaries

    PubMed Central

    Kondo, Shun; Mitsuma, Tasuku; Shibata, Naoya; Ikuhara, Yuichi

    2016-01-01

    In deformation processes, the presence of grain boundaries has a crucial influence on dislocation behavior; these boundaries drastically change the mechanical properties of polycrystalline materials. It has been considered that grain boundaries act as effective barriers for dislocation glide, but the origin of this barrier-like behavior has been a matter of conjecture for many years. We directly observe how the motion of individual dislocations is impeded at well-defined high-angle and low-angle grain boundaries in SrTiO3, via in situ nanoindentation experiments inside a transmission electron microscope. Our in situ observations show that both the high-angle and low-angle grain boundaries impede dislocation glide across them and that the impediment of dislocation glide does not simply originate from the geometric effects; it arises as a result of the local structural stabilization effects at grain boundary cores as well, especially for low-angle grain boundaries. The present findings indicate that simultaneous consideration of both the geometric effects and the stabilization effects is necessary to quantitatively understand the dislocation impediment processes at grain boundaries. PMID:27847862

  17. Evidence of Arctic sea ice thinning from direct observations

    NASA Astrophysics Data System (ADS)

    Renner, Angelika H. H.; Gerland, Sebastian; Haas, Christian; Spreen, Gunnar; Beckers, Justin F.; Hansen, Edmond; Nicolaus, Marcel; Goodwin, Harvey

    2014-07-01

    The Arctic sea ice cover is rapidly shrinking, but a direct, longer-term assessment of the ice thinning remains challenging. A new time series constructed from in situ measurements of sea ice thickness at the end of the melt season in Fram Strait shows a thinning by over 50% during 2003-2012. The modal and mean ice thickness along 79°N decreased at a rate of 0.3 and 0.2 m yr-1, respectively, with long-term averages of 2.5 and 3 m. Airborne observations reveal an east-west thickness gradient across the strait in spring but not in summer due to advection from more different source regions. There is no clear relationship between interannual ice thickness variability and the source regions of the ice. The observed thinning is therefore likely a result of Arctic-wide reduction in ice thickness with a potential shift in exported ice types playing a minor role.

  18. Direct observation of episodic growth in an abyssal xenophyophore (Protista)

    NASA Astrophysics Data System (ADS)

    Gooday, A. J.; Bett, B. J.; Pratt, D. N.

    1993-11-01

    Three specimens of the xenophyophore Reticulammina labyrinthica were photographed on the Madeira Abyssal Plain (31°6.1'N, 21°10.9'W; 4944 m) using the Bathysnap time-lapse camera system. During the 8 month observation period, the specimens underwent an estimated 3-10 fold increase in volume. Growth occurred episodically in several distinct phases, each lasting 2-3 days, during which sediment was collected and incorporated into the test. These phases were separated by fairly regular periods of about 2 months when the organisms showed little obvious activity. The growth phases were approximately synchronous between specimens. However, it is not clear whether the periodicity and apparent synchronization of these events resulted from an external (environmental) cue or whether growth is internally controlled and the synchronization arose by chance. These unique observations, which represent the first direct measurement of growth in any abyssal organism living outside a hydrothermal vent field, suggest that xenophyophores combine test growth with deposit feeding. The tests appear to grow more quickly, and to be more active, dynamic structures, than previously believed.

  19. Direct observation of the spin-dependent Peltier effect.

    PubMed

    Flipse, J; Bakker, F L; Slachter, A; Dejene, F K; van Wees, B J

    2012-02-05

    The Peltier coefficient describes the amount of heat that is carried by an electrical current when it passes through a material. When two materials with different Peltier coefficients are placed in contact with one another, the Peltier effect causes a net flow of heat either towards or away from the interface between them. Spintronics describes the transport of electric charge and spin angular momentum by separate spin-up and spin-down channels in a device. The observation that spin-up and spin-down charge transport channels are able to transport heat independently of each other has raised the possibility that spin currents could be used to heat or cool the interface between materials with different spin-dependent Peltier coefficients. Here, we report the direct observation of the heating and cooling of such an interface by a spin current. We demonstrate this spin-dependent Peltier effect in a spin-valve pillar structure that consists of two ferromagnetic layers separated by a non-ferromagnetic metal. Using a three-dimensional finite-element model, we extract spin-dependent Peltier coefficients in the range -0.9 to -1.3 mV for permalloy. The magnetic control of heat flow could prove useful for the cooling of nanoscale electronic components or devices.

  20. Direct observation of the spin-dependent Peltier effect

    NASA Astrophysics Data System (ADS)

    Flipse, J.; Bakker, F. L.; Slachter, A.; Dejene, F. K.; van Wees, B. J.

    2012-03-01

    The Peltier coefficient describes the amount of heat that is carried by an electrical current when it passes through a material. When two materials with different Peltier coefficients are placed in contact with one another, the Peltier effect causes a net flow of heat either towards or away from the interface between them. Spintronics describes the transport of electric charge and spin angular momentum by separate spin-up and spin-down channels in a device. The observation that spin-up and spin-down charge transport channels are able to transport heat independently of each other has raised the possibility that spin currents could be used to heat or cool the interface between materials with different spin-dependent Peltier coefficients. Here, we report the direct observation of the heating and cooling of such an interface by a spin current. We demonstrate this spin-dependent Peltier effect in a spin-valve pillar structure that consists of two ferromagnetic layers separated by a non-ferromagnetic metal. Using a three-dimensional finite-element model, we extract spin-dependent Peltier coefficients in the range -0.9 to -1.3 mV for permalloy. The magnetic control of heat flow could prove useful for the cooling of nanoscale electronic components or devices.

  1. Directly Observed Therapy and Improved Tuberculosis Treatment Outcomes in Thailand

    PubMed Central

    Anuwatnonthakate, Amornrat; Limsomboon, Pranom; Nateniyom, Sriprapa; Wattanaamornkiat, Wanpen; Komsakorn, Sittijate; Moolphate, Saiyud; Chiengsorn, Navarat; Kaewsa-ard, Samroui; Sombat, Potjaman; Siangphoe, Umaporn; Mock, Philip A.; Varma, Jay K.

    2008-01-01

    Background The World Health Organization (WHO) recommends that tuberculosis (TB) patients receive directly observed therapy (DOT). Randomized controlled trials have not consistently shown that this practice improves TB treatment success rates. In Thailand, one of 22 WHO-designated high burden TB countries, patients may have TB treatment observed by a health care worker (HCW), family member, or no one. We studied whether DOT improved TB treatment outcomes in a prospective, observational cohort. Methods and Findings We prospectively collected epidemiologic data about TB patients treated at public and private facilities in four provinces in Thailand and the national infectious diseases hospital from 2004–2006. Public health staff recorded the type of observed therapy that patients received during the first two months of TB treatment. We limited our analysis to pulmonary TB patients never previously treated for TB and not known to have multidrug-resistant TB. We analyzed the proportion of patients still on treatment at the end of two months and with treatment success at the end of treatment according to DOT type. We used propensity score analysis to control for factors associated with DOT and treatment outcome. Of 8,031 patients eligible for analysis, 24% received HCW DOT, 59% family DOT, and 18% self-administered therapy (SAT). Smear-positive TB was diagnosed in 63%, and 21% were HIV-infected. Of patients either on treatment or that defaulted at two months, 1601/1636 (98%) patients that received HCW DOT remained on treatment at two months compared with 1096/1268 (86%) patients that received SAT (adjusted OR [aOR] 3.8; 95% confidence interval [CI] 2.4–6.0) and 3782/3987 (95%) patients that received family DOT (aOR 2.1; CI, 1.4–3.1). Of patients that had treatment success or that defaulted at the end of treatment, 1369/1477 (93%) patients that received HCW DOT completed treatment compared with 744/1074 (69%) patients that received SAT (aOR 3.3; CI, 2.4–4.5) and

  2. Microcrack closure in rocks under stress: direct observation

    SciTech Connect

    Batzle, M.L.; Simmons, G.; Siegfried, R.W.

    1980-12-10

    Microcrack closure in rocks under increasing stress was observed directly with a scanning electron microscope. Uniaxial stresses to 300 bars were applied with a small hydraulic press to specimens of Westerly (RI) granite, both unheated and previously heat cycled to 500/sup 0/C, and of Frederick (MD) diabase, heat cycled to 700/sup 0/C. Closure characteristics (rate, final closure pressure, etc.) depend on crack orientation, shape, surface roughness, and on the nature of fracture intersections and interactions. Cracks perpendicular to the applied stress closed while those parallel to the stress tended to open. Long, narrow cracks (low aspect ratio) closed at relatively low pressures. At some intersections, one fracture would open while another simultaneously closed, depending upon their orientations. Many fractures closed uniformly even though offset by other fractures. Local stress concentrations often caused new fracturing at low applied stress. Some fractures were propped open until material lodged inside was crushed. Significant irreversible damage occurred during the first stress cycle. Closure characteristics varied significantly among the samples. The unheated granite has cracks with rough, pitted, and mismatched walls. Only partial closure occurred under stress with many sections remaining open. Crack porosity is reduced but continues to be interconnected. Fractures in the preheated granite and diabase are also irregular, but the walls are well-matched and closure is nearly complete. The cracks in the heated granite closed at lower stresses than in the diabase. As the maximum stress was approached for the heated granite, new transgranular cracks formed and preexisting cracks were enlarged. The variations in closure rate and character were also observed in strain measurements.

  3. Direct observation of the dynamic process underlying allosteric signal transmission.

    PubMed

    Brüschweiler, Sven; Schanda, Paul; Kloiber, Karin; Brutscher, Bernhard; Kontaxis, Georg; Konrat, Robert; Tollinger, Martin

    2009-03-04

    Allosteric regulation is an effective mechanism of control in biological processes. In allosteric proteins a signal originating at one site in the molecule is communicated through the protein structure to trigger a specific response at a remote site. Using NMR relaxation dispersion techniques we directly observe the dynamic process through which the KIX domain of CREB binding protein communicates allosteric information between binding sites. KIX mediates cooperativity between pairs of transcription factors through binding to two distinct interaction surfaces in an allosteric manner. We show that binding the activation domain of the mixed lineage leukemia (MLL) transcription factor to KIX induces a redistribution of the relative populations of KIX conformations toward a high-energy state in which the allosterically activated second binding site is already preformed, consistent with the Monod-Wyman-Changeux (WMC) model of allostery. The structural rearrangement process that links the two conformers and by which allosteric information is communicated occurs with a time constant of 3 ms at 27 degrees C. Our dynamic NMR data reveal that an evolutionarily conserved network of hydrophobic amino acids constitutes the pathway through which information is transmitted.

  4. Direct Observation of Rydberg-Rydberg Transitions via Cpmmw Spectroscopy

    NASA Astrophysics Data System (ADS)

    Zhou, Yan; Grimes, David; Klein, Ethan; Barnum, Timothy J.; Field, Robert W.

    2014-06-01

    Rydberg-Rydberg transitions of Ca atoms are directly observed by chirped-pulse millimeter-wave spectroscopy, which is a form of broadband, high-resolution, free induction decay-detected (FID) spectroscopy with accurate relative intensities. A new setup, a 20 K Neon buffer gas cooled molecular beam system, has been constructed and tested in our lab. The number density of our target molecules, BaF, is increased by a factor of >100 relative to a Smalley-type laser ablation supersonic beam source. In addition, the laboratory frame velocity is decreased by factor 10, which improves our spectroscopic resolution to better than 50 kHz FWHM at 100 GHz. The improved molecular beam source opens the door to an extension of the CPmmW spectroscopy from atomic Rydberg states to molecular Rydberg states. I expect to present preliminary data from ``pure electronic" spectra of BaF Rydberg molecules. We expect to produce 10^8 state-selected core-nonpenetrating Rydberg molecules in a single pulse of a laser-laser-mm-wave triple resonance excitation sequence.

  5. Direct observation of interface instability during crystal growth

    NASA Technical Reports Server (NTRS)

    Tiller, W. A.; Feigelson, R. S.; Elwell, D.

    1982-01-01

    The general aim of this investigation was to study interface stability and solute segregation phenomena during crystallization of a model system. Emphasis was to be placed on direct observational studies partly because this offered the possibility at a later stage of performing related experiments under substantially convection-free conditions in the space shuttle. The major achievements described in this report are: (1) the development of a new model system for fundamental studies of crystal growth from the melt and the measurement of a range of material parameters necessary for comparison of experiment with theory. (2) The introduction of a new method of measuring segregation coefficient using absorption of a laser beam by the liquid phase. (3) The comparison of segregation in crystals grown by gradient freezing and by pulling from the melt. (4) The introduction into the theory of solute segregation of an interface field term and comparison with experiment. (5) The introduction of the interface field term into the theories of constitutional supercooling and morphological stability and assessment of its importance.

  6. Directly Observing the Galaxies Likely Responsible for Reionization

    NASA Astrophysics Data System (ADS)

    Livermore, R. C.; Finkelstein, S. L.; Lotz, J. M.

    2017-02-01

    We report a new analysis of the Hubble Frontier Fields clusters Abell 2744 and MACS 0416 using wavelet decomposition to remove the cluster light, enabling the detection of highly magnified (>50×) galaxies a factor of 10× fainter in luminosity than previous studies. We find 167 galaxies at z≳ 6, and with this sample we are able to characterize the UV luminosity function to {M}{UV}=-12.5 at z∼ 6, ‑14 at z∼ 7, and ‑15 at z∼ 8. We find a steep faint-end slope (α < -2), and with our improved statistics at the faint end we reduce the fractional uncertainty on α to < 2 % at z∼ 6{--}7 and 4% at z∼ 8. We also investigate the systematic uncertainty due to the lens modeling by using every available lens model individually and comparing the results; this systematic fractional uncertainty on α is < 4 % at all redshifts. We now directly observe galaxies in the luminosity regime where some simulations predict a change in the faint-end slope of the luminosity function, yet our results provide statistically very strong evidence against any turnover in the luminosity range probed, more consistent with simulations in which stars form in lower-mass halos. Thus, we find strong support for the extension of the steep luminosity function to {M}{UV}=-13 at z> 6, consistent with the number of faint galaxies needed to reionize the universe under standard assumptions.

  7. Method for observing phase objects without halos and directional shadows

    NASA Astrophysics Data System (ADS)

    Suzuki, Yoshimasa; Kajitani, Kazuo; Ohde, Hisashi

    2015-03-01

    A new microscopy method for observing phase objects without halos and directional shadows is proposed. The key optical element is an annular aperture at the front focal plane of a condenser with a larger diameter than those used in standard phase contrast microscopy. The light flux passing through the annular aperture is changed by the specimen's surface profile and then passes through an objective and contributes to image formation. This paper presents essential conditions for realizing the method. In this paper, images of colonies formed by induced pluripotent stem (iPS) cells using this method are compared with the conventional phase contrast method and the bright-field method when the NA of the illumination is small to identify differences among these techniques. The outlines of the iPS cells are clearly visible with this method, whereas they are not clearly visible due to halos when using the phase contrast method or due to weak contrast when using the bright-field method. Other images using this method are also presented to demonstrate a capacity of this method: a mouse ovum and superimposition of several different images of mouse iPS cells.

  8. Homocysteine and Real-Space Navigation Performance among Non-Demented Older Adults.

    PubMed

    Pařízková, Martina; Andel, Ross; Lerch, Ondřej; Marková, Hana; Gažová, Ivana; Vyhnálek, Martin; Hort, Jakub; Laczó, Jan

    2017-01-01

    High plasma homocysteine (Hcy) level is related to higher risk of Alzheimer's disease (AD) and lower cognitive performance in older adults. To assess the association between plasma Hcy level and real-space navigation performance and the role of vascular risk and protective factors, APOE status, and white matter lesions (WML) on this association. Ninety-two non-demented older adults (29 with amnestic mild cognitive impairment, 46 with subjective cognitive decline, and 17 cognitively normal older adults) underwent spatial navigation testing of egocentric, allocentric, and mixed navigation in a real-space analogue of the Morris water maze, neuropsychological examination, blood collection, and MRI brain scan with evaluation of WML. In the regression analyses controlling for age, gender, education, and depressive symptoms, higher plasma Hcy level was related to worse mixed and egocentric (β= 0.31; p = 0.003 and β= 0.23; p = 0.017) but not allocentric (p > 0.05) navigation performance. Additional controlling for vascular risk and protective factors, WML, and APOE status did not modify the results. High total cholesterol and low vitamin B12 and folate levels increased the adverse effect of Hcy on egocentric and mixed navigation. WML did not explain the association between plasma Hcy level and navigation performance. Elevated plasma Hcy level may affect real-space navigation performance above and beyond vascular brain changes. This association may be magnified in the presence of high total cholesterol and low folate or vitamin B12 levels. Attention to the level of plasma Hcy may be a viable intervention strategy to prevent decline in spatial navigation in non-demented older adults.

  9. Modelling 1-minute directional observations of the global irradiance.

    NASA Astrophysics Data System (ADS)

    Thejll, Peter; Pagh Nielsen, Kristian; Andersen, Elsa; Furbo, Simon

    2016-04-01

    Direct and diffuse irradiances from the sky has been collected at 1-minute intervals for about a year from the experimental station at the Technical University of Denmark for the IEA project "Solar Resource Assessment and Forecasting". These data were gathered by pyrheliometers tracking the Sun, as well as with apertured pyranometers gathering 1/8th and 1/16th of the light from the sky in 45 degree azimuthal ranges pointed around the compass. The data are gathered in order to develop detailed models of the potentially available solar energy and its variations at high temporal resolution in order to gain a more detailed understanding of the solar resource. This is important for a better understanding of the sub-grid scale cloud variation that cannot be resolved with climate and weather models. It is also important for optimizing the operation of active solar energy systems such as photovoltaic plants and thermal solar collector arrays, and for passive solar energy and lighting to buildings. We present regression-based modelling of the observed data, and focus, here, on the statistical properties of the model fits. Using models based on the one hand on what is found in the literature and on physical expectations, and on the other hand on purely statistical models, we find solutions that can explain up to 90% of the variance in global radiation. The models leaning on physical insights include terms for the direct solar radiation, a term for the circum-solar radiation, a diffuse term and a term for the horizon brightening/darkening. The purely statistical model is found using data- and formula-validation approaches picking model expressions from a general catalogue of possible formulae. The method allows nesting of expressions, and the results found are dependent on and heavily constrained by the cross-validation carried out on statistically independent testing and training data-sets. Slightly better fits -- in terms of variance explained -- is found using the purely

  10. Direct AFM observation of individual micelles, tile decorations and tiling rules of a dodecagonal liquid quasicrystal

    NASA Astrophysics Data System (ADS)

    Zhang, Ruibin; Zeng, Xiangbing; Ungar, Goran

    2017-10-01

    We performed an atomic force microscopy study of the dendron-based dodecagonal quasicrystal, the material that had been reported in 2004 as the first soft quasicrystal. We succeeded in orienting the 12-fold axis perpendicular to the substrate, which allowed the imaging of the quasiperiodic xy plane. Thus for the first time we have been able to obtain direct real-space information not only on the arrangement of the tiles, but also on their ‘decorations’ by the individual spherical micelles or ‘nanoatoms’. The high-resolution patterns recorded confirm the square-triangle tiling, but the abundance of different nodes corresponds closely to random tiling rather than to any inflation rule. The previously proposed model of three types of decorated tiles, two triangular and one square, has been confirmed; the basic Frank–Kasper mode of alternating dense-sparse-dense-sparse layer stacking along z is confirmed too, each of the four sublayers being 2 nm thick. The consecutive dense layers are seen to be rotated by 90°, as expected. The 2 nm steps on the surface correspond to one layer of spheres, nonetheless with a dense layer always remaining on top, which implies a layer slip underneath and possibly the existence of screw dislocations.

  11. High-stability Finite-Length Silicon Nanowires: A Real Space Theoretical Study

    NASA Astrophysics Data System (ADS)

    Koukaras, E. N.; Zdetsis, A. D.; Garoufalis, C. S.

    2007-12-01

    We demonstrate by real-space density functional calculations that unreconstructed low-stability finite size hydrogenated silicon nanowires could bend through relaxation under the influence of internal strains, contrary to high-stability "magic" nanowires. The strains and the resulting bending depend on the distribution and orientation of silicon dihydrides on the nanowire's surface. This and other related effects cannot be accounted for by the usual k-space supercell techniques. We also demonstrate that reconstructed (2×1) nanowires, although bend they are practically as stable as the "magic" unreconstructed nanowires. Our calculations are in full agreement with the experimental work of Ma et al. [Science 299, 1874, (2003)].

  12. Real space renormalization group and totalitarian paradox of majority rule voting

    NASA Astrophysics Data System (ADS)

    Galam, Serge

    2000-09-01

    The effect of majority rule voting in hierarchical structures is studied using the basic concepts from real space renormalization group. It shows in particular that a huge majority can be self-eliminated while climbing up the hierarchy levels. This majority democratic self-elimination articulates around the existence of fixed points in the voting flow. An unstable fixed point determines the critical threshold to full and total power. It can be varied from 50% up to 77% of initial support. Our model could shed new light on the last century eastern European communist collapse.

  13. Lattice dynamics calculations based on density-functional perturbation theory in real space

    NASA Astrophysics Data System (ADS)

    Shang, Honghui; Carbogno, Christian; Rinke, Patrick; Scheffler, Matthias

    2017-06-01

    A real-space formalism for density-functional perturbation theory (DFPT) is derived and applied for the computation of harmonic vibrational properties in molecules and solids. The practical implementation using numeric atom-centered orbitals as basis functions is demonstrated exemplarily for the all-electron Fritz Haber Institute ab initio molecular simulations (FHI-aims) package. The convergence of the calculations with respect to numerical parameters is carefully investigated and a systematic comparison with finite-difference approaches is performed both for finite (molecules) and extended (periodic) systems. Finally, the scaling tests and scalability tests on massively parallel computer systems demonstrate the computational efficiency.

  14. Duality with real-space renormalization and its application to bond percolation.

    PubMed

    Ohzeki, Masayuki

    2013-01-01

    We obtain the exact solution of the bond-percolation thresholds with inhomogeneous probabilities on the square lattice. Our method is based on the duality analysis with real-space renormalization, which is a profound technique invented in the spin-glass theory. Our formulation is a more straightforward way than that of a very recent study on the same problem [R. M. Ziff et al., J. Phys. A: Math. Theor. 45, 494005 (2012)]. The resultant generic formulas from our derivation can give several estimations for the bond-percolation thresholds on other lattices rather than the square lattice.

  15. Periodically driven random quantum spin chains: real-space renormalization for Floquet localized phases

    NASA Astrophysics Data System (ADS)

    Monthus, Cécile

    2017-07-01

    When random quantum spin chains are submitted to some periodic Floquet driving, the eigenstates of the time-evolution operator over one period can be localized in real space. For the case of periodic quenches between two Hamiltonians (or periodic kicks), where the time-evolution operator over one period reduces to the product of two simple transfer matrices, we propose a block-self-dual renormalization procedure to construct the localized eigenstates of the Floquet dynamics. We also discuss the corresponding strong disorder renormalization procedure, that generalizes the RSRG-X procedure to construct the localized eigenstates of time-independent Hamiltonians.

  16. Real-space decoupling transformation for quantum many-body systems.

    PubMed

    Evenbly, G; Vidal, G

    2014-06-06

    We propose a real-space renormalization group method to explicitly decouple into independent components a many-body system that, as in the phenomenon of spin-charge separation, exhibits separation of degrees of freedom at low energies. Our approach produces a branching holographic description of such systems that opens the path to the efficient simulation of the most entangled phases of quantum matter, such as those whose ground state violates a boundary law for entanglement entropy. As in the coarse-graining transformation of Vidal [Phys. Rev. Lett. 99, 220405 (2007).

  17. Direct Observation of Two Proton Radioactivity Using Digital Photography

    SciTech Connect

    Rykaczewski, Krzysztof Piotr; Pfutzner, M.; Dominik, Wojciech; Janas, Z.; Miernik, K.; Bingham, C. R.; Czyrkowski, Henryk; Cwiok, Mikolaj; Darby, Iain; Dabrowski, Ryszard; Ginter, T. N.; Grzywacz, Robert Kazimierz; Karny, M.; Korgul, A.; Kusmierz, Waldemar; Liddick, Sean; Rajabali, Mustafa; Stolz, A.

    2007-01-01

    Recently the observation of a new type of spontaneous radioactive decay has been claimed in which two protons are simultaneously ejected by an atomic nucleus from the ground state1,2,3. Experimental data obtained for the extremely neutron-deficient nuclei 45Fe and 54Zn, were interpreted as the first evidence of such a decay mode which has been sought since 1960.4 However, the technique applied in those studies allowed only measurements of the decay time and the total energy released. Particles emitted in the decay were not identified and the conclusions had to be supported by theoretical arguments. Here we show for the first time, directly and unambiguously, that 45Fe indeed disintegrates by two-proton decay. Furthermore, we demonstrate that the decay branch of this isotope leads to various particle emission channels including two-proton and three-proton emission. To achieve this result we have developed a new type of detector V the Optical Time Projection Chamber (OTPC) in which digital photography is applied to nuclear physics for the first time. The detector records images of tracks from charged particles, allowing for their unambiguous identification and the reconstruction of decay events in three dimensions. This new and simple technique provides a powerful method to identify exotic decay channels involving emission of charged particles. It is expected that further studies with the OTPC device will yield important information on nuclei located at and beyond the proton drip-line, thus providing new material for testing and improving models of very unstable atomic nuclei.

  18. Direct Observations Of Microbial Activity At Extreme Pressures

    NASA Astrophysics Data System (ADS)

    Sharma, A.; Scott, J. H.; Cody, G. D.; Fogel, M.; Hazen, R. M.; Hemley, R. J.; Huntress, W. T.

    2002-12-01

    Microbial communities adapt to a wide range of pressures, temperatures, salinities, pH, and oxidation states. Although, significant attention has been focused on the effects of high and low temperature on physiology, there is some evidence that elevated pressure may also manifest interesting effects on cellular physiology, such as enzyme inactivation, cell-membrane breach, and suppression of protein interactions with various substrates. However, exactly how these factors affect intact cells is not well understood. In this study, we have adapted diamond anvil cells to explore the effects of high pressure on microbial life. We used the rate of microbial formate oxidation as a probe of metabolic viability. The utilization of formate by microorganisms is a fundamental metabolic process in anaerobic environments. We monitored in-situ microbial formate oxidation via molecular spectroscopy for Shewanella oneidensis strain MR1 and Escherichia coli strain MG1655 at high pressures (68 to 1060 MPa). At pressures of 1200 to 1600 MPa, living bacteria resided in fluid inclusions in ice-VI crystals and continued to be viable upon subsequent release to ambient pressures (0.1 MPa). Furthermore, direct microscopic observations indicate that these cells maintain their ability for cellular division upon decompression from such high pressures. Evidence of microbial viability and activity at these extreme pressures expands by an order of magnitude the range of conditions representing the habitable zone in the solar system. These results imply that pressure may not be a significant impediment to life. The maximum pressure explored in this work is equivalent to a depth of ~ 50 km below Earth's crust, or ~ 160 km in a hypothetical ocean. The pressures encountered at the depths of thick ice caps and deep crustal subsurface may not be a limiting factor for the existence of life. This suggests that deep (water/ice) layers of Europa, Callisto, or Ganymede, subduction zones on Earth, and the

  19. Modeling solvation effects in real-space and real-time within density functional approaches

    SciTech Connect

    Delgado, Alain; Corni, Stefano; Pittalis, Stefano; Rozzi, Carlo Andrea

    2015-10-14

    The Polarizable Continuum Model (PCM) can be used in conjunction with Density Functional Theory (DFT) and its time-dependent extension (TDDFT) to simulate the electronic and optical properties of molecules and nanoparticles immersed in a dielectric environment, typically liquid solvents. In this contribution, we develop a methodology to account for solvation effects in real-space (and real-time) (TD)DFT calculations. The boundary elements method is used to calculate the solvent reaction potential in terms of the apparent charges that spread over the van der Waals solute surface. In a real-space representation, this potential may exhibit a Coulomb singularity at grid points that are close to the cavity surface. We propose a simple approach to regularize such singularity by using a set of spherical Gaussian functions to distribute the apparent charges. We have implemented the proposed method in the OCTOPUS code and present results for the solvation free energies and solvatochromic shifts for a representative set of organic molecules in water.

  20. Modeling solvation effects in real-space and real-time within density functional approaches.

    PubMed

    Delgado, Alain; Corni, Stefano; Pittalis, Stefano; Rozzi, Carlo Andrea

    2015-10-14

    The Polarizable Continuum Model (PCM) can be used in conjunction with Density Functional Theory (DFT) and its time-dependent extension (TDDFT) to simulate the electronic and optical properties of molecules and nanoparticles immersed in a dielectric environment, typically liquid solvents. In this contribution, we develop a methodology to account for solvation effects in real-space (and real-time) (TD)DFT calculations. The boundary elements method is used to calculate the solvent reaction potential in terms of the apparent charges that spread over the van der Waals solute surface. In a real-space representation, this potential may exhibit a Coulomb singularity at grid points that are close to the cavity surface. We propose a simple approach to regularize such singularity by using a set of spherical Gaussian functions to distribute the apparent charges. We have implemented the proposed method in the Octopus code and present results for the solvation free energies and solvatochromic shifts for a representative set of organic molecules in water.

  1. Modeling solvation effects in real-space and real-time within density functional approaches

    NASA Astrophysics Data System (ADS)

    Delgado, Alain; Corni, Stefano; Pittalis, Stefano; Rozzi, Carlo Andrea

    2015-10-01

    The Polarizable Continuum Model (PCM) can be used in conjunction with Density Functional Theory (DFT) and its time-dependent extension (TDDFT) to simulate the electronic and optical properties of molecules and nanoparticles immersed in a dielectric environment, typically liquid solvents. In this contribution, we develop a methodology to account for solvation effects in real-space (and real-time) (TD)DFT calculations. The boundary elements method is used to calculate the solvent reaction potential in terms of the apparent charges that spread over the van der Waals solute surface. In a real-space representation, this potential may exhibit a Coulomb singularity at grid points that are close to the cavity surface. We propose a simple approach to regularize such singularity by using a set of spherical Gaussian functions to distribute the apparent charges. We have implemented the proposed method in the Octopus code and present results for the solvation free energies and solvatochromic shifts for a representative set of organic molecules in water.

  2. A Real Space Cellular Automaton Laboratory (ReSCAL) to analyze complex geophysical systems

    NASA Astrophysics Data System (ADS)

    Rozier, O.; Narteau, C.

    2012-04-01

    The Real Space Cellular Automaton Laboratory (ReSCAL) is a generator of 3D multiphysics, markovian and stochastic cellular automata with continuous time. The objective of this new software released under a GNU licence is to develop interdisciplinary research collaboration to investigate the dynamics of complex geophysical systems. In a vast majority of cases, a numerical model is a set of physical variables (temperature, pressure, velocity, etc...) that are recalculated over time according to some predetermined rules or equations. Then, any point in space is entirely characterized by a local set of parameters. This is not the case in ReSCAL where the only local variable is a state-parameter that represent the different phases involved in the problem. An elementary cell represent a given volume of real-space. Pairs of nearest neighbour cells are called doublet. For each individual physical process that we take into account, there is a set of doublet transitions. Using this approach we can model a wide range of physical-chemical or anthropological processes. Here, we present different ingredients of ReSCAL using published applications in geosciences (Narteau et al. 2001 and 2009). We also show how ReSCAL can be developped and used across many displines in geophysics and physical geography. Supplementary informations: Sources files of ReSCAL can be download on http://www.ipgp.fr/~rozier/ReSCAL/rescal-en.html

  3. Real-space imaginary-time propagators for non-local nucleon-nucleon potentials

    NASA Astrophysics Data System (ADS)

    Lynn, J. E.; Schmidt, K. E.

    2012-07-01

    Nuclear structure quantum Monte Carlo methods such as Green's function or auxiliary field diffusion Monte Carlo have used phenomenological local real-space potentials containing as few derivatives as possible, such as the Argonne-Urbana family of interactions, to make sampling simple and efficient. Basis set methods such as no-core shell model and coupled-cluster techniques typically use softer non-local potentials because of their more rapid convergence with basis set size. These non-local potentials are usually defined in momentum space and are often based on effective field theory. Comparisons of the results of the two types of methods can be difficult when different potentials are used. We show methods for evaluating the real-space imaginary-time propagators needed to perform quantum Monte Carlo calculations using such non-local potentials. We explore the universality of the large imaginary time propagators for different potentials and discuss how non-local potentials can be used in quantum Monte Carlo calculations.

  4. A Real-Space Cellular Automaton Laboratory for the modeling of complex dunefields

    NASA Astrophysics Data System (ADS)

    Rozier, Olivier; Narteau, Clement

    2013-04-01

    Using applications in the physics of sand dunes, we explore the capabilities of a Real Space Cellular Automaton Laboratory (ReSCAL), a generator of 3D stochastic cellular automaton stochastic cellular automaton models with continuous time. The objective of this software is to develop interdisciplinary research collaboration to investigate the dynamics of complex systems. In the vast majority of numerical models, any point in space is entirely characterized by a local set of physical variables (e. g. temperature, pressure, velocity) that are recalculated over time according to some predetermined set of fundamental laws. However, there is not always a satisfactory theoretical framework from which we can try to quantify the overall dynamics of the system. For this reason, we prefer concentrate on features of organization and ReSCAL is entirely constructed from a finite number of discrete states that represent the different phases of matter involved in the system under consideration. Then, an elementary cell is a real-space representation of the physical environment. Pairs of nearest neighbor cells are called doublets and each individual physical process is associated with a set of doublet transitions and a characteristic transition rate. Using a modular approach, we show how it is possible to model and combine a wide range of physical, chemical and/or anthropological processes. As an example, we discuss different dune morphologies with respect to rotating wind conditions.

  5. A real space auxiliary field approach to the BCS-BEC crossover

    NASA Astrophysics Data System (ADS)

    Tarat, Sabyasachi; Majumdar, Pinaki

    2015-03-01

    The BCS to BEC crossover in attractive Fermi systems is a prototype of weak to strong coupling evolution in many body physics. While extensive numerical results are available, and several approximate methods have been developed, most of these schemes are unsuccessful in the presence of spatial inhomogeneity. Such situations call for a real space approach that can handle large spatial scales and retain the crucial thermal fluctuations. With this in mind we present comprehensive results of a real space auxiliary field approach to the BCS to BEC crossover in the attractive Hubbard model in two dimensions. The scheme reproduces the Hartree-Fock-Bogoliubov ground state, and leads to a T c scale that agrees with quantum Monte Carlo estimates to within a few percent. We provide results on the T c , amplitude and phase fluctuations, density of states, and the momentum resolved spectral function, over the entire interaction and temperature window. We suggest how the method generalises successfully to the presence of disorder, trapping, and population imbalance.

  6. Symmetry-respecting real-space renormalization for the quantum Ashkin-Teller model.

    PubMed

    O'Brien, Aroon; Bartlett, Stephen D; Doherty, Andrew C; Flammia, Steven T

    2015-10-01

    We use a simple real-space renormalization-group approach to investigate the critical behavior of the quantum Ashkin-Teller model, a one-dimensional quantum spin chain possessing a line of criticality along which critical exponents vary continuously. This approach, which is based on exploiting the on-site symmetry of the model, has been shown to be surprisingly accurate for predicting some aspects of the critical behavior of the quantum transverse-field Ising model. Our investigation explores this approach in more generality, in a model in which the critical behavior has a richer structure but which reduces to the simpler Ising case at a special point. We demonstrate that the correlation length critical exponent as predicted from this real-space renormalization-group approach is in broad agreement with the corresponding results from conformal field theory along the line of criticality. Near the Ising special point, the error in the estimated critical exponent from this simple method is comparable to that of numerically intensive simulations based on much more sophisticated methods, although the accuracy decreases away from the decoupled Ising model point.

  7. A direct way to observe absolute molecular handedness

    NASA Astrophysics Data System (ADS)

    Vager, Zeev

    2014-07-01

    We claim that the polarization of electrons tunneling through the molecular electric dipole direction uniquely determines the handedness of chiral centers. Unique labeling of chiral stereo-centers must include their handedness. The conventional method is formally known as the R, S nomenclature or the Ingold-Prelog priority (CIP) rules. It requires knowledge of the spatial absolute configuration of that center. Traditionally, experimental methods of extracting handedness go through the absolute configuration and only then would the CIP convention be applied. Here we show that a direct experimental method of determination of the natural molecular handedness by the polarization of tunneling electrons is almost always compatible with the CIP convention. By the sole use of symmetry arguments we show that the chiral molecular symmetry eliminates the need of fine structure splitting. As a consequence, the polarization of electrons tunneling through the molecular electric dipole direction uniquely determines their handedness.

  8. A new parallel plate shear cell for in situ real-space measurements of complex fluids under shear flow.

    PubMed

    Wu, Yu Ling; Brand, Joost H J; van Gemert, Josephus L A; Verkerk, Jaap; Wisman, Hans; van Blaaderen, Alfons; Imhof, Arnout

    2007-10-01

    We developed and tested a parallel plate shear cell that can be mounted on top of an inverted microscope to perform confocal real-space measurements on complex fluids under shear. To follow structural changes in time, a plane of zero velocity is created by letting the plates move in opposite directions. The location of this plane is varied by changing the relative velocities of the plates. The gap width is variable between 20 and 200 microm with parallelism better than 1 microm. Such a small gap width enables us to examine the total sample thickness using high numerical aperture objective lenses. The achieved shear rates cover the range of 0.02-10(3) s(-1). This shear cell can apply an oscillatory shear with adjustable amplitude and frequency. The maximum travel of each plate equals 1 cm, so that strains up to 500 can be applied. For most complex fluids, an oscillatory shear with such a large amplitude can be regarded as a continuous shear. We measured the flow profile of a suspension of silica colloids in this shear cell. It was linear except for a small deviation caused by sedimentation. To demonstrate the excellent performance and capabilities of this new setup we examined shear induced crystallization and melting of concentrated suspensions of 1 microm diameter silica colloids.

  9. Ordered lattice defects in colored fluorite: direct observations.

    PubMed

    Murr, L E

    1974-01-18

    Ordered arrays of defect aggregates in the (111) planes of natural fluorite have been observed by transmission electron microscopy. The intense blue coloration observed in corresponding sample areas after 200-kilovolt electron microscopy confirms the conclusion that these are color-center aggregates and, conversely, that color centers are primarily responsible for fluorite coloration.

  10. The direct observation of cosmic ray composition in JACEE

    SciTech Connect

    Burnett, T.H.; Iwai, J.; Lord, J.J. ); Dake, S.; Oda, H. ); Derrickson, J.H.; Fountain, W.F. ); Fuki, M. ); Gregory, J.C.; Hayashi, T. ); Holynski, R.; Jurak, A. ); Jones, W.V. ); Miyamura, O. )

    1989-03-01

    No significant changes in spectral index for protons up to 500 TeV and higher intensity for helium above 2 TeV were observed. For heavier elements, a general tendency of intensity enhancement of medium heavies in the relative abundance above about 10 TeV/amu was observed.

  11. Comer Schools: Are They Recognizable through Direct Observation?

    ERIC Educational Resources Information Center

    Aguilera, Linda; Crane, Patti; Hamer, Mariann; Morrison, Melissa; Serrano, Dina

    The Comer School Development Program is a reform model aimed at creating a positive school climate. Research has confirmed that specific Comer characteristics, such as an orderly, well-maintained facility, classroom diversity, and staff friendliness, can be observed. This study uses the Comer Visitor Observation instrument to determine whether…

  12. Direct observation of electronic-liquid-crystal phase transitions and their microscopic origin in La1/3Ca2/3MnO3

    SciTech Connect

    Tao, J.; Sun, K.; Yin, W. -G.; Wu, L.; Xin, H.; Wen, J. G.; Luo, W.; Pennycook, S. J.; Tranquada, J. M.; Zhu, Y.

    2016-11-22

    The ground-state electronic order in doped manganites is frequently associated with a lattice modulation, contributing to their many interesting properties. However, measuring the thermal evolution of the lattice superstructure with reciprocal-space probes alone can lead to ambiguous results with competing interpretations. Here, we provide direct observations of the evolution of the superstructure in La1/3Ca2/3MnO3 in real space, as well as reciprocal space, using transmission electron microscopic (TEM) techniques. We show that the transitions are the consequence of a proliferation of dislocations plus electronic phase separation. The resulting states are well described by the symmetries associated with electronic-liquid-crystal (ELC) phases. Furthermore, our results resolve the long-standing controversy over the origin of the incommensurate superstructure and suggest a new structural model that is consistent with recent theoretical calculations.

  13. A New Method to Directly Observe Tuberculosis Treatment: Skype Observed Therapy, a Patient-Centered Approach.

    PubMed

    Buchman, Tavora; Cabello, Celina

    Tuberculosis (TB) treatment completion is in part determined by patient's adherence to long-term drug regimens. To best ensure compliance, directly observed therapy (DOT) is considered the standard of practice. Nassau County Department of Health TB Control is responsible for providing DOT to patients with TB. Tuberculosis Control sought to use and evaluate Skype Observed Therapy (SOT) as an alternative to DOT for eligible patients. The evaluation included analysis of patient's acceptance and adherence to drug regimen using SOT. Tuberculosis Control assessed staff efficiency and cost savings for this program. Percentages of SOT of patients and successful SOT visits, mileage, and travel time savings. Twenty percent of the caseload used SOT and 100% of patients who were eligible opted in. Average SOT success was 79%. Total mileage savings and time saved were $9,929.07 and 614 hours. Because SOT saves cost and time and is a suitable alternative to DOT for patients, it should be considered as part of new policies and practices in TB control programs.

  14. Direct UV observations of the circumstellar envelope of alpha Orionis

    NASA Technical Reports Server (NTRS)

    Stencel, R. E.; Carpenter, K. G.; Pesce, J. E.; Skinner, S.; Brown, A.; Judge, P.

    1988-01-01

    Observations were made in the IUE LWP camera, low dispersion mode, with alpha Ori being offset various distances from the center of the Long Wavelength Large Aperture along its major axis. Signal was acquired at all offset positions and is comprised of unequal components of background/dark counts, telescope-scattered light, and scattered light emanating from the extended circumstellar shell. The star is known from optical and infrared observations to possess an extended, arc-minute sized, shell of cool material. Attempts to observe this shell with the IUE are described, although the deconvolution of the stellar signal from the telescope scattered light requires further calibration effort.

  15. Direct observation of the Aharonov-Casher phase.

    PubMed

    König, M; Tschetschetkin, A; Hankiewicz, E M; Sinova, Jairo; Hock, V; Daumer, V; Schäfer, M; Becker, C R; Buhmann, H; Molenkamp, L W

    2006-02-24

    Ring structures fabricated from HgTe/HgCdTe quantum wells have been used to study Aharonov-Bohm type conductance oscillations as a function of Rashba spin-orbit splitting strength. We observe nonmonotonic phase changes indicating that an additional phase factor modifies the electron wave function. We associate these observations with the Aharonov-Casher effect. This is confirmed by comparison with numerical calculations of the magnetoconductance for a multichannel ring structure within the Landauer-Büttiker formalism.

  16. Physical Activity Surveillance in Parks Using Direct Observation

    PubMed Central

    McKenzie, Thomas L.; Cohen, Deborah; Evenson, Kelly R.; Golinelli, Daniela; Hillier, Amy; Lapham, Sandra C.; Williamson, Stephanie

    2014-01-01

    Introduction Primary features of observational public health surveillance instruments are that they are valid, can reliably estimate physical activity behaviors, and are useful across diverse geographic settings and seasons by different users. Previous studies have reported the validity and reliability of Systematic Observation of Play and Recreation in Communities (SOPARC) to estimate park and user characteristics. The purpose of this investigation was to establish the use of SOPARC as a surveillance instrument and to situate the findings from the study in the context of the previous literature. Methods We collected data by using SOPARC for more than 3 years in 4 locations: Philadelphia, Pennsylvania; Columbus, Ohio; Chapel Hill/Durham, North Carolina; and Albuquerque, New Mexico during spring, summer, and autumn. Results We observed a total of 35,990 park users with an overall observer reliability of 94% (range, 85%–99%) conducted on 15% of the observations. We monitored the proportion of park users engaging in moderate-to-vigorous physical activity (MVPA) and found marginal differences in MVPA by both city and season. Park users visited parks significantly more on weekend days than weekdays and visitation rates tended to be lower during summer than spring. Conclusion SOPARC is a highly reliable observation instrument that can be used to collect data across diverse geographic settings and seasons by different users and has potential as a surveillance system. PMID:24384304

  17. Direct Observation of Zitterbewegung in a Bose Einstein Condensate

    DTIC Science & Technology

    2013-07-03

    analogous to the Higgs mechanism where a Higgs condensate (a coherent matter wave) generates mass in the standard model [28].) The zitterbewegung of...directly realize Dirac– boson systems in the laboratory [12, 29], permitting access to new classes of experimental systems. Though BECs near these Dirac...http://www.njp.org/) 10 in an optical lattice, can stably populate these states [34, 35], for example leading to bosonic composite-fermion states [36, 37

  18. Conformational disorder of proteins assessed by real-space molecular dynamics refinement.

    PubMed Central

    Chen, Z; Chapman, M S

    2001-01-01

    Motion is critical to the function of many proteins, but much more difficult to study than structure. Due to lack of easy alternatives, although there are inherent limitations, there have been several prior attempts to extract some information from the Bragg scattering in conventional diffraction patterns. Bragg diffraction reflects only a small proportion of a protein's motion and disorder, so fitted values likely underestimate reality. However, this work shows that the fitted estimates should be even smaller, because current methods of refinement over-fit the Bragg diffraction, leading to a component of the disorder that is not based on any experimental data, and could be characterized as a guess. Real-space refinement is less susceptible than other methods, but its application depends on the availability of very accurate experimental phases. A future challenge will be the collection of such data without resort to cryo-techniques, so that a physiologically relevant understanding can be achieved. PMID:11222306

  19. Visualization of Vibrational Modes in Real Space by Tip-Enhanced Non-Resonant Raman Spectroscopy.

    PubMed

    Duan, Sai; Tian, Guangjun; Luo, Yi

    2016-01-18

    We present a general theory to model the spatially resolved non-resonant Raman images of molecules. It is predicted that the vibrational motions of different Raman modes can be fully visualized in real space by tip-enhanced non-resonant Raman scattering. As an example, the non-resonant Raman images of water clusters were simulated by combining the new theory and first-principles calculations. Each individual normal mode gives rise its own distinct Raman image, which resembles the expected vibrational motions of the atoms very well. The characteristics of intermolecular vibrations in supermolecules could also be identified. The effects of the spatial distribution of the plasmon as well as nonlinear scattering processes were also addressed. Our study not only suggests a feasible approach to spatially visualize vibrational modes, but also provides new insights in the field of nonlinear plasmonic spectroscopy.

  20. Real Space Renormalization of Majorana Fermions in Quantum Nano-Wire Superconductors

    NASA Astrophysics Data System (ADS)

    Jafari, R.; Langari, A.; Akbari, Alireza; Kim, Ki-Seok

    2017-02-01

    We develop the real space quantum renormalization group (QRG) approach for majorana fermions. As an example we focus on the Kitaev chain to investigate the topological quantum phase transition (TQPT) in the one-dimensional spinless p-wave superconductor. Studying the behaviour of local compressibility and ground-state fidelity, show that the TQPT is signalled by the maximum of local compressibility at the quantum critical point tuned by the chemical potential. Moreover, a sudden drop of the ground-state fidelity and the divergence of fidelity susceptibility at the topological quantum critical point are used as proper indicators for the TQPT, which signals the appearance of Majorana fermions. Finally, we present the scaling analysis of ground-state fidelity near the critical point that manifests the universal information about the TQPT, which reveals two different scaling behaviors as we approach the critical point and thermodynamic limit.

  1. New real-space renormalization-group calculation for the critical properties of lattice spin systems

    NASA Astrophysics Data System (ADS)

    Hecht, Charles E.; Kikuchi, Ryoichi

    1982-05-01

    In evaluating the critical properties of lattice spin systems in the real-space renormalization-group theory we use the cluster variation method. A configuration in the transformed system is constrained and the probability of occurrence of this configuration is calculated both in the transformed system and in the original system. By equating the two probabilities and forming ratios of two such equalities (for two or more constrained configurations) the fixed point of the renormalization transformation is evaluated. The method can avoid the trouble due to different singularities in the original and transformed systems, and hence can obviate the possible development of spurious singularities in the transformation at low temperatures. The two-dimensional triangular Ising model is treated with numerical results comparable with those obtained by the cluster treatment of Niemeijer and van Leeuwen who used more and larger cluster types than those we introduce.

  2. Scalable real space pseudopotential-density functional codes for materials applications

    NASA Astrophysics Data System (ADS)

    Chelikowsky, James R.; Lena, Charles; Schofield, Grady; Saad, Yousef; Deslippe, Jack; Yang, Chao

    2015-03-01

    Real-space pseudopotential density functional theory has proven to be an efficient method for computing the properties of matter in many different states and geometries, including liquids, wires, slabs and clusters with and without spin polarization. Fully self-consistent solutions have been routinely obtained for systems with thousands of atoms. However, there are still systems where quantum mechanical accuracy is desired, but scalability proves to be a hindrance, such as large biological molecules or complex interfaces. We will present an overview of our work on new algorithms, which offer improved scalability by implementing another layer of parallelism, and by optimizing communication and memory management. Support provided by the SciDAC program, Department of Energy, Office of Science, Advanced Scientific Computing Research and Basic Energy Sciences. Grant Numbers DE-SC0008877 (Austin) and DE-FG02-12ER4 (Berkeley).

  3. Size dependence of structural stability and magnetization of nickel clusters from real-space pseudopotentials

    NASA Astrophysics Data System (ADS)

    Sakurai, Masahiro; Souto-Casares, Jaime; Chelikowsky, James R.

    2016-07-01

    We examine the structural stability and magnetization for nickel clusters containing up to 500 atoms by performing first-principles calculations based on pseudopotential in real space computed within density-functional theory. After structural relaxation, Ni clusters in this size range favor either an fcc structure, which is a crystal structure in bulk, or an icosahedral structure, which is expected for small clusters. The calculated total magnetic moments per atom of energetically stable clusters agree well with experiment, wherein the moments decrease nonmonotonically toward the bulk value as the cluster size increases. We analyze the spatial distribution of the local magnetic moment, which explains why the magnetic moments of Ni clusters are enhanced compared to their bulk value.

  4. Bounding the costs of quantum simulation of many-body physics in real space

    NASA Astrophysics Data System (ADS)

    Kivlichan, Ian D.; Wiebe, Nathan; Babbush, Ryan; Aspuru-Guzik, Alán

    2017-07-01

    We present a quantum algorithm for simulating the dynamics of a first-quantized Hamiltonian in real space based on the truncated Taylor series algorithm. We avoid the possibility of singularities by applying various cutoffs to the system and using a high-order finite difference approximation to the kinetic energy operator. We find that our algorithm can simulate η interacting particles using a number of calculations of the pairwise interactions that scales, for a fixed spatial grid spacing, as \\tilde{O}(η^2) , versus the \\tilde{O}(η^5) time required by previous methods (assuming the number of orbitals is proportional to η), and scales super-polynomially better with the error tolerance than algorithms based on the Lie-Trotter-Suzuki product formula. Finally, we analyze discretization errors that arise from the spatial grid and show that under some circumstances these errors can remove the exponential speedups typically afforded by quantum simulation.

  5. Probing critical surfaces in momentum space using real-space entanglement entropy: Bose versus Fermi

    NASA Astrophysics Data System (ADS)

    Lai, Hsin-Hua; Yang, Kun

    2016-03-01

    A codimension-one critical surface in momentum space can be either a familiar Fermi surface, which separates occupied states from empty ones in the noninteracting fermion case, or a novel Bose surface, where gapless bosonic excitations are anchored. The presence of such surfaces gives rise to logarithmic violation of entanglement entropy area law. When they are convex, we show that the shape of these critical surfaces can be determined by inspecting the leading logarithmic term of real-space entanglement entropy. The fundamental difference between a Fermi surface and a Bose surface is revealed by the fact that the logarithmic terms in entanglement entropies differ by a factor of 2: SlogBose=2 SlogFermi , even when they have identical geometry. Our method has remarkable similarity with determining Fermi surface shape using quantum oscillation. We also discuss possible probes of concave critical surfaces in momentum space.

  6. Probing the Nodal Structure of Landau Level Wave Functions in Real Space.

    PubMed

    Bindel, J R; Ulrich, J; Liebmann, M; Morgenstern, M

    2017-01-06

    The inversion layer of p-InSb(110) obtained by Cs adsorption of 1.8% of a monolayer is used to probe the Landau level wave functions within smooth potential valleys by scanning tunneling spectroscopy at 14 T. The nodal structure becomes apparent as a double peak structure of each spin polarized first Landau level, while the zeroth Landau level exhibits a single peak per spin level only. The real space data show single rings of the valley-confined drift states for the zeroth Landau level and double rings for the first Landau level. The result is reproduced by a recursive Green function algorithm using the potential landscape obtained experimentally. We show that the result is generic by comparing the local density of states from the Green function algorithm with results from a well-controlled analytic model based on the guiding center approach.

  7. Computational Methodologies for Real-Space Structural Refinement of Large Macromolecular Complexes.

    PubMed

    Goh, Boon Chong; Hadden, Jodi A; Bernardi, Rafael C; Singharoy, Abhishek; McGreevy, Ryan; Rudack, Till; Cassidy, C Keith; Schulten, Klaus

    2016-07-05

    The rise of the computer as a powerful tool for model building and refinement has revolutionized the field of structure determination for large biomolecular systems. Despite the wide availability of robust experimental methods capable of resolving structural details across a range of spatiotemporal resolutions, computational hybrid methods have the unique ability to integrate the diverse data from multimodal techniques such as X-ray crystallography and electron microscopy into consistent, fully atomistic structures. Here, commonly employed strategies for computational real-space structural refinement are reviewed, and their specific applications are illustrated for several large macromolecular complexes: ribosome, virus capsids, chemosensory array, and photosynthetic chromatophore. The increasingly important role of computational methods in large-scale structural refinement, along with current and future challenges, is discussed.

  8. COMPUTATIONAL METHODOLOGIES for REAL-SPACE STRUCTURAL REFINEMENT of LARGE MACROMOLECULAR COMPLEXES

    PubMed Central

    Goh, Boon Chong; Hadden, Jodi A.; Bernardi, Rafael C.; Singharoy, Abhishek; McGreevy, Ryan; Rudack, Till; Cassidy, C. Keith; Schulten, Klaus

    2017-01-01

    The rise of the computer as a powerful tool for model building and refinement has revolutionized the field of structure determination for large biomolecular systems. Despite the wide availability of robust experimental methods capable of resolving structural details across a range of spatiotemporal resolutions, computational hybrid methods have the unique ability to integrate the diverse data from multimodal techniques such as X-ray crystallography and electron microscopy into consistent, fully atomistic structures. Here, commonly employed strategies for computational real-space structural refinement are reviewed, and their specific applications are illustrated for several large macromolecular complexes: ribosome, virus capsids, chemosensory array, and photosynthetic chromatophore. The increasingly important role of computational methods in large-scale structural refinement, along with current and future challenges, is discussed. PMID:27145875

  9. Probing the Nodal Structure of Landau Level Wave Functions in Real Space

    NASA Astrophysics Data System (ADS)

    Bindel, J. R.; Ulrich, J.; Liebmann, M.; Morgenstern, M.

    2017-01-01

    The inversion layer of p -InSb (110 ) obtained by Cs adsorption of 1.8% of a monolayer is used to probe the Landau level wave functions within smooth potential valleys by scanning tunneling spectroscopy at 14 T. The nodal structure becomes apparent as a double peak structure of each spin polarized first Landau level, while the zeroth Landau level exhibits a single peak per spin level only. The real space data show single rings of the valley-confined drift states for the zeroth Landau level and double rings for the first Landau level. The result is reproduced by a recursive Green function algorithm using the potential landscape obtained experimentally. We show that the result is generic by comparing the local density of states from the Green function algorithm with results from a well-controlled analytic model based on the guiding center approach.

  10. Accurate Nanoscale Crystallography in Real-Space Using Scanning Transmission Electron Microscopy.

    PubMed

    Dycus, J Houston; Harris, Joshua S; Sang, Xiahan; Fancher, Chris M; Findlay, Scott D; Oni, Adedapo A; Chan, Tsung-Ta E; Koch, Carl C; Jones, Jacob L; Allen, Leslie J; Irving, Douglas L; LeBeau, James M

    2015-08-01

    Here, we report reproducible and accurate measurement of crystallographic parameters using scanning transmission electron microscopy. This is made possible by removing drift and residual scan distortion. We demonstrate real-space lattice parameter measurements with <0.1% error for complex-layered chalcogenides Bi2Te3, Bi2Se3, and a Bi2Te2.7Se0.3 nanostructured alloy. Pairing the technique with atomic resolution spectroscopy, we connect local structure with chemistry and bonding. Combining these results with density functional theory, we show that the incorporation of Se into Bi2Te3 causes charge redistribution that anomalously increases the van der Waals gap between building blocks of the layered structure. The results show that atomic resolution imaging with electrons can accurately and robustly quantify crystallography at the nanoscale.

  11. Facilitated spin models in one dimension: a real-space renormalization group study.

    PubMed

    Whitelam, Stephen; Garrahan, Juan P

    2004-10-01

    We use a real-space renormalization group (RSRG) to study the low-temperature dynamics of kinetically constrained Ising chains (KCICs). We consider the cases of the Fredrickson-Andersen (FA) model, the East model, and the partially asymmetric KCIC. We show that the RSRG allows one to obtain in a unified manner the dynamical properties of these models near their zero-temperature critical points. These properties include the dynamic exponent, the growth of dynamical length scales, and the behavior of the excitation density near criticality. For the partially asymmetric chain, the RG predicts a crossover, on sufficiently large length and time scales, from East-like to FA-like behavior. Our results agree with the known results for KCICs obtained by other methods.

  12. Van Allen Probes Observations of Direct Wave Particle Interactions

    NASA Astrophysics Data System (ADS)

    Fennell, J. F.; Roeder, J. L.; Kurth, W. S.; Henderson, M. G.; Larsen, B.; Hospodarsky, G. B.; Blake, J. B.; Claudepierre, S. G.; Clemmons, J. H.; Spence, H.; Funsten, H. O.; Reeves, G. D.; Kletzing, C.; Wygant, J. R.

    2013-12-01

    We present observations of wave-particle interactions observed on the Van Allen Probes during an interval of sporadic increases or bursts of 20-30 keV electron fluxes observed in conjunction with bursts of chorus activity. The electron flux and chorus burst occurred on a nearly one for one basis during an hour interval on January 13, 2013. The electron angular distributions changed during the burst events such that flux increases evolved from Sinn(α) type angular distributions to form maxima in the electron angular distributions at 75-80° local pitch angle with the fluxes at 90° and <60° remaining the same as in the pre and post burst distributions. These events occurred well outside the plasmasphere following a minor plasma injection. They were observed on both Van Allen Probes spacecraft, which were relatively close together. The plasma density, electron gyro-frequency and pitch angle of peak flux in a burst was used to estimate the resonant electron energy. The result of ~25 keV is consistent with the energies of the electrons showing the flux enhancements observed by the ECT/MagEIS and ECT/HOPE spectrometers. These results will be described in detail and questions concerning the source of such events will be discussed.

  13. Catching the electron in action in real space inside a Ge-Si core-shell nanowire transistor.

    PubMed

    Jaishi, Meghnath; Pati, Ranjit

    2017-09-21

    Catching the electron in action in real space inside a semiconductor Ge-Si core-shell nanowire field effect transistor (FET), which has been demonstrated (J. Xiang, W. Lu, Y. Hu, Y. Wu, H. Yan and C. M. Lieber, Nature, 2006, 441, 489) to outperform the state-of-the-art metal oxide semiconductor FET, is central to gaining unfathomable access into the origin of its functionality. Here, using a quantum transport approach that does not make any assumptions on electronic structure, charge, and potential profile of the device, we unravel the most probable tunneling pathway for electrons in a Ge-Si core-shell nanowire FET with orbital level spatial resolution, which demonstrates gate bias induced decoupling of electron transport between the core and the shell region. Our calculation yields excellent transistor characteristics as noticed in the experiment. Upon increasing the gate bias beyond a threshold value, we observe a rapid drop in drain current resulting in a gate bias driven negative differential resistance behavior and switching in the sign of trans-conductance. We attribute this anomalous behavior in drain current to the gate bias induced modification of the carrier transport pathway from the Ge core to the Si shell region of the nanowire channel. A new experiment involving a four probe junction is proposed to confirm our prediction on gate bias induced decoupling.

  14. The nature of the redshift and directly observed quasar statistics.

    PubMed

    Segal, I E; Nicoll, J F; Wu, P; Zhou, Z

    1991-07-01

    The nature of the cosmic redshift is one of the most fundamental questions in modern science. Hubble's discovery of the apparent Expansion of the Universe is derived from observations on a small number of galaxies at very low redshifts. Today, quasar redshifts have a range more than 1000 times greater than those in Hubble's sample, and represent more than 100 times as many objects. A recent comprehensive compilation of published measurements provides the basis for a study indicating that quasar observations are not in good agreement with the original predictions of the Expanding Universe theory, but are well fit by the predictions of an alternative theory having fewer adjustable parameters.

  15. Direct observation of up-conversion via femtosecond photoelectron imaging

    NASA Astrophysics Data System (ADS)

    Liu, Yuzhu; Knopp, Gregor; Gerber, Thomas

    2015-10-01

    Ultrafast relaxation dynamics in 2-methylfuran has been investigated by time-resolved photoelectron imaging. An "up" internal conversion from a low-lying state into a higher-lying one has been observed experimentally. Temporal photoelectron kinetic-energy distributions and angular distributions of the photoelectrons are analyzed. In the up-conversion process, the vibrational energy in the initial state is converted to the electronic energy of the final state during the energy transfer. And the time scale for the up-conversion process is estimated by the observed onset delay for the corresponding photoelectron bands.

  16. Direct Observations of Nucleation in a Nondilute Multicomponent Alloy

    NASA Technical Reports Server (NTRS)

    Sudbrack, Chantal K.; Noebe, Ronald D.; Seidman, David N.

    2006-01-01

    The chemical pathways leading to gamma'(L1(sub 2)) nucleation from nondilute Ni-5.2 Al-14.2 Cr at. %, gama(fcc), at 873 K are followed with radial distribution functions and isoconcentration surface analyses of direct-space atom-probe tomographic images. Although Cr atoms initially are randomly distributed, a distribution of congruent Ni3Al short-range-order domains (SRO), [R] approx. equals 0.6 nm, results from Al diffusion during quenching. Domain site occupancy develops as their number density increases leading to Al-rich phase separation by gamma'-nucleation, [R]=0.75 nm, after SRO occurs.

  17. Direct Observations of Nucleation in a Nondilute Multicomponent Alloy

    NASA Technical Reports Server (NTRS)

    Sudbrack, Chantal K.; Noebe, Ronald D.; Seidman, David N.

    2006-01-01

    The chemical pathways leading to gamma'(L1(sub 2)) nucleation from nondilute Ni-5.2 Al-14.2 Cr at. %, gama(fcc), at 873 K are followed with radial distribution functions and isoconcentration surface analyses of direct-space atom-probe tomographic images. Although Cr atoms initially are randomly distributed, a distribution of congruent Ni3Al short-range-order domains (SRO), [R] approx. equals 0.6 nm, results from Al diffusion during quenching. Domain site occupancy develops as their number density increases leading to Al-rich phase separation by gamma'-nucleation, [R]=0.75 nm, after SRO occurs.

  18. Observations of directional gamma prime coarsening during engine operation

    NASA Technical Reports Server (NTRS)

    Draper, Susan L.; Hull, David R.; Dreshfield, Robert L.

    1987-01-01

    Two alloys with negative mismatch parameters, NASAIR 100 and a modified NASAIR 100 called Alloy 3 were run as turbine blades in an experimental ground based Garret TFE731 engine for up to 200 hr. The directional coarsening of gamma prime (rafting) that developed during engine testing was analyzed and compared to previous research from laboratory tests. The blades were found to be rafted normal to the centrifugal stress axis over much of the span, but near the surfaces, the blades were found to be rafted parallel to the centrifugal stress axis for certain cycles. Representative photomicrographs of the blades and the effects of stress and temperature on raft formation are shown.

  19. Ultrafast bandgap photonics for IR directional countermeasures and low observables

    NASA Astrophysics Data System (ADS)

    Rafailov, Michael K.

    2011-06-01

    Ultrafast Bandgap Photonics is discussed as an alternative technology for laser-based Directional IR Counter Measures (DIRCM). Ultra-fast laser is capable of providing fundamentally different type of countermeasure which is able to counter all generations of heat-seeking missiles. Ultrafast Bandgap Photonic technology is compatible with existing laser based DIRCM pointing systems as it requires much less energy per pulse and peak power than damage inducing systems. A foundation of ultra-fast technology is its ability to remotely alter seeker characteristics. In this paper, we will consider the effects caused by relatively low energy per pulse ultra-fast and, to some extent, fast lasers.

  20. Clear Direction. The Montessori Observer. Volume 32, Number 2

    ERIC Educational Resources Information Center

    International Montessori Society (NJ3), 2011

    2011-01-01

    "The Montessori Observer" is mailed four times each year, in March, May, September and November, to Society members throughout the world. The purpose is to provide news and information about the Society's work in Montessori education, and to extend awareness of Montessori principles throughout the world. This issue contains a feature…

  1. Direct observation of warping in the plasma sheet of Saturn

    NASA Astrophysics Data System (ADS)

    Carbary, J. F.; Mitchell, D. G.; Paranicas, C.; Roelof, E. C.; Krimigis, S. M.

    2008-12-01

    The ENA images from the Ion Neutral CAmera (INCA) on the Cassini spacecraft are projected onto the noon-midnight plane of Sun-Saturn orbital coordinates, and a composite ``image'' of Saturn's plasma sheet is constructed from dawn-side observations of 20-50 keV hydrogens obtained from days 352 to 361 in 2004. The maxima in the intensity contours define the center of the plasma sheet in the noon-midnight plane. This plasma sheet surface displays a distinct bending or ``warping'' above Saturn's equatorial plane at radial distances of beyond ~15 RS on the nightside. On the dayside, the plasma sheet lies close to the equator all the way to the magnetopause. The observed warping agrees with the ``bowl'' model derived from measurements of Saturn's magnetic field, but fits more closely a simple third-order polynomial.

  2. Direct observations of atomic diffusion by scanning transmission electron microscopy

    PubMed Central

    Isaacson, M.; Kopf, D.; Utlaut, M.; Parker, N. W.; Crewe, A. V.

    1977-01-01

    The feasibility of using a high-resolution scanning transmission electron microscope to study the diffusion of heavy atoms on thin film substrates of low atomic number has been investigated. We have shown that it is possible to visualize the diffusion of individual uranium atoms adsorbed to thin carbon film substrates and that the observed motion of the atoms does not appear to be induced by the incident electron beam. Images PMID:16592396

  3. Van Allen Probes observations of direct wave-particle interactions

    NASA Astrophysics Data System (ADS)

    Fennell, J. F.; Roeder, J. L.; Kurth, W. S.; Henderson, M. G.; Larsen, B. A.; Hospodarsky, G.; Wygant, J. R.; Claudepierre, J. S. G.; Blake, J. B.; Spence, H. E.; Clemmons, J. H.; Funsten, H. O.; Kletzing, C. A.; Reeves, G. D.

    2014-03-01

    Quasiperiodic increases, or "bursts," of 17-26 keV electron fluxes in conjunction with chorus wave bursts were observed following a plasma injection on 13 January 2013. The pitch angle distributions changed during the burst events, evolving from sinN(α) to distributions that formed maxima at α = 75-80°, while fluxes at 90° and <60° remained nearly unchanged. The observations occurred outside of the plasmasphere in the postmidnight region and were observed by both Van Allen Probes. Density, cyclotron frequency, and pitch angle of the peak flux were used to estimate resonant electron energy. The result of ~15-35 keV is consistent with the energies of the electrons showing the flux enhancements and corresponds to electrons in and above the steep flux gradient that signals the presence of an Alfvén boundary in the plasma. The cause of the quasiperiodic nature (on the order of a few minutes) of the bursts is not understood at this time.

  4. Direct Observation of Nanoparticle-Cancer Cell Nucleus Interactions

    PubMed Central

    Dam, Duncan Hieu M.; Lee, Jung Heon; Sisco, Patrick N.; Co, Dick T.; Zhang, Ming; Wasielewski, Michael R.; Odom, Teri W.

    2012-01-01

    We report the direct visualization of interactions between drug-loaded nanoparticles and the cancer cell nucleus. Nanoconstructs composed of nucleolin-specific aptamers and gold nanostars were actively transported to the nucleus and induced major changes to the nuclear phenotype via nuclear envelope invaginations near the site of the construct. The number of local deformations could be increased by ultra-fast, light-triggered release of the aptamers from the surface of the gold nanostars. Cancer cells with more nuclear envelope folding showed increased caspase 3 and 7 activity (apoptosis) as well as decreased cell viability. This newly revealed correlation between drug-induced changes in nuclear phenotype and increased therapeutic efficacy could provide new insight for nuclear-targeted cancer therapy. PMID:22424173

  5. Direct observation of closure domain wall mediated spin waves

    SciTech Connect

    Mozooni, Babak McCord, Jeffrey

    2015-07-27

    The generation and guiding of spin waves from and by magnetic domain walls are demonstrated. The spin waves radiate from pinned and oscillating magnetic closure domain walls and propagate linearly along a narrow path formed by the surrounding 180° asymmetric Bloch domain walls. The propagating spin wave modes are directly visualized by time-resolved magneto-optical Kerr microscopy with picosecond temporal resolution. A linear relationship between excitation frequency, wavelength, and number of spin waves per domain exists. Independent of the field excitation frequency, a constant phase velocity of spin waves propagation is obtained. Spin waves characteristics can be tuned by varying the magnetic domain dynamics, allowing for variable spin wave characteristics with magnetic field characteristics and histories.

  6. Direct observation of coherent energy transfer in nonlinear micromechanical oscillators.

    PubMed

    Chen, Changyao; Zanette, Damián H; Czaplewski, David A; Shaw, Steven; López, Daniel

    2017-05-26

    Energy dissipation is an unavoidable phenomenon of physical systems that are directly coupled to an external environmental bath. In an oscillatory system, it leads to the decay of the oscillation amplitude. In situations where stable oscillations are required, the energy dissipated by the vibrations is usually compensated by replenishment from external energy sources. Consequently, if the external energy supply is removed, the amplitude of oscillations start to decay immediately, since there is no means to restitute the energy dissipated. Here, we demonstrate a novel dissipation engineering strategy that can support stable oscillations without supplying external energy to compensate losses. The fundamental intrinsic mechanism of resonant mode coupling is used to redistribute and store mechanical energy among vibrational modes and coherently transfer it back to the principal mode when the external excitation is off. To experimentally demonstrate this phenomenon, we exploit the nonlinear dynamic response of microelectromechanical oscillators to couple two different vibrational modes through an internal resonance.

  7. Direct observation of nanoparticle-cancer cell nucleus interactions.

    PubMed

    Dam, Duncan Hieu M; Lee, Jung Heon; Sisco, Patrick N; Co, Dick T; Zhang, Ming; Wasielewski, Michael R; Odom, Teri W

    2012-04-24

    We report the direct visualization of interactions between drug-loaded nanoparticles and the cancer cell nucleus. Nanoconstructs composed of nucleolin-specific aptamers and gold nanostars were actively transported to the nucleus and induced major changes to the nuclear phenotype via nuclear envelope invaginations near the site of the construct. The number of local deformations could be increased by ultrafast, light-triggered release of the aptamers from the surface of the gold nanostars. Cancer cells with more nuclear envelope folding showed increased caspase 3 and 7 activity (apoptosis) as well as decreased cell viability. This newly revealed correlation between drug-induced changes in nuclear phenotype and increased therapeutic efficacy could provide new insight for nuclear-targeted cancer therapy.

  8. Observations of directional gamma prime coarsening during engine operation

    NASA Technical Reports Server (NTRS)

    Draper, S.; Hull, D.; Dreshfield, R.

    1989-01-01

    Two alloys, NASAIR 100 and a modified NASAIR 100 called Alloy 3, were run as turbine blades in an experimental ground-based Garrett TFE731 engine for up to 200 hours. The stress induced directional coarsening of gamma-prime (rafting) that developed during engine testing was analyzed and compared to previous research from laboratory tests. The blades were found to have formed a lamellar structure, the lamellae being normal to the centrifugal stress axis over much of the span. However, near the surfaces, the blades were found to have formed lamellae parallel to the centrifugal stress axis for certain cycles. Representative photomicrographs of the blades and the effects of stress and temperature on lamellae formation are shown.

  9. Direct observation of coherent energy transfer in nonlinear micromechanical oscillators

    NASA Astrophysics Data System (ADS)

    Chen, Changyao; Zanette, Damián H.; Czaplewski, David A.; Shaw, Steven; López, Daniel

    2017-05-01

    Energy dissipation is an unavoidable phenomenon of physical systems that are directly coupled to an external environmental bath. In an oscillatory system, it leads to the decay of the oscillation amplitude. In situations where stable oscillations are required, the energy dissipated by the vibrations is usually compensated by replenishment from external energy sources. Consequently, if the external energy supply is removed, the amplitude of oscillations start to decay immediately, since there is no means to restitute the energy dissipated. Here, we demonstrate a novel dissipation engineering strategy that can support stable oscillations without supplying external energy to compensate losses. The fundamental intrinsic mechanism of resonant mode coupling is used to redistribute and store mechanical energy among vibrational modes and coherently transfer it back to the principal mode when the external excitation is off. To experimentally demonstrate this phenomenon, we exploit the nonlinear dynamic response of microelectromechanical oscillators to couple two different vibrational modes through an internal resonance.

  10. Direct observation of coherent energy transfer in nonlinear micromechanical oscillators

    PubMed Central

    Chen, Changyao; Zanette, Damián H.; Czaplewski, David A.; Shaw, Steven; López, Daniel

    2017-01-01

    Energy dissipation is an unavoidable phenomenon of physical systems that are directly coupled to an external environmental bath. In an oscillatory system, it leads to the decay of the oscillation amplitude. In situations where stable oscillations are required, the energy dissipated by the vibrations is usually compensated by replenishment from external energy sources. Consequently, if the external energy supply is removed, the amplitude of oscillations start to decay immediately, since there is no means to restitute the energy dissipated. Here, we demonstrate a novel dissipation engineering strategy that can support stable oscillations without supplying external energy to compensate losses. The fundamental intrinsic mechanism of resonant mode coupling is used to redistribute and store mechanical energy among vibrational modes and coherently transfer it back to the principal mode when the external excitation is off. To experimentally demonstrate this phenomenon, we exploit the nonlinear dynamic response of microelectromechanical oscillators to couple two different vibrational modes through an internal resonance. PMID:28548088

  11. 10 CFR 26.115 - Collecting a urine specimen under direct observation.

    Code of Federal Regulations, 2010 CFR

    2010-01-01

    ... 10 Energy 1 2010-01-01 2010-01-01 false Collecting a urine specimen under direct observation. 26... for Testing § 26.115 Collecting a urine specimen under direct observation. (a) Procedures for... specimen under direct observation, the collector shall obtain the agreement of the FFD program manager or...

  12. Task Learning of an Arm Robot in Real Space by Using a Learning System in Virtual Space

    NASA Astrophysics Data System (ADS)

    Tsubone, Tadashi; Kurimoto, Kenichi; Sugiyama, Koichi; Wada, Yasuhiro

    Reinforced learning by which a robot acquires control rules through trial and error has gotten a lot of attention. However, it is quite difficult for robots to acquire control rules by reinforcement learning in real space because many learning trials are needed to achieve the control rules; the robot itself may lose control, or there may be safety problems with the control objects. In this paper, we propose a method in which a robot in real space learns a virtual task; then the task is transferred from virtual to real space. The robot eventually acquires the task in a real environment. We show that a real robot can acquire a task in virtual space with an input device by an example of an inverted pendulum. Next, we verify availability that the acquired task in virtual space can be applied to a real world task. We emphasize the utilization of virtual space to effectively obtain the real world task.

  13. Direct Observation of Ultralow Vertical Emittance using a Vertical Undulator

    SciTech Connect

    Wootton, Kent

    2015-09-17

    In recent work, the first quantitative measurements of electron beam vertical emittance using a vertical undulator were presented, with particular emphasis given to ultralow vertical emittances [K. P. Wootton, et al., Phys. Rev. ST Accel. Beams, 17, 112802 (2014)]. Using this apparatus, a geometric vertical emittance of 0.9 #6;± 0.3 pm rad has been observed. A critical analysis is given of measurement approaches that were attempted, with particular emphasis on systematic and statistical uncertainties. The method used is explained, compared to other techniques and the applicability of these results to other scenarios discussed.

  14. Direct observation of magnetic metastability in individual iron nanoparticles.

    PubMed

    Balan, Ana; Derlet, Peter M; Rodríguez, Arantxa Fraile; Bansmann, Joachim; Yanes, Rocio; Nowak, Ulrich; Kleibert, Armin; Nolting, Frithjof

    2014-03-14

    X-ray photoemission electron microscopy combined with x-ray magnetic circular dichroism is used to study the magnetic properties of individual iron nanoparticles with sizes ranging from 20 down to 8 nm. While the magnetocrystalline anisotropy of bulk iron suggests superparamagnetic behavior in this size range, ferromagnetically blocked particles are also found at all sizes. Spontaneous transitions from the blocked state to the superparamagnetic state are observed in single particles and suggest that the enhanced magnetic energy barriers in the ferromagnetic particles are due to metastable, structurally excited states with unexpected life times.

  15. Direct Observation of Entropic Stabilization of bcc Crystals Near Melting

    NASA Astrophysics Data System (ADS)

    Sprakel, Joris; Zaccone, Alessio; Spaepen, Frans; Schall, Peter; Weitz, David A.

    2017-02-01

    Crystals with low latent heat are predicted to melt from an entropically stabilized body-centered cubic symmetry. At this weakly first-order transition, strongly correlated fluctuations are expected to emerge, which could change the nature of the transition. Here we show how large fluctuations stabilize bcc crystals formed from charged colloids, giving rise to strongly power-law correlated heterogeneous dynamics. Moreover, we find that significant nonaffine particle displacements lead to a vanishing of the nonaffine shear modulus at the transition. We interpret these observations by reformulating the Born-Huang theory to account for nonaffinity, illustrating a scenario of ordered solids reaching a state where classical lattice dynamics fail.

  16. Direct Observation of Critical Point Wetting in Microgravity

    NASA Technical Reports Server (NTRS)

    Kaukler, W. F.

    1985-01-01

    The objective of this program is to observe the interface shape in single and multicomponent systems at the onset of critical wetting in microgravity using the MSFC drop tower and KC-135 aircraft. Test cells for the drop facility were built and tested up to critical point of CCl. Low temperature drops were conducted for two-component systems near the critical consolute point. Contact angle seems to approach 90 deg near the critical consolute temperature contrary to expectations. It is suspected that since the interfacial energy becomes vanishingly small at the critical consolute temperature, the interface shape has not reached equilibrium in the available low-gravity time.

  17. Internal waves in the Aral Sea: the first direct observations

    NASA Astrophysics Data System (ADS)

    Khymchenko, Ielizaveta; Serebryany, Andrey; Zavialov, Peter

    2014-05-01

    At present time the Aral sea represents an ultrahaline basin (maximum of salinity is about 120 g/kg) characterized with sharp vertical stratification, which implies development of baroclinic processes. In October 2013 during the latest expedition of the Institute of Oceanology at Large Aral Sea observations aimed specifically at investigating the internal waves were conducted for the first time. The measurements were performed using 4 moored stations equipped with thermistor chains. Moored stations were located at the vertices of a rectangle with sides 10 and 13 km, so that 2 stations were situated at the western and 2 stations at the eastern shores of the basin. The stations were installed at a depth of 23-25 m. Recording was carried out continuously with sampling rate of 30 seconds during 6 days. During the observation, the position of thermocline was at a depth of 20-21 m, with a maximum depth of the sea 37 m. According to the wind conditions, all measurement period was divided into 3 parts. At first, the weather was calm, but after a few days there was a 1 day long intensification of the southwestern wind. Then there was a period of calm wind again. Both long-period and short-period internal waves were identified in the data record. In particular, we observed internal seiche oscillations with a period of 10-11 hours and vertical displacements of about 5 m. Short-period internal waves with periods from several minutes and heights of 1 m and less were also registered. After the period of strong wind, at one station periodically appearing and disappearing temperature inversions were observed. Temperature records of thermistors were analyzed in detail. Frequency and spatial spectral analysis of internal waves was performed. Dispersion curves for the real stratification of the Aral Sea were calculated and compared with the experimental data. This work was partly supported by the Ministry of science and education of the Russian Federation and Russian Foundation for

  18. Direct observation of intermediate states in model membrane fusion

    PubMed Central

    Keidel, Andrea; Bartsch, Tobias F.; Florin, Ernst-Ludwig

    2016-01-01

    We introduce a novel assay for membrane fusion of solid supported membranes on silica beads and on coverslips. Fusion of the lipid bilayers is induced by bringing an optically trapped bead in contact with the coverslip surface while observing the bead’s thermal motion with microsecond temporal and nanometer spatial resolution using a three-dimensional position detector. The probability of fusion is controlled by the membrane tension on the particle. We show that the progression of fusion can be monitored by changes in the three-dimensional position histograms of the bead and in its rate of diffusion. We were able to observe all fusion intermediates including transient fusion, formation of a stalk, hemifusion and the completion of a fusion pore. Fusion intermediates are characterized by axial but not lateral confinement of the motion of the bead and independently by the change of its rate of diffusion due to the additional drag from the stalk-like connection between the two membranes. The detailed information provided by this assay makes it ideally suited for studies of early events in pure lipid bilayer fusion or fusion assisted by fusogenic molecules. PMID:27029285

  19. Direct observation of ice nucleation events on individual atmospheric particles

    SciTech Connect

    Wang, Bingbing; Knopf, Daniel A.; China, Swarup; Arey, Bruce W.; Harder, Tristan H.; Gilles, Mary K.; Laskin, Alexander

    2016-01-01

    Heterogeneous ice nucleation is a physical chemistry process of critical relevance to a range of topics in the fundamental and the applied sciences and technologies. Heterogeneous ice nucleation remains insufficiently understood. This is in part due to the lack of experimental methods capable of in situ visualization of ice formation over nucleating substrates with microscopically characterized morphology and composition. We present development, validation and first applications of a novel electron microscopy platform allowing observation of individual ice nucleation events at temperature and relative humidity (RH) relevant for ice formation in a broad range of environmental and applied technology processes. The approach utilizes a custom-built ice nucleation cell, interfaced with an Environmental Scanning Electron Microscope (IN-ESEM system). The IN-ESEM system allows dynamic observations of individual ice formation events over particles of atmospheric relevance and determination of the ice nucleation mechanisms. Additional IN-ESEM experiments allow examination of the location of ice formation on the surface of individual particles and micro-spectroscopy analysis of the ice nucleating particles (INPs). This includes elemental composition detected by the energy dispersed analysis of X-rays (EDX), speciation of the organic content in particles using scanning transmission X-ray microscopy with near edge X-ray absorption fine structure spectroscopy (STXM/NEXAFS), and Helium ion microscopy (HeIM). The capabilities of the IN-ESEM experimental platform are demonstrated first on laboratory standards and then by chemical imaging of INPs using a complex sample of ambient particles.

  20. Direct observation of intermediate states in model membrane fusion

    NASA Astrophysics Data System (ADS)

    Keidel, Andrea; Bartsch, Tobias F.; Florin, Ernst-Ludwig

    2016-03-01

    We introduce a novel assay for membrane fusion of solid supported membranes on silica beads and on coverslips. Fusion of the lipid bilayers is induced by bringing an optically trapped bead in contact with the coverslip surface while observing the bead’s thermal motion with microsecond temporal and nanometer spatial resolution using a three-dimensional position detector. The probability of fusion is controlled by the membrane tension on the particle. We show that the progression of fusion can be monitored by changes in the three-dimensional position histograms of the bead and in its rate of diffusion. We were able to observe all fusion intermediates including transient fusion, formation of a stalk, hemifusion and the completion of a fusion pore. Fusion intermediates are characterized by axial but not lateral confinement of the motion of the bead and independently by the change of its rate of diffusion due to the additional drag from the stalk-like connection between the two membranes. The detailed information provided by this assay makes it ideally suited for studies of early events in pure lipid bilayer fusion or fusion assisted by fusogenic molecules.

  1. Direct Experimental Observation of a Practical AC Zeeman Force

    NASA Astrophysics Data System (ADS)

    Fancher, Charles; Pyle, Andrew; Rotunno, Andrew; Du, Shuangli; Aubin, Seth

    2016-05-01

    We present measurements of the spin-dependent AC Zeeman force produced by microwave magnetic near-field gradients on an atom chip. We measure the AC Zeeman force on ultracold 87 Rb atoms by observing its effect on the motion of atoms in free-fall and on those confined in a trap. We have studied the force as a function of microwave frequency detuning from a hyperfine transition at 6.8 GHz at several magnetic field strengths and have observed its characteristic bipolar and resonant features predicted by two-level dressed atom theory. We find that the force is several times the strength of gravity in our setup, and that it can be targeted to a specific hyperfine transition while leaving other hyperfine states and transitions relatively unaffected. We find that our measurements are reasonably consistent with theory and are working towards a parameter-free comparison. AC Zeeman potentials offer the possibility of targeting qualitatively different trapping potentials to different spin states, a capability currently absent from the toolbox of atomic quantum control techniques. In particular, an AC Zeeman potential could be used as the beamsplitter for a spin-dependent atom interferometer or for engineering a quantum gate. Work supported by AFOSR and W&M, and in part by AFRL.

  2. Direct observation of coherent energy transfer in nonlinear micromechanical oscillators

    DOE PAGES

    Chen, Changyao; Zanette, Damian H.; Czaplewski, David A.; ...

    2017-05-26

    Energy dissipation is an unavoidable phenomenon of physical systems that are directly coupled to an external environmental bath. In an oscillatory system, it leads to the decay of the oscillation amplitude. In situations where stable oscillations are required, the energy dissipated by the vibrations is usually compensated by replenishment from external energy sources. Consequently, if the external energy supply is removed, the amplitude of oscillations start to decay immediately, since there is no means to restitute the energy dissipated. Here, we demonstrate a novel dissipation engineering strategy that can support stable oscillations without supplying external energy to compensate losses. Themore » fundamental intrinsic mechanism of resonant mode coupling is used to redistribute and store mechanical energy among vibrational modes and coherently transfer it back to the principal mode when the external excitation is off. To experimentally demonstrate this phenomenon, we exploit the nonlinear dynamic response of microelectromechanical oscillators to couple two different vibrational modes through an internal resonance.« less

  3. Direct observation of light focusing by single photoreceptor cell nuclei.

    PubMed

    Błaszczak, Zuzanna; Kreysing, Moritz; Guck, Jochen

    2014-05-05

    The vertebrate retina is inverted with respect to its optical function, which requires light to pass through the entire tissue prior to detection. The last significant barrier for photons to overcome is the outer nuclear layer formed by photoreceptor cell (PRC) nuclei. Here we experimentally characterise the optical properties of PRC nuclei using bright-field defocusing microscopy to capture near-field intensity distributions behind individual nuclei. We find that some nuclei efficiently focus incident light confirming earlier predictions based on comparative studies of chromatin organisation in nocturnal and diurnal mammals. The emergence of light focusing during the development of mouse nuclei highlights the acquired nature of the observed lens-like behaviour. Optical characterisation of these nuclei is an important first step towards an improved understanding of how light transmission through the retina is influenced by its constituents.

  4. Direct observation of brownian motion of lipids in a membrane.

    PubMed Central

    Lee, G M; Ishihara, A; Jacobson, K A

    1991-01-01

    Nanovid microscopy, which uses 30- to 40-nm colloidal gold probes combined with video-enhanced contrast, can be used to examine random and directed movements of individual molecules in the plasma membrane of living cells. To validate the technique in a model system, the movements of lipid molecules were followed in a supported, planar bilayer containing fluorescein-conjugated phosphatidylethanolamine (Fl-PtdEtn) labeled with 30-nm gold anti-fluorescein (anti-Fl). Multivalent gold probes were prepared by conjugating only anti-Fl to the gold. Paucivalent probes were prepared by mixing an irrelevant antibody with the anti-Fl prior to conjugation. The membrane-bound gold particles moved in random patterns that were indistinguishable from those produced by computer simulations of two-dimensional random motion. The multivalent gold probes had an average lateral diffusion coefficient (D) of 0.26 x 10(-8) cm2/sec, and paucivalent probes had an average D of 0.73 x 10(-8) cm2/sec. Sixteen percent of the multivalent and 50% of the paucivalent probes had values for D in excess of 0.6 x 10(-8) cm2/sec, which, after allowance for stochastic variation, are consistent with the D of 1.3 x 10(-8) cm2/sec measured by fluorescence recovery after photobleaching of Fl-PtdEtn in the planar bilayer. The effect of valency on diffusion suggests that the multivalent gold binds several lipids forming a disk up to 30-40 nm in diameter, resulting in reduced diffusion with respect to the paucivalent gold, which binds one or a very few lipids. Provided the valency of the gold probe is considered in the interpretation of the results. Nanovid microscopy is a valid method for analyzing the movements of single or small groups of molecules within membranes. Images PMID:1712486

  5. Direct observation of dynamic shear jamming in dense suspensions

    NASA Astrophysics Data System (ADS)

    Peters, Ivo R.; Majumdar, Sayantan; Jaeger, Heinrich M.

    2016-04-01

    Liquid-like at rest, dense suspensions of hard particles can undergo striking transformations in behaviour when agitated or sheared. These phenomena include solidification during rapid impact, as well as strong shear thickening characterized by discontinuous, orders-of-magnitude increases in suspension viscosity. Much of this highly non-Newtonian behaviour has recently been interpreted within the framework of a jamming transition. However, although jamming indeed induces solid-like rigidity, even a strongly shear-thickened state still flows and thus cannot be fully jammed. Furthermore, although suspensions are incompressible, the onset of rigidity in the standard jamming scenario requires an increase in particle density. Finally, whereas shear thickening occurs in the steady state, impact-induced solidification is transient. As a result, it has remained unclear how these dense suspension phenomena are related and how they are connected to jamming. Here we resolve this by systematically exploring both the steady-state and transient regimes with the same experimental system. We demonstrate that a fully jammed, solid-like state can be reached without compression and instead purely with shear, as recently proposed for dry granular systems. This state is created by transient shear-jamming fronts, which we track directly. We also show that shear stress, rather than shear rate, is the key control parameter. From these findings we map out a state diagram with particle density and shear stress as variables. We identify discontinuous shear thickening with a marginally jammed regime just below the onset of full, solid-like jamming. This state diagram provides a unifying framework, compatible with prior experimental and simulation results on dense suspensions, that connects steady-state and transient behaviour in terms of a dynamic shear-jamming process.

  6. Direct Observation of Completely Processed Calcium Carbonate Dust Particles

    SciTech Connect

    Laskin, Alexander; Iedema, Martin J.; Ichkovich, Aviad; Graber, Ellen R.; Taraniuk, Ilya; Rudich, Yinon

    2005-05-27

    This study presents, for the first time, field evidence of complete, irreversible processing of solid calcium carbonate (calcite)-containing particles and quantitative formation of liquid calcium nitrate particles apparently as a result of heterogeneous reaction of calcium carbonate-containing mineral dust particles with gaseous nitric acid. Formation of nitrates from individual calcite and sea salt particles was followed as a function of time in aerosol samples collected at Shoresh, Israel. Morphology and compositional changes of individual particles were observed using conventional scanning electron microscopy with energy dispersive analysis of X-rays (SEM/EDX) and computer controlled SEM/EDX. Environmental scanning electron microscopy (ESEM) was utilized to determine and demonstrate the hygroscopic behavior of calcium nitrate particles found in some of the samples. Calcium nitrate particles are exceptionally hygroscopic and deliquesce even at very low relative humidity (RH) of 9 -11% which is lower than typical atmospheric environments. Transformation of non-hygroscopic dry mineral dust particles into hygroscopic wet aerosol may have substantial impacts on light scattering properties, the ability to modify clouds and heterogeneous chemistry.

  7. Direct observation of OH formation from stabilised Criegee intermediates.

    PubMed

    Novelli, A; Vereecken, L; Lelieveld, J; Harder, H

    2014-10-07

    The syn-CH3CHOO Criegee intermediate formed from the ozonolysis of propene and (E)-2-butene was detected via unimolecular decomposition and subsequent detection of OH radicals by a LIF-FAGE instrument. An observed time dependent OH concentration profile was analysed using a detailed model focusing on the speciated chemistry of Criegee intermediates based on the recent literature. The absolute OH concentration was found to depend on the steady state concentration of syn-CH3CHOO at the injection point while the time dependence of the OH concentration profile was influenced by the sum of the rates of unimolecular decomposition of syn-CH3CHOO and wall loss. By varying the most relevant parameters influencing the SCI chemistry in the model and based on the temporal OH concentration profile, the unimolecular decomposition rate k (293 K) of syn-CH3CHOO was shown to lie within the range 3-30 s(-1), where a value of 20 ± 10 s(-1) yields the best agreement with the CI chemistry literature.

  8. Direct observation of resonance effects in laser cluster interactions

    SciTech Connect

    Zweiback, J. S.

    1999-06-01

    Time resolved dynamics of high intensity laser interactions with atomic clusters have been studied with both theoretical analysis and experiment. A short-pulse Ti:sapphire laser system, which could produce 50 mJ of energy in a 50 fs pulse, was built to perform these experiments. The laser used a novel single grating stretcher and was pumped, in part, by a custom Nd:YLF laser system, including 19 mm Nd:YLF amplifiers. It was found that there is an optimal pulse width to maximize absorption for a given cluster size. This optimal pulse width ranged from 400 fs for 85 A radius xenon clusters to 1.2 ps for 205 {angstrom} radius xenon clusters. Using a pump-probe configuration, the absorption of the probe radiation was observed to reach a maximum for a particular time delay between pump and probe, dependent on the cluster size. The delay for peak absorption was 800, 1400, and 2100 fs for 85 Å, 130 Å, and 170 Å radius xenon clusters respectively. Model calculations suggest that these effects are due to resonant heating of the spherical plasma in agreement with the hydrodynamic interpretation of cluster interactions. While this simple hydrodynamic code produces reasonable agreement with data, it does not include bulk plasma or non-linear propagation effects and is limited to the regime where resonant behavior dominates. We also measured the scattered laser light from the laser-cluster interaction. Similar to the absorption measurements, there is an optimal pulse width which maximizes the scattered signal. This pulse width is larger than the optimal pulse width for absorption. This disagrees with model calculations which show both pulse widths being similar. Further experiments measuring the scattered light in a pump-probe configuration should help to resolve this disagreement.

  9. Direct observations of the atmospheric processing of Asian mineral dust

    NASA Astrophysics Data System (ADS)

    Sullivan, R. C.; Guazzotti, S. A.; Sodeman, D. A.; Prather, K. A.

    2007-02-01

    The accumulation of secondary acids and ammonium on individual mineral dust particles during ACE-Asia has been measured with an online single-particle mass spectrometer, the ATOFMS. Changes in the amounts of sulphate, nitrate, and chloride mixed with dust particles correlate with air masses from different source regions. The uptake of secondary acids depended on the individual dust particle mineralogy; high amounts of nitrate accumulated on calcium-rich dust while high amounts of sulphate accumulated on aluminosilicate-rich dust. Oxidation of S(IV) to S(VI) by iron in the aluminosilicate dust is a possible explanation for this enrichment of sulphate, which has important consequences for the fertilization of remote oceans by soluble iron. This study shows the segregation of sulphate from nitrate and chloride in individual aged dust particles for the first time. A transport and aging timeline provides an explanation for the observed segregation. Our data suggests that sulphate became mixed with the dust first. This implies that the transport pathway is more important than the reaction kinetics in determining which species accumulate on mineral dust. Early in the study, dust particles in volcanically influenced air masses were mixed predominately with sulphate. Dust mixed with chloride then dominated over sulphate and nitrate when a major dust front reached the R. V. Ronald Brown. We hypothesize that the rapid increase in chloride on dust was due to mixing with HCl(g) released from acidified sea salt particles induced by heterogeneous reaction with volcanic SO2(g), prior to the arrival of the dust front. The amount of ammonium mixed with dust correlated strongly with the total amount of secondary acid reaction products in the dust. Submicron dust and ammonium sulphate were internally mixed, contrary to frequent reports that they exist as external mixtures. The size distribution of the mixing state of dust with these secondary species validates previous mechanisms of

  10. In-situ real-space imaging of single crystal surface reconstructions via electron microscopy

    NASA Astrophysics Data System (ADS)

    Xu, Weizong; Bowes, Preston C.; Grimley, Everett D.; Irving, Douglas L.; LeBeau, James M.

    2016-11-01

    Here, we report a high temperature in-situ atomic resolution scanning transmission electron microscopy (STEM) study of single crystal surface structure dynamics. With the approach, we gain direct insight into a double layer reconstruction that occurs on the polar SrTiO3 (110) surface. We find that structural details of this reconstruction can be directly attributed to charge redistribution and the thermal mismatch between the surface and the bulk material. Periodic surface defects, similar to dislocations, are found, which act to relieve stress as the temperature is lowered. Combining STEM observations, electron energy loss spectroscopy, and density functional theory, we highlight the combined role of lattice misfit and charge compensation to determine the structure and chemistry of the observed polar surface reconstruction.

  11. Relation between Direct Observation of Relaxation and Self-Reported Mindfulness and Relaxation States

    ERIC Educational Resources Information Center

    Hites, Lacey S.; Lundervold, Duane A.

    2013-01-01

    Forty-four individuals, 18-47 (MN 21.8, SD 5.63) years of age, took part in a study examining the magnitude and direction of the relationship between self-report and direct observation measures of relaxation and mindfulness. The Behavioral Relaxation Scale (BRS), a valid direct observation measure of relaxation, was used to assess relaxed behavior…

  12. Snell's law for surface electrons: refraction of an electron gas imaged in real space.

    PubMed

    Repp, Jascha; Meyer, Gerhard; Rieder, Karl-Heinz

    2004-01-23

    On NaCl(100)/Cu(111) an interface state band is observed that descends from the surface-state band of the clean copper surface. This band exhibits a Moiré-pattern-induced one-dimensional band gap, which is accompanied by strong standing-wave patterns, as revealed in low-temperature scanning tunneling microscopy images. At NaCl island step edges, one can directly see the refraction of these standing waves, which obey Snell's refraction law.

  13. Chemical bonding in excited states: Energy transfer and charge redistribution from a real space perspective.

    PubMed

    Jara-Cortés, Jesús; Guevara-Vela, José Manuel; Martín Pendás, Ángel; Hernández-Trujillo, Jesús

    2017-05-15

    This work provides a novel interpretation of elementary processes of photophysical relevance from the standpoint of the electron density using simple model reactions. These include excited states of H2 taken as a prototype for a covalent bond, excimer formation of He2 to analyze non-covalent interactions, charge transfer by an avoided crossing of electronic states in LiF and conical interesections involved in the intramolecular scrambling in C2 H4 . The changes of the atomic and interaction energy components along the potential energy profiles are described by the interacting quantum atoms approach and the quantum theory of atoms in molecules. Additionally, the topological analysis of one- and two-electron density functions is used to explore basic reaction mechanisms involving excited and degenerate states in connection with the virial theorem. This real space approach allows to describe these processes in a unified way, showing its versatility and utility in the study of chemical systems in excited states. © 2017 Wiley Periodicals, Inc.

  14. Real-Space x-ray tomographic reconstruction of randomly oriented objects with sparse data frames.

    PubMed

    Ayyer, Kartik; Philipp, Hugh T; Tate, Mark W; Elser, Veit; Gruner, Sol M

    2014-02-10

    Schemes for X-ray imaging single protein molecules using new x-ray sources, like x-ray free electron lasers (XFELs), require processing many frames of data that are obtained by taking temporally short snapshots of identical molecules, each with a random and unknown orientation. Due to the small size of the molecules and short exposure times, average signal levels of much less than 1 photon/pixel/frame are expected, much too low to be processed using standard methods. One approach to process the data is to use statistical methods developed in the EMC algorithm (Loh & Elser, Phys. Rev. E, 2009) which processes the data set as a whole. In this paper we apply this method to a real-space tomographic reconstruction using sparse frames of data (below 10(-2) photons/pixel/frame) obtained by performing x-ray transmission measurements of a low-contrast, randomly-oriented object. This extends the work by Philipp et al. (Optics Express, 2012) to three dimensions and is one step closer to the single molecule reconstruction problem.

  15. Real-Space Mapping of Surface Trap States in CIGSe Nanocrystals Using 4D Electron Microscopy.

    PubMed

    Bose, Riya; Bera, Ashok; Parida, Manas R; Adhikari, Aniruddha; Shaheen, Basamat S; Alarousu, Erkki; Sun, Jingya; Wu, Tom; Bakr, Osman M; Mohammed, Omar F

    2016-07-13

    Surface trap states in copper indium gallium selenide semiconductor nanocrystals (NCs), which serve as undesirable channels for nonradiative carrier recombination, remain a great challenge impeding the development of solar and optoelectronics devices based on these NCs. In order to design efficient passivation techniques to minimize these trap states, a precise knowledge about the charge carrier dynamics on the NCs surface is essential. However, selective mapping of surface traps requires capabilities beyond the reach of conventional laser spectroscopy and static electron microscopy; it can only be accessed by using a one-of-a-kind, second-generation four-dimensional scanning ultrafast electron microscope (4D S-UEM) with subpicosecond temporal and nanometer spatial resolutions. Here, we precisely map the collective surface charge carrier dynamics of copper indium gallium selenide NCs as a function of the surface trap states before and after surface passivation in real space and time using S-UEM. The time-resolved snapshots clearly demonstrate that the density of the trap states is significantly reduced after zinc sulfide (ZnS) shelling. Furthermore, the removal of trap states and elongation of carrier lifetime are confirmed by the increased photocurrent of the self-biased photodetector fabricated using the shelled NCs.

  16. Scalable real space pseudopotential density functional codes for materials in the exascale regime

    NASA Astrophysics Data System (ADS)

    Lena, Charles; Chelikowsky, James; Schofield, Grady; Biller, Ariel; Kronik, Leeor; Saad, Yousef; Deslippe, Jack

    Real-space pseudopotential density functional theory has proven to be an efficient method for computing the properties of matter in many different states and geometries, including liquids, wires, slabs, and clusters with and without spin polarization. Fully self-consistent solutions using this approach have been routinely obtained for systems with thousands of atoms. Yet, there are many systems of notable larger sizes where quantum mechanical accuracy is desired, but scalability proves to be a hindrance. Such systems include large biological molecules, complex nanostructures, or mismatched interfaces. We will present an overview of our new massively parallel algorithms, which offer improved scalability in preparation for exascale supercomputing. We will illustrate these algorithms by considering the electronic structure of a Si nanocrystal exceeding 104 atoms. Support provided by the SciDAC program, Department of Energy, Office of Science, Advanced Scientific Computing Research and Basic Energy Sciences. Grant Numbers DE-SC0008877 (Austin) and DE-FG02-12ER4 (Berkeley).

  17. Real Space Multigrid (RMG) Open Source Software Suite for Multi-Petaflops Electronic Structure Calculations

    NASA Astrophysics Data System (ADS)

    Briggs, Emil; Hodak, Miroslav; Lu, Wenchang; Bernholc, Jerry; Li, Yan

    RMG is a cross platform open source package for ab initio electronic structure calculations that uses real-space grids, multigrid pre-conditioning, and subspace diagonalization to solve the Kohn-Sham equations. The code has been successfully used for a wide range of problems ranging from complex bulk materials to multifunctional electronic devices and biological systems. RMG makes efficient use of GPU accelerators, if present, but does not require them. Recent work has extended GPU support to systems with multiple GPU's per computational node, as well as optimized both CPU and GPU memory usage to enable large problem sizes, which are no longer limited by the memory of the GPU board. Additional enhancements include increased portability, scalability and performance. New versions of the code are regularly released at sourceforge.net/projects/rmgdft/. The releases include binaries for Linux, Windows and MacIntosh systems, automated builds for clusters using cmake, as well as versions adapted to the major supercomputing installations and platforms.

  18. Real-space refinement with DireX: from global fitting to side-chain improvements.

    PubMed

    Wang, Zhe; Schröder, Gunnar F

    2012-09-01

    Single-particle cryo-electron microscopy (cryo-EM) has become an important tool to determine the structure of large biomolecules and assemblies thereof. However, the achievable resolution varies considerably over a wide range of about 3.5-20 Å. The interpretation of these intermediate- to low-resolution density maps in terms of atomic models is a big challenge and an area of active research. Here, we present our real-space structure refinement program DireX, which was developed primarily for cryo-EM-derived density maps. The basic principle and its main features are described. DireX employs Deformable Elastic Network (DEN) restraints to reduce overfitting by decreasing the effective number of degrees of freedom used in the refinement. Missing or reduced density due to flexible parts of the protein can lead to artifacts in the structure refinement, which is addressed through the concept of restrained grouped occupancy refinement. Furthermore, we describe the performance of DireX in the 2010 Cryo-EM Modeling Challenge, where we chose six density maps of four different proteins provided by the Modeling Challenge exemplifying typical refinement results at a large resolution range from 3 to 23 Å. Copyright © 2012 Wiley Periodicals, Inc.

  19. Real-space renormalization group method for quantum 1/2 spins on the pyrochlore lattice.

    PubMed

    Garcia-Adeva, Angel J

    2014-04-02

    A simple phenomenological real-space renormalization group method for quantum Heisenberg spins with nearest and next nearest neighbour interactions on a pyrochlore lattice is presented. Assuming a scaling law for the order parameter of two clusters of different sizes, a set of coupled equations that gives the fixed points of the renormalization group transformation and, thus, the critical temperatures and ordered phases of the system is found. The particular case of spins 1/2 is studied in detail. Furthermore, to simplify the mathematical details, from all the possible phases arising from the renormalization group transformation, only those phases in which the magnetic lattice is commensurate with a subdivision of the crystal lattice into four interlocked face-centred cubic sublattices are considered. These correspond to a quantum spin liquid, ferromagnetic order, or non-collinear order in which the total magnetic moment of a tetrahedral unit is zero. The corresponding phase diagram is constructed and the differences with respect to the classical model are analysed. It is found that this method reproduces fairly well the phase diagram of the pyrochlore lattice under the aforementioned constraints.

  20. Transport capacity and saturation mechanism in a real-space cellular automaton dune model

    NASA Astrophysics Data System (ADS)

    Gao, X.; Zhang, D.; Rozier, O.; Narteau, C.

    2014-04-01

    In a real-space cellular automaton dune model, individual physical processes such as erosion, deposition and transport are implemented by nearest neighbor interactions and a time-dependent stochastic process. Hence, the transport capacity, the saturation mechanism and the characteristic wavelength for the formation of dunes are emergent properties that can only be determined a posteriori from the output of the numerical simulations. Here we propose a simplified version of the model to establish asymptotic relations between the microscopic erosion-deposition-transport rate parameters and the characteristic length and time scales of the flux saturation mechanism. In particular, we show that, in the cellular automaton, the saturation length is a mean transport distance controlled by the deposition of mobile sedimentary cells. Then, we discuss how these results can be used to determine the sediment flux within dune fields and the rate parameters of a new class of discrete models that concentrate on the effect of heterogeneities in grain-size on dune morphodynamics.

  1. Probing Critical Surfaces in Momentum Space Using Real-Space Entanglement Entropy: Bose versus Fermi

    NASA Astrophysics Data System (ADS)

    Yang, Kun; Lai, Hsin-Hua

    A co-dimension one critical surface in the momentum space can be either a familiar Fermi surface, which separates occupied states from empty ones in the non-interacting fermion case, or a novel Bose surface, where gapless bosonic excitations are anchored. Their presence gives rise to logarithmic violation of entanglement entropy area law. When they are convex, we show that the shape of these critical surfaces can be determined by inspecting the leading logarithmic term of real space entanglement entropy. The fundamental difference between a Fermi surface and a Bose surface is revealed by the fact that the logarithmic terms in entanglement entropies differ by a factor of two: SlogBose = 2SlogFermi , even when they have identical geometry. Our method has remarkable similarity with determining Fermi surface shape using quantum oscillation. We also discuss possible probes of concave critical surfaces in momentum space. HHL and KY acknowledge the National Science Foundation through Grants No. DMR-1004545, DMR-1157490, No. DMR-1442366, and State of Florida. HHL is also partially supported by NSF Grant No. DMR-1309531, and the Smalley Postdoctoral Fellowship in Quantum Ma.

  2. Measuring Implementation of the Direct Instruction Model in an Urban School District: An Observational Approach.

    ERIC Educational Resources Information Center

    Gersten, Russell M.; Carnine, Doug

    During an extensive inservice program, teachers and aides in 20 kindergarten and first grade Follow Through Classrooms were observed for mastery of the Direct Instruction Model. Two trained observers used the Direct Instruction Supervisor Code to record behavior in the fall, winter, and spring. Subjects were observed while teaching a 12 minute…

  3. Perturbation theory approach for the power spectrum: from dark matter in real space to massive haloes in redshift space

    SciTech Connect

    Gil-Marín, Héctor; Wagner, Christian; Verde, Licia; Jimenez, Raul; Porciani, Cristiano E-mail: cwagner@icc.ub.edu E-mail: porciani@astro.uni-bonn.de

    2012-11-01

    We investigate the accuracy of Eulerian perturbation theory for describing the matter and galaxy power spectra in real and redshift space in light of future observational probes for precision cosmology. Comparing the analytical results with a large suite of N-body simulations (160 independent boxes of 13.8 (Gpc/h){sup 3} volume each, which are publicly available), we find that re-summing terms in the standard perturbative approach predicts the real-space matter power spectrum with an accuracy of ∼<2% for k ≤ 0.20 h/Mpc at redshifts z∼<1.5. This is obtained following the widespread technique of writing the resummed propagator in terms of 1-loop contributions. We show that the accuracy of this scheme increases by considering higher-order terms in the resummed propagator. By combining resummed perturbation theories with several models for the mappings from real to redshift space discussed in the literature, the multipoles of the dark-matter power spectrum can be described with sub-percent deviations from N-body results for k ≤ 0.15 h/Mpc at z∼<1. As a consequence, the logarithmic growth rate, f, can be recovered with sub-percent accuracy on these scales. Extending the models to massive dark-matter haloes in redshift space, our results describe the monopole term from N-body data within 2% accuracy for scales k ≤ 0.15 h/Mpc at z∼<0.5; here f can be recovered within < 5% when the halo bias is known. We conclude that these techniques are suitable to extract cosmological information from future galaxy surveys.

  4. Direct Observation of Teacher-Directed IEP Meetings: Establishing the Need for Student IEP Meeting Instruction

    ERIC Educational Resources Information Center

    Martin, James E.; Van Dycke, Jamie L.; Greene, Barbara A.; Gardner, J. Emmett; Christensen, W. Robert; Woods, Lee L.; Lovett, David L.

    2006-01-01

    The 1997 reauthorization of the Individuals with Disabilities Education Act (IDEA) called for an increase in student involvement in individualized education program (IEP) meetings. To determine the extent of student involvement in educational planning, this study observed 109 middle and high school IEP meetings; 90% of the participants completed a…

  5. Virtual environment navigation with look-around mode to explore new real spaces by people who are blind.

    PubMed

    Lahav, Orly; Gedalevitz, Hadas; Battersby, Steven; Brown, David; Evett, Lindsay; Merritt, Patrick

    2017-02-10

    This paper examines the ability of people who are blind to construct a mental map and perform orientation tasks in real space by using Nintendo Wii technologies to explore virtual environments. The participant explores new spaces through haptic and auditory feedback triggered by pointing or walking in the virtual environments and later constructs a mental map, which can be used to navigate in real space. The study included 10 participants who were congenitally or adventitiously blind, divided into experimental and control groups. The research was implemented by using virtual environments exploration and orientation tasks in real spaces, using both qualitative and quantitative methods in its methodology. The results show that the mode of exploration afforded to the experimental group is radically new in orientation and mobility training; as a result 60% of the experimental participants constructed mental maps that were based on map model, compared with only 30% of the control group participants. Using technology that enabled them to explore and to collect spatial information in a way that does not exist in real space influenced the ability of the experimental group to construct a mental map based on the map model. Implications for rehabilitation The virtual cane system for the first time enables people who are blind to explore and collect spatial information via the look-around mode in addition to the walk-around mode. People who are blind prefer to use look-around mode to explore new spaces, as opposed to the walking mode. Although the look-around mode requires users to establish a complex collecting and processing procedure for the spatial data, people who are blind using this mode are able to construct a mental map as a map model. For people who are blind (as for the sighted) construction of a mental map based on map model offers more flexibility in choosing a walking path in a real space, accounting for changes that occur in the space.

  6. The ESO Slice Project (ESP) galaxy redshift survey. VII. The redshift and real-space correlation functions

    NASA Astrophysics Data System (ADS)

    Guzzo, L.; Bartlett, J. G.; Cappi, A.; Maurogordato, S.; Zucca, E.; Zamorani, G.; Balkowski, C.; Blanchard, A.; Cayatte, V.; Chincarini, G.; Collins, C. A.; Maccagni, D.; MacGillivray, H.; Merighi, R.; Mignoli, M.; Proust, D.; Ramella, M.; Scaramella, R.; Stirpe, G. M.; Vettolani, G.

    2000-03-01

    We present analyses of the two-point correlation properties of the ESO Slice Project (ESP) galaxy redshift survey, both in redshift and real space. From the redshift-space correlation function $xi (r) i(s) we are able to trace positive clustering out to separations as large as 50 h^{-1} Mpc, after which xi (r) i(s) smoothly breaks down, crossing the zero value between 60 and 80 h^{-1} Mpc. This is best seen from the whole magnitude-limited redshift catalogue, using the J_3 miniμm-variance weighting estimator. xi (r) i(s) is reasonably well described by a shallow power law with \\gamma\\sim 1.5 between 3 and 50 h^{-1} Mpc, while on smaller scales (0.2-2 h^{-1} Mpc) it has a shallower slope (\\gamma\\sim 1). This flattening is shown to be mostly due to the redshift-space damping produced by virialized structures, and is less evident when volume-limited samples of the survey are analysed. We examine the full effect of redshift-space distortions by computing the two-dimensional correlation function xi (r) i(r_p,\\pi) , from which we project out the real-space xi (r) i(r) below 10 h^{-1} Mpc. This function is well described by a power-law model (r/r_o)^{-\\gamma}, with r_o=4.15^{+0.20}_{-0.21} h^{-1} Mpc and \\gamma=1.67^{+0.07}_{-0.09} for the whole magnitude-limited catalogue. Comparison to other redshift surveys shows a consistent picture in which galaxy clustering remains positive out to separations of 50 h^{-1} Mpc or larger, in substantial agreement with the results obtained from angular surveys like the APM and EDSGC. Also the shape of the two-point correlation function is remarkably unanimous among these data sets, in all cases requiring more power on scales larger than 5 h^{-1} Mpc (a `shoulder'), with respect to a simple extrapolation of the canonical xi (r) i(r) =(r/5)^{-1.8}. The analysis of xi (r) i(s) for volume-limited subsamples with different luminosity shows evidence of luminosity segregation only for the most luminous sample with Mb_J <= -20.5. For

  7. Real Space Imaging of Nanoparticle Assembly at Liquid-Liquid Interfaces with Nanoscale Resolution.

    PubMed

    Costa, Luca; Li-Destri, Giovanni; Thomson, Neil H; Konovalov, Oleg; Pontoni, Diego

    2016-09-14

    Bottom up self-assembly of functional materials at liquid-liquid interfaces has recently emerged as method to design and produce novel two-dimensional (2D) nanostructured membranes and devices with tailored properties. Liquid-liquid interfaces can be seen as a "factory floor" for nanoparticle (NP) self-assembly, because NPs are driven there by a reduction of interfacial energy. Such 2D assembly can be characterized by reciprocal space techniques, namely X-ray and neutron scattering or reflectivity. These techniques have drawbacks, however, as the structural information is averaged over the finite size of the radiation beam and nonperiodic isolated assemblies in 3D or defects may not be easily detected. Real-space in situ imaging methods are more appropriate in this context, but they often suffer from limited resolution and underperform or fail when applied to challenging liquid-liquid interfaces. Here, we study the surfactant-induced assembly of SiO2 nanoparticle monolayers at a water-oil interface using in situ atomic force microscopy (AFM) achieving nanoscale resolved imaging capabilities. Hitherto, AFM imaging has been restricted to solid-liquid interfaces because applications to liquid interfaces have been hindered by their softness and intrinsic dynamics, requiring accurate sample preparation methods and nonconventional AFM operational schemes. Comparing both AFM and grazing incidence X-ray small angle scattering data, we unambiguously demonstrate correlation between real and reciprocal space structure determination showing that the average interfacial NP density is found to vary with surfactant concentration. Additionally, the interaction between the tip and the interface can be exploited to locally determine the acting interfacial interactions. This work opens up the way to studying complex nanostructure formation and phase behavior in a range of liquid-liquid and complex liquid interfaces.

  8. Real Space Mapping of Li-Ion Transport in Amorphous Si Anodes with Nanometer Resolution

    SciTech Connect

    Balke, Nina; Jesse, Stephen; Kim, Yoongu; Adamczyk, Leslie A; Tselev, Alexander; Ivanov, Ilia N; Dudney, Nancy J; Kalinin, Sergei V

    2010-01-01

    The electrical bias driven Li-ion motion in silicon anode materials in thin film battery heterostructures is investigated using electrochemical strain microscopy (ESM), which is a newly developed scanning probe microscopy based characterization method. ESM utilizes the intrinsic link between bias-controlled Li-ion concentration and molar volume of electrode materials, providing the capability for studies on the sub-20 nm scale, and allows the relationship between Li-ion flow and microstructure to be established. The evolution of Li-ion transport during the battery charging is directly observed.

  9. Real space mapping of Li-ion transport in amorphous Si anodes with nanometer resolution.

    PubMed

    Balke, Nina; Jesse, Stephen; Kim, Yoongu; Adamczyk, Leslie; Tselev, Alexander; Ivanov, Ilia N; Dudney, Nancy J; Kalinin, Sergei V

    2010-09-08

    The electrical bias driven Li-ion motion in silicon anode materials in thin film battery heterostructures is investigated using electrochemical strain microscopy (ESM), which is a newly developed scanning probe microscopy based characterization method. ESM utilizes the intrinsic link between bias-controlled Li-ion concentration and molar volume of electrode materials, providing the capability for studies on the sub-20 nm scale, and allows the relationship between Li-ion flow and microstructure to be established. The evolution of Li-ion transport during the battery charging is directly observed.

  10. Direct Versus Remote Clinical Observation: Assessing Learners' Milestones While Addressing Adolescent Patients' Needs

    PubMed Central

    Pitts, Sarah; Borus, Joshua; Goncalves, Adrianne; Gooding, Holly

    2015-01-01

    Background Direct clinical observation is an essential component of medical trainee assessment, particularly in the era of milestone-based competencies. However, the adolescent patient's perspective on this practice is missing from the literature. Quality health care is patient centered, yet we did not know if our educational practices align with this clinical goal. Objective We sought to better understand our adolescent/young adult patients' perspectives of the direct observation of our medical trainees in the outpatient clinical setting. Methods As a quality improvement initiative, we surveyed adolescent/young adult patients, medical trainees, and physician observers in our outpatient clinical practice regarding their experience following a direct observation encounter. We performed descriptive analyses of the data. Results During a 1-year period, responses were received from 23 adolescent/young adult patients, 8 family members, 14 trainees, and 6 faculty observers. Nearly all adolescent/young adult patients (n = 22) and all surveyed family members (n = 8) expressed comfort with direct observation, and all respondents felt the care they received was the same or better. All patient/family respondents preferred direct observation to the idea of remote observation, and most, but not all, trainees and faculty observers expressed similar opinions. Conclusions Adolescent/young adult patients and their family members found direct observation of their trainee providers to be comfortable and beneficial. Despite adolescent and young adults' facility and comfort with modern technologies, there was an expressed preference for direct versus remote observation. PMID:26221445

  11. Direct Versus Remote Clinical Observation: Assessing Learners' Milestones While Addressing Adolescent Patients' Needs.

    PubMed

    Pitts, Sarah; Borus, Joshua; Goncalves, Adrianne; Gooding, Holly

    2015-06-01

    Direct clinical observation is an essential component of medical trainee assessment, particularly in the era of milestone-based competencies. However, the adolescent patient's perspective on this practice is missing from the literature. Quality health care is patient centered, yet we did not know if our educational practices align with this clinical goal. We sought to better understand our adolescent/young adult patients' perspectives of the direct observation of our medical trainees in the outpatient clinical setting. As a quality improvement initiative, we surveyed adolescent/young adult patients, medical trainees, and physician observers in our outpatient clinical practice regarding their experience following a direct observation encounter. We performed descriptive analyses of the data. During a 1-year period, responses were received from 23 adolescent/young adult patients, 8 family members, 14 trainees, and 6 faculty observers. Nearly all adolescent/young adult patients (n=22) and all surveyed family members (n=8) expressed comfort with direct observation, and all respondents felt the care they received was the same or better. All patient/family respondents preferred direct observation to the idea of remote observation, and most, but not all, trainees and faculty observers expressed similar opinions. Adolescent/young adult patients and their family members found direct observation of their trainee providers to be comfortable and beneficial. Despite adolescent and young adults' facility and comfort with modern technologies, there was an expressed preference for direct versus remote observation.

  12. 10 CFR 26.115 - Collecting a urine specimen under direct observation.

    Code of Federal Regulations, 2014 CFR

    2014-01-01

    ... 10 Energy 1 2014-01-01 2014-01-01 false Collecting a urine specimen under direct observation. 26.115 Section 26.115 Energy NUCLEAR REGULATORY COMMISSION FITNESS FOR DUTY PROGRAMS Collecting Specimens for Testing § 26.115 Collecting a urine specimen under direct observation. (a) Procedures for...

  13. 10 CFR 26.115 - Collecting a urine specimen under direct observation.

    Code of Federal Regulations, 2013 CFR

    2013-01-01

    ... 10 Energy 1 2013-01-01 2013-01-01 false Collecting a urine specimen under direct observation. 26.115 Section 26.115 Energy NUCLEAR REGULATORY COMMISSION FITNESS FOR DUTY PROGRAMS Collecting Specimens for Testing § 26.115 Collecting a urine specimen under direct observation. (a) Procedures for...

  14. 10 CFR 26.115 - Collecting a urine specimen under direct observation.

    Code of Federal Regulations, 2012 CFR

    2012-01-01

    ... 10 Energy 1 2012-01-01 2012-01-01 false Collecting a urine specimen under direct observation. 26.115 Section 26.115 Energy NUCLEAR REGULATORY COMMISSION FITNESS FOR DUTY PROGRAMS Collecting Specimens for Testing § 26.115 Collecting a urine specimen under direct observation. (a) Procedures for...

  15. 10 CFR 26.115 - Collecting a urine specimen under direct observation.

    Code of Federal Regulations, 2011 CFR

    2011-01-01

    ... 10 Energy 1 2011-01-01 2011-01-01 false Collecting a urine specimen under direct observation. 26.115 Section 26.115 Energy NUCLEAR REGULATORY COMMISSION FITNESS FOR DUTY PROGRAMS Collecting Specimens for Testing § 26.115 Collecting a urine specimen under direct observation. (a) Procedures for...

  16. Reduction of Z classification of a two-dimensional weak topological insulator: Real-space dynamical mean-field theory study

    NASA Astrophysics Data System (ADS)

    Yoshida, Tsuneya; Kawakami, Norio

    2017-01-01

    One of the remarkable interaction effects on topological insulators is the reduction of topological classification in free-fermion systems. We address this issue in a bilayer honeycomb lattice model by taking into account temperature effects on the reduction. Our analysis, based on the real-space dynamical mean-field theory, elucidates the following results. (i) Even when the reduction occurs, the winding number defined by the Green's function can take a nontrivial value at zero temperature. (ii) The winding number taking the nontrivial value becomes consistent with the absence of gapless edge modes due to Mott behaviors emerging only at the edges. (iii) Temperature effects can restore the gapless edge modes, provided that the energy scale of interactions is smaller than the bulk gap. In addition, we observe the topological edge Mott behavior only in some finite-temperature region.

  17. Use of the star-triangle transformation for the application of differential real-space renormalization-group theory

    NASA Astrophysics Data System (ADS)

    van Saarloos, Wim

    1983-05-01

    When differential real-space renormalization-grup theory was proposed by Hilhorst, Schick, and van Leeuwen, they suggested that their approach could only be applied to lattice models for which a star-triangle transformation exists. However, differential renormalization-group equations for the square Ising model have recently been proposed whose derivation does not involve the star-triangle transformation. We show that the latter equations are not exact renormalization-group equations by an analysis that reveals some essential limitations of the present formulation of differential real-space renormalization. We investigate the structure of the renormalization-group flow equations obtained in this method and uncover a strong property of these equations that simplifies the calculations in actual applications of the theory. However, the status and implications of this property, which embodies the crux of the theory, are not yet fully understood.

  18. Real-space renormalization group for the transverse-field Ising model in two and three dimensions.

    PubMed

    Miyazaki, Ryoji; Nishimori, Hidetoshi; Ortiz, Gerardo

    2011-05-01

    The two- and three-dimensional transverse-field Ising models with ferromagnetic exchange interactions are analyzed by means of the real-space renormalization-group method. The basic strategy is a generalization of a method developed for the one-dimensional case, which exploits the exact invariance of the model under renormalization and is known to give the exact values of the critical point and critical exponent ν. The resulting values of the critical exponent ν in two and three dimensions are in good agreement with those for the classical Ising model in three and four dimensions. To the best of our knowledge, this is the first example in which a real-space renormalization group on (2+1)- and (3+1)-dimensional Bravais lattices yields accurate estimates of the critical exponents.

  19. Real Space Renormalization Group Study of the S=1/2 XXZ Chains with Fibonacci Exchange Modulation

    NASA Astrophysics Data System (ADS)

    Hida, Kazuo

    2004-08-01

    Ground state properties of the S=1/2 antiferromagnetic XXZ chain with Fibonacci exchange modulation are studied using the real space renormalization group method for strong modulation. The quantum dynamical critical behavior with a new universality class is predicted in the isotropic case. Combining our results with the weak coupling renormalization group results by Vidal et al., the ground state phase diagram is obtained.

  20. Real-space multiple-scattering theory of XMCD including spin-orbit interaction in scattering process

    NASA Astrophysics Data System (ADS)

    Koide, Akihiro; Niki, Kaori; Sakai, Seiji; Fujikawa, Takashi

    2016-05-01

    The effects of the spin-orbit interaction on surrounding atoms for XMCD spectra are studied by a real-space multiple-scattering theory. The present numerical calculation for Fe K-edge XMCD spectra from BCC iron demonstrates the importance of the spin-orbit interaction on scattering atoms, which has been disregarded in previous works. These effects will be inevitable for K-edge XMCD analyses of light elements surrounded by heavy magnetic atoms.

  1. Direct observation of martensitic phase-transformation dynamics in iron by 4D single-pulse electron microscopy.

    PubMed

    Park, Hyun Soon; Kwon, Oh-Hoon; Baskin, J Spencer; Barwick, Brett; Zewail, Ahmed H

    2009-11-01

    The in situ martensitic phase transformation of iron, a complex solid-state transition involving collective atomic displacement and interface movement, is studied in real time by means of four-dimensional (4D) electron microscopy. The iron nanofilm specimen is heated at a maximum rate of approximately 10(11) K/s by a single heating pulse, and the evolution of the phase transformation from body-centered cubic to face-centered cubic crystal structure is followed by means of single-pulse, selected-area diffraction and real-space imaging. Two distinct components are revealed in the evolution of the crystal structure. The first, on the nanosecond time scale, is a direct martensitic transformation, which proceeds in regions heated into the temperature range of stability of the fcc phase, 1185-1667 K. The second, on the microsecond time scale, represents an indirect process for the hottest central zone of laser heating, where the temperature is initially above 1667 K and cooling is the rate-determining step. The mechanism of the direct transformation involves two steps, that of (barrier-crossing) nucleation on the reported nanosecond time scale, followed by a rapid grain growth typically in approximately 100 ps for 10 nm crystallites.

  2. A real-space study of random extended defects in solids: Application to disordered Stone-Wales defects in graphene

    NASA Astrophysics Data System (ADS)

    Chowdhury, Suman; Baidya, Santu; Nafday, Dhani; Halder, Soumyajyoti; Kabir, Mukul; Sanyal, Biplab; Saha-Dasgupta, Tanusri; Jana, Debnarayan; Mookerjee, Abhijit

    2014-07-01

    We propose here a first-principles, parameter free, real space method for the study of disordered extended defects in solids. We shall illustrate the power of the technique with an application to graphene sheets with randomly placed Stone-Wales defects and shall examine the signature of such random defects on the density of states as a function of their concentration. The technique is general enough to be applied to a whole class of systems with lattice translational symmetry broken not only locally but by extended defects and defect clusters. The real space approach will allow us to distinguish signatures of specific defects and defect clusters. The authors go on to remark that although this disorder may not affect the vibrational spectrum significantly, the electronic structure obtained from a periodic array of SW defects needs to be interpreted with care. Our real space recursion approach [41] makes no appeal to lattice translational symmetry and is thus ideal for studying topological disorder and its effect on electronic structure. The illustration of this point is the justification of our proposed methodology and the main focus of this communication.

  3. Screened real-space Korringa-Kohn-Rostoker description of the relativistic and magnetic properties of transition metals

    NASA Astrophysics Data System (ADS)

    Petit, L.; Beiden, S. V.; Temmerman, W. M.; Szotek, Z.; Stocks, G. M.; Gehring, G. A.

    2000-10-01

    The use of the relativistic and spin-polarized real-space Korringa-Kohn-Rostoker (KKR) method is limited to small systems (less than 100 atoms). This is due to the prohibitively large CPU times needed for the inversion of the KKR matrix. To study systems of more than a thousand atoms, we have implemented the concept of a screened reference medium, within the fully relativistic spin-polarized version of the real-space locally self-consistent multiple-scattering method (LSMS). The LSMS method makes use of a local interaction zone (LIZ) for solving the quantum mechanical problem, while the Poisson equation is solved in the whole space. The screened reference medium gives rise to sparse KKR matrices and using state-of-the-art sparse matrix technology a substantial reduction in the CPU times is obtained, enabling applications of the method to systems whose LIZ consists of more than a thousand atoms. The method is benchmarked by application to the elemental transition metals, the fcc (face-centred-cubic) Co and Ni, and the bcc (body-centred cubic) Fe, and compared to the results of the conventional k-space methods. The convergence in real space of the magnetic moments, the magnetocrystalline anisotropy energy and the orbital moment anisotropy is discussed in detail.

  4. Real-space post-processing correction of thermal drift and piezoelectric actuator nonlinearities in scanning tunneling microscope images

    NASA Astrophysics Data System (ADS)

    Yothers, Mitchell P.; Browder, Aaron E.; Bumm, Lloyd A.

    2017-01-01

    We have developed a real-space method to correct distortion due to thermal drift and piezoelectric actuator nonlinearities on scanning tunneling microscope images using Matlab. The method uses the known structures typically present in high-resolution atomic and molecularly resolved images as an internal standard. Each image feature (atom or molecule) is first identified in the image. The locations of each feature's nearest neighbors are used to measure the local distortion at that location. The local distortion map across the image is simultaneously fit to our distortion model, which includes thermal drift in addition to piezoelectric actuator hysteresis and creep. The image coordinates of the features and image pixels are corrected using an inverse transform from the distortion model. We call this technique the thermal-drift, hysteresis, and creep transform. Performing the correction in real space allows defects, domain boundaries, and step edges to be excluded with a spatial mask. Additional real-space image analyses are now possible with these corrected images. Using graphite(0001) as a model system, we show lattice fitting to the corrected image, averaged unit cell images, and symmetry-averaged unit cell images. Statistical analysis of the distribution of the image features around their best-fit lattice sites measures the aggregate noise in the image, which can be expressed as feature confidence ellipsoids.

  5. Twelve tips for implementing tools for direct observation of medical trainees' clinical skills during patient encounters.

    PubMed

    Hauer, Karen E; Holmboe, Eric S; Kogan, Jennifer R

    2011-01-01

    Direct observation of medical trainees by their supervisors with actual patients is essential for trainees to develop clinical skills competence. Despite the many available tools for direct observation of trainees by supervisors, it is unclear how educators should identify an appropriate tool for a particular clinical setting and implement the tool to maximize educational benefits for trainees in a manner that is feasible for faculty. Based on our previous systematic review of the literature, we provide 12 tips for selecting and incorporating a tool for direct observation into a medical training program. We focus specifically on direct observation that occurs in clinical settings with actual patients. Educators should focus on the existing tools for direct observation that have evidence of validity. Tool implementation must be a component of an educational program that includes faculty development about rating performance, providing meaningful feedback, and developing action plans collaboratively with learners. Educators can enhance clinical skills education with strategic incorporation of tools for direct observation into medical training programs. Identification of a psychometrically sound instrument and attention to faculty development and the feedback process are critical to the success of a program of direct observation.

  6. A robust variant of block Jacobi-Davidson for extracting a large number of eigenpairs: Application to grid-based real-space density functional theory

    NASA Astrophysics Data System (ADS)

    Lee, M.; Leiter, K.; Eisner, C.; Breuer, A.; Wang, X.

    2017-09-01

    In this work, we investigate a block Jacobi-Davidson (J-D) variant suitable for sparse symmetric eigenproblems where a substantial number of extremal eigenvalues are desired (e.g., ground-state real-space quantum chemistry). Most J-D algorithm variations tend to slow down as the number of desired eigenpairs increases due to frequent orthogonalization against a growing list of solved eigenvectors. In our specification of block J-D, all of the steps of the algorithm are performed in clusters, including the linear solves, which allows us to greatly reduce computational effort with blocked matrix-vector multiplies. In addition, we move orthogonalization against locked eigenvectors and working eigenvectors outside of the inner loop but retain the single Ritz vector projection corresponding to the index of the correction vector. Furthermore, we minimize the computational effort by constraining the working subspace to the current vectors being updated and the latest set of corresponding correction vectors. Finally, we incorporate accuracy thresholds based on the precision required by the Fermi-Dirac distribution. The net result is a significant reduction in the computational effort against most previous block J-D implementations, especially as the number of wanted eigenpairs grows. We compare our approach with another robust implementation of block J-D (JDQMR) and the state-of-the-art Chebyshev filter subspace (CheFSI) method for various real-space density functional theory systems. Versus CheFSI, for first-row elements, our method yields competitive timings for valence-only systems and 4-6× speedups for all-electron systems with up to 10× reduced matrix-vector multiplies. For all-electron calculations on larger elements (e.g., gold) where the wanted spectrum is quite narrow compared to the full spectrum, we observe 60× speedup with 200× fewer matrix-vector multiples vs. CheFSI.

  7. A robust variant of block Jacobi-Davidson for extracting a large number of eigenpairs: Application to grid-based real-space density functional theory.

    PubMed

    Lee, M; Leiter, K; Eisner, C; Breuer, A; Wang, X

    2017-09-21

    In this work, we investigate a block Jacobi-Davidson (J-D) variant suitable for sparse symmetric eigenproblems where a substantial number of extremal eigenvalues are desired (e.g., ground-state real-space quantum chemistry). Most J-D algorithm variations tend to slow down as the number of desired eigenpairs increases due to frequent orthogonalization against a growing list of solved eigenvectors. In our specification of block J-D, all of the steps of the algorithm are performed in clusters, including the linear solves, which allows us to greatly reduce computational effort with blocked matrix-vector multiplies. In addition, we move orthogonalization against locked eigenvectors and working eigenvectors outside of the inner loop but retain the single Ritz vector projection corresponding to the index of the correction vector. Furthermore, we minimize the computational effort by constraining the working subspace to the current vectors being updated and the latest set of corresponding correction vectors. Finally, we incorporate accuracy thresholds based on the precision required by the Fermi-Dirac distribution. The net result is a significant reduction in the computational effort against most previous block J-D implementations, especially as the number of wanted eigenpairs grows. We compare our approach with another robust implementation of block J-D (JDQMR) and the state-of-the-art Chebyshev filter subspace (CheFSI) method for various real-space density functional theory systems. Versus CheFSI, for first-row elements, our method yields competitive timings for valence-only systems and 4-6× speedups for all-electron systems with up to 10× reduced matrix-vector multiplies. For all-electron calculations on larger elements (e.g., gold) where the wanted spectrum is quite narrow compared to the full spectrum, we observe 60× speedup with 200× fewer matrix-vector multiples vs. CheFSI.

  8. Neural substrates for observing and imagining non-object-directed actions.

    PubMed

    Lui, Fausta; Buccino, Giovanni; Duzzi, Davide; Benuzzi, Francesca; Crisi, Girolamo; Baraldi, Patrizia; Nichelli, Paolo; Porro, Carlo Adolfo; Rizzolatti, Giacomo

    2008-01-01

    The present fMRI study was aimed at assessing the cortical areas active when individuals observe non-object-directed actions (mimed, symbolic, and meaningless), and when they imagine performing those same actions. fMRI signal increases in common between action observation and motor imagery were found in the premotor cortex and in a large region of the inferior parietal lobule. While the premotor cortex activation overlapped that previously found during the observation and imagination of object-directed actions, in the parietal lobe the signal increase was not restricted to the intraparietal sulcus region, known to be active during the observation and imagination of object-directed actions, but extended into the supramarginal and angular gyri. When contrasting motor imagery with the observation of non-object-directed actions, signal increases were found in the mesial frontal and cingulate cortices, the supramarginal gyrus, and the inferior frontal gyrus. The opposite contrast showed activation virtually limited to visual areas. In conclusion, the present data define the common circuit for observing and imagining non-object-directed actions. In addition, they show that the representation of non-object-directed actions include parietal regions not found to be involved in coding object-directed actions.

  9. Direct observation in medical education: a review of the literature and evidence for validity.

    PubMed

    Fromme, H Barrett; Karani, Reena; Downing, Steven M

    2009-08-01

    In 2000, the Accreditation Council for Medical Education introduced a new initiative that substantively changed the method by which residency programs are evaluated. In this new competency-based approach to residency education, assessment of performance became a main area of interest, and direct observation was offered as a tool to assess knowledge and skills. Despite being an inherent part of medical education as faculty and learners work together in clinical experiences, direct observation has traditionally been an informal and underused assessment method across all specialties. Residents and students report rarely being observed during their educational process, even though they value the experience. Reasons for this include a lack of faculty time, a lack of faculty skills, a potential stressful effect on the learner, and a perceived lack of validation of the assessment. This article examines the literature regarding the use of direct observation in medical education with a focus on validity evidence. We performed a PubMed search of articles pertaining to direct observation, using key words such as direct observation, performance observation, clinical observation, students, and residents. A subsequent search was conducted in known articles, focusing on variations of the term observation in the titles of articles and introducing the concept of clinical competence. In conclusion, direct observation is a unique and useful tool in the assessment of medical students and residents. Assessing learners in natural settings offers the opportunity to see beyond what they know and into what they actually do, which is fundamentally essential to training qualified physicians. Although the literature identifies several threats to its validity as an assessment, it also demonstrates methods to minimize those threats. Based on the current recommendations and need for performance assessment in education and with attention paid to the development and design, direct observation can

  10. Nonequilibrium dynamics of random field Ising spin chains: exact results via real space renormalization group.

    PubMed

    Fisher, D S; Le Doussal, P; Monthus, C

    2001-12-01

    The nonequilibrium dynamics of classical random Ising spin chains with nonconserved magnetization are studied using an asymptotically exact real space renormalization group (RSRG). We focus on random field Ising model (RFIM) spin chains with and without a uniform applied field, as well as on Ising spin glass chains in an applied field. For the RFIM we consider a universal regime where the random field and the temperature are both much smaller than the exchange coupling. In this regime, the Imry-Ma length that sets the scale of the equilibrium correlations is large and the coarsening of domains from random initial conditions (e.g., a quench from high temperature) occurs over a wide range of length scales. The two types of domain walls that occur diffuse in opposite random potentials, of the form studied by Sinai, and domain walls annihilate when they meet. Using the RSRG we compute many universal asymptotic properties of both the nonequilibrium dynamics and the equilibrium limit. We find that the configurations of the domain walls converge rapidly toward a set of system-specific time-dependent positions that are independent of the initial conditions. Thus the behavior of this nonequilibrium system is pseudodeterministic at long times because of the broad distributions of barriers that occur on the long length scales involved. Specifically, we obtain the time dependence of the energy, the magnetization, and the distribution of domain sizes (found to be statistically independent). The equilibrium limits agree with known exact results. We obtain the exact scaling form of the two-point equal time correlation function and the two-time autocorrelations . We also compute the persistence properties of a single spin, of local magnetization, and of domains. The analogous quantities for the +/-J Ising spin glass in an applied field are obtained from the RFIM via a gauge transformation. In addition to these we compute the two-point two

  11. Direct retrieval of ocean surface evaporation and latent heat flux from the spacebased observations

    NASA Technical Reports Server (NTRS)

    Liu, W. T.; Tang, W.

    2000-01-01

    The Tropical Rain Measuring Mission (TRMM) provides the opportunity to improve the spacebased estimation of evaporation. An algorithm for retrieving evaporation directly from the radiances observed by the TRMM Microwave Imager and its validation results are described.

  12. Instructional Interactions of Kindergarten Mathematics Classrooms: Validating a Direct Observation Instrument

    ERIC Educational Resources Information Center

    Doabler, Christian; Smolkowski, Keith; Fien, Hank; Kosty, Derek B.; Cary, Mari Strand

    2010-01-01

    In this paper, the authors report research focused directly on the validation of the Coding of Academic Teacher-Student interactions (CATS) direct observation instrument. They use classroom information gathered by the CATS instrument to better understand the potential mediating variables hypothesized to influence student achievement. Their study's…

  13. Experience-Based Guidance for Implementing a Direct Observation Checklist in a Pediatric Emergency Department Setting

    PubMed Central

    FitzGerald, Michael; Mallory, Mia; Mittiga, Matthew; Schubert, Charles; Schwartz, Hamilton; Gonzalez, Javier; Duma, Elena; McAneney, Constance

    2012-01-01

    Background The importance and benefits of direct observation in residency training have been underscored by a number of studies. Yet, implementing direct observation in an effective and sustainable way is hampered by demands on physicians' time and shrinking resources for educational innovation. Objective To describe the development and pilot implementation of a direct observation tool to assess the history and physical examination skills of interns in a pediatric emergency department rotation. Methods A task force developed specific history and physical examination checklists for a range of common conditions. For the pilot implementation, 10 pediatric emergency medicine faculty attendings conducted the initial observations of 34 interns during the course of 1 academic year. At the conclusion of the pilot, the faculty observers and interns were interviewed to assess the feasibility and benefits of the process. Results A total of 33 of the 34 interns were observed during their rotation, with 26 of the observations conducted when the faculty observer was off shift, and it took approximately 20 minutes to complete each observation. In terms of learning benefits, interns and faculty observers reported that it facilitated clear and useful feedback and revealed gaps that would not have otherwise been identified. Faculty observers also mentioned that it helped them focus their teaching effort, built empathy with learners, and gave them a way to demonstrate a true concern for their learning. Conclusion Our results offer evidence for the feasibility and benefits of the direct observation checklists. The description of the implementation, challenges, and response to those challenges may help others avoid some of the common problems faced when implementing direct observation methods. PMID:24294433

  14. Simultaneous Measurements of direct, semi-direct and indirect aerosol forcing with Stacked Autonomous UAVs: A New Observing Platform

    NASA Astrophysics Data System (ADS)

    Ramanathan, V.; Roberts, G.; Ramana, M. V.; Corrigan, C.; Nguyen, H.

    2006-12-01

    We report here first time demonstration with three autonomously flying Unmanned Aerial Vehicles (UAVs) of cloudy sky albedo, transmission atmospheric solar absorption, aerosol and cloud droplet concentrations and number densities. From these direct measurements we derive the direct, semi-direct and the first indirect aerosol forcing. The observing system consisted of 3 light weight UAVs, instrumented with miniaturized instruments (Roberts et al, 2006; Ramana et al, 2006; Corrigan et al 2006) for measuring aerosol concentrations and size distribution, cloud microphysical properties, black carbon concentration and broad band and narrow band solar fluxes. The airborne measurements were validated and augmented by the Atmospheric Brown Clouds Maldives Climate Observatory (ABC_MCO) in the island of Hanimaadhoo in the N. Indian Ocean (Corrigan et al, 2006; Ramana and Ramanathan 2006). The campaign was conducted during March and early April of 2006 when this region is subject to long range transport of pollution from S. Asia. In the stacked 3_UAV configuration, one flew in the boundary layer below clouds to characterize the aerosols feeding the clouds and the transmission of solar radiation by the absorbing aerosol layer and clouds above; the second inside the trade cumulus clouds to directly observe the fully nucleated cloud drop size and concentrations and total liquid water content; and the third above the cloud to determine the incoming solar and the reflected solar radiation. The 3-UAVs were programmed to sample the same region(or clouds) within seconds of each other, thus providing unique insights into how aerosols and boundary layer dynamics modulate the cloud microphysics and thus the albedo and solar absorption of cloudy skies in the planet. The period of observations also included a major dust-soot event which revealed a large increase in atmospheric solar absorption. We will present results on how 3- dimensional clouds with absorbing aerosols modulate

  15. Direct Adaptive Neural Control for a Class of Uncertain Nonaffine Nonlinear Systems Based on Disturbance Observer.

    PubMed

    Chen, Mou; Ge, Shuzhi Sam

    2013-08-01

    In this paper, the direct adaptive neural control is proposed for a class of uncertain nonaffine nonlinear systems with unknown nonsymmetric input saturation. Based on the implicit function theorem and mean value theorem, both state feedback and output feedback direct adaptive controls are developed using neural networks (NNs) and a disturbance observer. A compounded disturbance is defined to take into account of the effect of the unknown external disturbance, the unknown nonsymmetric input saturation, and the approximation error of NN. Then, a disturbance observer is developed to estimate the unknown compounded disturbance, and it is established that the estimate error converges to a compact set if appropriate observer design parameters are chosen. Both state feedback and output feedback direct adaptive controls can guarantee semiglobal uniform boundedness of the closed-loop system signals as rigorously proved by Lyapunov analysis. Numerical simulation results are presented to illustrate the effectiveness of the proposed direct adaptive neural control techniques.

  16. Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method

    NASA Astrophysics Data System (ADS)

    Enkovaara, J.; Rostgaard, C.; Mortensen, J. J.; Chen, J.; Dułak, M.; Ferrighi, L.; Gavnholt, J.; Glinsvad, C.; Haikola, V.; Hansen, H. A.; Kristoffersen, H. H.; Kuisma, M.; Larsen, A. H.; Lehtovaara, L.; Ljungberg, M.; Lopez-Acevedo, O.; Moses, P. G.; Ojanen, J.; Olsen, T.; Petzold, V.; Romero, N. A.; Stausholm-Møller, J.; Strange, M.; Tritsaris, G. A.; Vanin, M.; Walter, M.; Hammer, B.; Häkkinen, H.; Madsen, G. K. H.; Nieminen, R. M.; Nørskov, J. K.; Puska, M.; Rantala, T. T.; Schiøtz, J.; Thygesen, K. S.; Jacobsen, K. W.

    2010-06-01

    Electronic structure calculations have become an indispensable tool in many areas of materials science and quantum chemistry. Even though the Kohn-Sham formulation of the density-functional theory (DFT) simplifies the many-body problem significantly, one is still confronted with several numerical challenges. In this article we present the projector augmented-wave (PAW) method as implemented in the GPAW program package (https://wiki.fysik.dtu.dk/gpaw) using a uniform real-space grid representation of the electronic wavefunctions. Compared to more traditional plane wave or localized basis set approaches, real-space grids offer several advantages, most notably good computational scalability and systematic convergence properties. However, as a unique feature GPAW also facilitates a localized atomic-orbital basis set in addition to the grid. The efficient atomic basis set is complementary to the more accurate grid, and the possibility to seamlessly switch between the two representations provides great flexibility. While DFT allows one to study ground state properties, time-dependent density-functional theory (TDDFT) provides access to the excited states. We have implemented the two common formulations of TDDFT, namely the linear-response and the time propagation schemes. Electron transport calculations under finite-bias conditions can be performed with GPAW using non-equilibrium Green functions and the localized basis set. In addition to the basic features of the real-space PAW method, we also describe the implementation of selected exchange-correlation functionals, parallelization schemes, ΔSCF-method, x-ray absorption spectra, and maximally localized Wannier orbitals.

  17. EDF: Computing electron number probability distribution functions in real space from molecular wave functions

    NASA Astrophysics Data System (ADS)

    Francisco, E.; Pendás, A. Martín; Blanco, M. A.

    2008-04-01

    Given an N-electron molecule and an exhaustive partition of the real space ( R) into m arbitrary regions Ω,Ω,…,Ω ( ⋃i=1mΩ=R), the edf program computes all the probabilities P(n,n,…,n) of having exactly n electrons in Ω, n electrons in Ω,…, and n electrons ( n+n+⋯+n=N) in Ω. Each Ω may correspond to a single basin (atomic domain) or several such basins (functional group). In the later case, each atomic domain must belong to a single Ω. The program can manage both single- and multi-determinant wave functions which are read in from an aimpac-like wave function description ( .wfn) file (T.A. Keith et al., The AIMPAC95 programs, http://www.chemistry.mcmaster.ca/aimpac, 1995). For multi-determinantal wave functions a generalization of the original .wfn file has been introduced. The new format is completely backwards compatible, adding to the previous structure a description of the configuration interaction (CI) coefficients and the determinants of correlated wave functions. Besides the .wfn file, edf only needs the overlap integrals over all the atomic domains between the molecular orbitals (MO). After the P(n,n,…,n) probabilities are computed, edf obtains from them several magnitudes relevant to chemical bonding theory, such as average electronic populations and localization/delocalization indices. Regarding spin, edf may be used in two ways: with or without a splitting of the P(n,n,…,n) probabilities into α and β spin components. Program summaryProgram title: edf Catalogue identifier: AEAJ_v1_0 Program summary URL:http://cpc.cs.qub.ac.uk/summaries/AEAJ_v1_0.html Program obtainable from: CPC Program Library, Queen's University, Belfast, N. Ireland Licensing provisions: Standard CPC licence, http://cpc.cs.qub.ac.uk/licence/licence.html No. of lines in distributed program, including test data, etc.: 5387 No. of bytes in distributed program, including test data, etc.: 52 381 Distribution format: tar.gz Programming language: Fortran 77 Computer

  18. First-Principles Calculation of the Real-Space Order Parameter and Condensation Energy Density in Phonon-Mediated Superconductors.

    PubMed

    Linscheid, A; Sanna, A; Floris, A; Gross, E K U

    2015-08-28

    We show that the superconducting order parameter and condensation energy density of phonon-mediated superconductors can be calculated in real space from first principles density functional theory for superconductors. This method highlights the connection between the chemical bonding structure and the superconducting condensation and reveals new and interesting properties of superconducting materials. Understanding this connection is essential to describe nanostructured superconducting systems where the usual reciprocal space analysis hides the basic physical mechanism. In a first application we present results for MgB2, CaC6 and hole-doped graphane.

  19. First-Principles Calculation of the Real-Space Order Parameter and Condensation Energy Density in Phonon-Mediated Superconductors

    NASA Astrophysics Data System (ADS)

    Linscheid, A.; Sanna, A.; Floris, A.; Gross, E. K. U.

    2015-08-01

    We show that the superconducting order parameter and condensation energy density of phonon-mediated superconductors can be calculated in real space from first principles density functional theory for superconductors. This method highlights the connection between the chemical bonding structure and the superconducting condensation and reveals new and interesting properties of superconducting materials. Understanding this connection is essential to describe nanostructured superconducting systems where the usual reciprocal space analysis hides the basic physical mechanism. In a first application we present results for MgB2 , CaC6 and hole-doped graphane.

  20. A connection between domain-averaged Fermi hole orbitals and electron number distribution functions in real space

    NASA Astrophysics Data System (ADS)

    Francisco, E.; Martín Pendás, A.; Blanco, M. A.

    2009-09-01

    We show in this article how for single-determinant wave functions the one-electron functions derived from the diagonalization of the Fermi hole, averaged over an arbitrary domain Ω of real space, and expressed in terms of the occupied canonical orbitals, describe coarse-grained statistically independent electrons. With these domain-averaged Fermi hole (DAFH) orbitals, the full electron number distribution function (EDF) is given by a simple product of one-electron events. This useful property follows from the simultaneous orthogonality of the DAFH orbitals in Ω, Ω'=R3-Ω, and R3. We also show how the interfragment (shared electron) delocalization index, δΩ,Ω', transforms into a sum of one-electron DAFH contributions. Description of chemical bonding in terms of DAFH orbitals provides a vivid picture relating bonding and delocalization in real space. DAFH and EDF analyses are performed on several test systems to illustrate the close relationship between both concepts. Finally, these analyses clearly prove how DAFH orbitals well localized in Ω or Ω' can be simply ignored in computing the EDFs and/or δΩ,Ω', and thus do not contribute to the chemical bonding between the two fragments.

  1. Direct observation of grain growth from molten silicon formed by micro-thermal-plasma-jet irradiation

    SciTech Connect

    Hayashi, Shohei; Fujita, Yuji; Kamikura, Takahiro; Sakaike, Kohei; Akazawa, Muneki; Ikeda, Mitsuhisa; Hanafusa, Hiroaki; Higashi, Seiichiro

    2012-10-22

    Phase transformation of amorphous-silicon during millisecond annealing using micro-thermal-plasma-jet irradiation was directly observed using a high-speed camera with microsecond time resolution. An oval-shaped molten-silicon region adjacent to the solid phase crystallization region was clearly observed, followed by lateral large grain growth perpendicular to a liquid-solid interface. Furthermore, leading wave crystallization (LWC), which showed intermittent explosive crystallization, was discovered in front of the moving molten region. The growth mechanism of LWC has been investigated on the basis of numerical simulation implementing explosive movement of a thin liquid layer driven by released latent heat diffusion in a lateral direction.

  2. Direct observation of blocked nanoscale surface evaporation on SiO2 nanodroplets

    NASA Astrophysics Data System (ADS)

    Wan, Neng; Xu, Jun; Sun, Li-Tao; Martini, Matteo; Huang, Qing-An; Hu, Xiao-Hui; Xu, Tao; Bi, Heng-Chang; Sun, Jun

    2012-10-01

    Nano-scale surface evaporation of SiO2 nanodroplets from a volcano-shaped tip (tip diameter d ˜ 20 nm to 70 nm) was observed directly using an in situ transmission electron microscopy method. Au nanoparticles, those precipitated in the SiO2 matrix after an Au catalyzed growth, diffused and pinned onto the evaporation surface, which induced blocked evaporation dynamics. Our observations provide direct evidences of blocked evaporation dynamics caused by small-sized nanoparticles at the nanometer scale.

  3. Directional surface plasmon coupled chemiluminescence from nickel thin films: Fixed angle observation

    NASA Astrophysics Data System (ADS)

    Weisenberg, Micah; Aslan, Kadir; Hortle, Elinor; Geddes, Chris D.

    2009-04-01

    Directional surface plasmon coupled chemiluminescence (SPCC) from nickel thin films is demonstrated. Free-space and angular-dependent SPCC emission from blue, green and turquoise chemiluminescent solutions placed onto nickel thin films attached to a hemispherical prism were measured. SPCC emission was found to be highly directional and preferentially p-polarized, in contrast to the unpolarized and isotropic chemiluminescence emission. The largest SPCC emission for all chemiluminescence solutions was observed at a fixed observation angle of 60°, which was also predicted by theoretical Fresnel calculations. It was found that nickel thin films did not have a catalytic effect on chemiluminescence emission.

  4. Assessment of Interobserver Reliability in Nutrition Studies that Use Direct Observation of School Meals

    PubMed Central

    BAGLIO, MICHELLE L.; BAXTER, SUZANNE DOMEL; GUINN, CAROLINE H.; THOMPSON, WILLIAM O.; SHAFFER, NICOLE M.; FRYE, FRANCESCA H. A.

    2005-01-01

    This article (a) provides a general review of interobserver reliability (IOR) and (b) describes our method for assessing IOR for items and amounts consumed during school meals for a series of studies regarding the accuracy of fourth-grade children's dietary recalls validated with direct observation of school meals. A widely used validation method for dietary assessment is direct observation of meals. Although many studies utilize several people to conduct direct observations, few published studies indicate whether IOR was assessed. Assessment of IOR is necessary to determine that the information collected does not depend on who conducted the observation. Two strengths of our method for assessing IOR are that IOR was assessed regularly throughout the data collection period and that IOR was assessed for foods at the item and amount level instead of at the nutrient level. Adequate agreement among observers is essential to the reasoning behind using observation as a validation tool. Readers are encouraged to question the results of studies that fail to mention and/or to include the results for assessment of IOR when multiple people have conducted observations. PMID:15354155

  5. Using direct clinical observation to assess the quality of cesarean delivery in Afghanistan: an exploratory study.

    PubMed

    Evans, Cherrie Lynn; Kim, Young Mi; Yari, Khalid; Ansari, Nasratullah; Tappis, Hannah

    2014-05-27

    As part of a National Emergency Obstetric and Newborn Care (EmONC) Needs Assessment, a special study was undertaken in July 2010 to examine the quality of cesarean deliveries in Afghanistan and examine the utility of direct clinical observation as an assessment method in low-resource settings. This cross-sectional assessment of the quality of cesareans at 14 facilities in Afghanistan included a survey of surgeons regarding their routine cesarean practices, direct observation of 29 cesarean deliveries and comparison of observations with facility records for 34 additional cesareans conducted during the 3 days prior to the observation period at each facility. For both observed cases and record reviews, we assessed time intervals between specified points of care-arrival to the ward, first evaluation, detection of a complication, decision for cesarean, incision, and birth. All time intervals with the exception of "decision to skin incision" were longer in the record reviews than in observed cases. Prior cesarean was the most common primary indication for all cases. All mothers in both groups observed survived through one hour postpartum. Among newborns there were two stillbirths (7%) in observed births and seven (21%) record reviews. Although our sample is too small to show statistical significance, the difference is noteworthy. In six of the reviewed cesareans resulting in stillbirth, a fetal heart rate was recorded in the operating theater, although four were recorded as macerated. For the two fresh stillbirths, the cesarean surgeries were recorded as scheduled and not urgent. Direct observation of cesarean deliveries enabled us to assess a number of preoperative, postoperative, and intraoperative procedures that are often not described in medical records in low resource settings. Comparison of observations with findings from provider interviews and facility records allowed us to infer whether observed practices were typical of providers and facilities and detect

  6. Using direct clinical observation to assess the quality of cesarean delivery in Afghanistan: an exploratory study

    PubMed Central

    2014-01-01

    Background As part of a National Emergency Obstetric and Newborn Care (EmONC) Needs Assessment, a special study was undertaken in July 2010 to examine the quality of cesarean deliveries in Afghanistan and examine the utility of direct clinical observation as an assessment method in low-resource settings. Methods This cross-sectional assessment of the quality of cesareans at 14 facilities in Afghanistan included a survey of surgeons regarding their routine cesarean practices, direct observation of 29 cesarean deliveries and comparison of observations with facility records for 34 additional cesareans conducted during the 3 days prior to the observation period at each facility. For both observed cases and record reviews, we assessed time intervals between specified points of care-arrival to the ward, first evaluation, detection of a complication, decision for cesarean, incision, and birth. Results All time intervals with the exception of “decision to skin incision” were longer in the record reviews than in observed cases. Prior cesarean was the most common primary indication for all cases. All mothers in both groups observed survived through one hour postpartum. Among newborns there were two stillbirths (7%) in observed births and seven (21%) record reviews. Although our sample is too small to show statistical significance, the difference is noteworthy. In six of the reviewed cesareans resulting in stillbirth, a fetal heart rate was recorded in the operating theater, although four were recorded as macerated. For the two fresh stillbirths, the cesarean surgeries were recorded as scheduled and not urgent. Conclusions Direct observation of cesarean deliveries enabled us to assess a number of preoperative, postoperative, and intraoperative procedures that are often not described in medical records in low resource settings. Comparison of observations with findings from provider interviews and facility records allowed us to infer whether observed practices were typical

  7. Direct observation of the actin filament by tip-scan atomic force microscopy.

    PubMed

    Narita, Akihiro; Usukura, Eiji; Yagi, Akira; Tateyama, Kiyohiko; Akizuki, Shogo; Kikumoto, Mahito; Matsumoto, Tomoharu; Maéda, Yuichiro; Ito, Shuichi; Usukura, Jiro

    2016-08-01

    Actin filaments, the actin-myosin complex and the actin-tropomyosin complex were observed by a tip-scan atomic force microscope (AFM), which was recently developed by Olympus as the AFM part of a correlative microscope. This newly developed AFM uses cantilevers of similar size as stage-scan AFMs to improve substantially the spatial and temporal resolution. Such an approach has previously never been possible by a tip-scan system, in which a cantilever moves in the x, y and z directions. We evaluated the performance of this developed tip-scan AFM by observing the molecular structure of actin filaments and the actin-tropomyosin complex. In the image of the actin filament, the molecular interval of the actin subunits (∼5.5 nm) was clearly observed as stripes. From the shape of the stripes, the polarity of the actin filament was directly determined and the results were consistent with the polarity determined by myosin binding. In the image of the actin-tropomyosin complex, each tropomyosin molecule (∼2 nm in diameter) on the actin filament was directly observed without averaging images of different molecules. Each tropomyosin molecule on the actin filament has never been directly observed by AFM or electron microscopy. Thus, our developed tip-scan AFM offers significant potential in observing purified proteins and cellular structures at nanometer resolution. Current results represent an important step in the development of a new correlative microscope to observe nm-order structures at an acceptable frame rate (∼10 s/frame) by AFM at the position indicated by the fluorescent dye observed under a light microscope. © The Author 2016. Published by Oxford University Press on behalf of The Japanese Society of Microscopy.

  8. Promoting adherence to treatment for tuberculosis: the importance of direct observation.

    PubMed

    Frieden, Thomas R; Sbarbaro, John A

    2007-01-01

    Since 1993, WHO has recommended a strategy through which national governments can meet their responsibility to treat patients and to prevent the spread of tuberculosis (TBI). Four of the major elements of the strategy, which came to be known as DOTS, were political commitment by governments, improved laboratory services, a continuous supply of good-quality drugs, and a reporting system to document the progress (and failure) of treatment for individual patients and of the programme. The fifth element, effective case management via direct observation of treatment by an independent and trained third party, was a response to decades of reports documenting the failure of patients to complete treatment. Put simply: direct observation of treatment is an integral and essential component of DOTS. The value of the direct observation component of DOTS has been questioned in a recent systematic review, in which it was suggested that direct observation of treatment is unnecessary and disrespectful of patients. Both self-administered treatment and treatment observation by a family member have been proposed as acceptable alternatives. This article challenges the validity of these assertions on the basis that, firstly, direct observation requires strong leadership and a lengthy commitment of human resources, which as yet is not universally employed. Secondly, it is believed that the ultimate ethical and legal responsibility for ensuring treatment completion and cure of a communicable disease belongs to the public health system and the community, and not to the individual patient. TB, this article will seek to argue, can be controlled when appropriate policies are implemented and continued, even in the absence of an outbreak or media attention. Just as patients may be tempted to change or stop an effective treatment regimen because of the long duration of treatment, public health policy-makers may be tempted to alter key elements of DOTS because of the persistence required to

  9. Observing Grasping Actions Directed to Emotion-Laden Objects: Effects upon Corticospinal Excitability

    PubMed Central

    Nogueira-Campos, Anaelli A.; Saunier, Ghislain; Della-Maggiore, Valeria; De Oliveira, Laura A. S.; Rodrigues, Erika C.; Vargas, Claudia D.

    2016-01-01

    The motor system is recruited whenever one executes an action as well as when one observes the same action being executed by others. Although it is well established that emotion modulates the motor system, the effect of observing other individuals acting in an emotional context is particularly elusive. The main aim of this study was to investigate the effect induced by the observation of grasping directed to emotion-laden objects upon corticospinal excitability (CSE). Participants classified video-clips depicting the right-hand of an actor grasping emotion-laden objects. Twenty video-clips differing in terms of valence but balanced in arousal level were selected. Motor evoked potentials (MEPs) were then recorded from the first dorsal interosseous using transcranial magnetic stimulation (TMS) while the participants observed the selected emotional video-clips. During the video-clip presentation, TMS pulses were randomly applied at one of two different time points of grasping: (1) maximum grip aperture, and (2) object contact time. CSE was higher during the observation of grasping directed to unpleasant objects compared to pleasant ones. These results indicate that when someone observes an action of grasping directed to emotion-laden objects, the effect of the object valence promotes a specific modulation over the motor system. PMID:27625602

  10. Direct observation of liquid crystals using cryo-TEM: specimen preparation and low-dose imaging.

    PubMed

    Gao, Min; Kim, Young-Ki; Zhang, Cuiyu; Borshch, Volodymyr; Zhou, Shuang; Park, Heung-Shik; Jákli, Antal; Lavrentovich, Oleg D; Tamba, Maria-Gabriela; Kohlmeier, Alexandra; Mehl, Georg H; Weissflog, Wolfgang; Studer, Daniel; Zuber, Benoît; Gnägi, Helmut; Lin, Fang

    2014-10-01

    Liquid crystals (LCs) represent a challenging group of materials for direct transmission electron microscopy (TEM) studies due to the complications in specimen preparation and the severe radiation damage. In this paper, we summarize a series of specimen preparation methods, including thin film and cryo-sectioning approaches, as a comprehensive toolset enabling high-resolution direct cryo-TEM observation of a broad range of LCs. We also present comparative analysis using cryo-TEM and replica freeze-fracture TEM on both thermotropic and lyotropic LCs. In addition to the revisits of previous practices, some new concepts are introduced, e.g., suspended thermotropic LC thin films, combined high-pressure freezing and cryo-sectioning of lyotropic LCs, and the complementary applications of direct TEM and indirect replica TEM techniques. The significance of subnanometer resolution cryo-TEM observation is demonstrated in a few important issues in LC studies, including providing direct evidences for the existence of nanoscale smectic domains in nematic bent-core thermotropic LCs, comprehensive understanding of the twist-bend nematic phase, and probing the packing of columnar aggregates in lyotropic chromonic LCs. Direct TEM observation opens ways to a variety of TEM techniques, suggesting that TEM (replica, cryo, and in situ techniques), in general, may be a promising part of the solution to the lack of effective structural probe at the molecular scale in LC studies. © 2014 Wiley Periodicals, Inc.

  11. Standardizing the Pre-Licensure Supervision Process: A Commentary on Advocating for Direct Observation of Skills

    ERIC Educational Resources Information Center

    Gray, Neal D.; Erickson, Paul

    2013-01-01

    The present paper advocates for standardized regulations and laws for supervision of pre-licensed counselors in the United States, particularly for direct observation of clinical skills. A review of regulations by the American Counseling Association (ACA) Office of Professional Affairs (2012) reveals that only two states (Arizona and North…

  12. Proposal of the Experiment on Direct Observation of e-cloud

    SciTech Connect

    Heifets, S.

    2004-09-28

    Measurements of the attenuation of the rf wave can be used for direct observation of the electron cloud in LER positron ring. A simple experiment is suggested. Estimates show that damping of the rf wave proportional to the density of the electron cloud should be possible to detect.

  13. The Impact of Observation Duration on the Accuracy of Data Obtained from Direct Behavior Rating (DBR)

    ERIC Educational Resources Information Center

    Riley-Tillman, T. Chris; Christ, Theodore J.; Chafouleas, Sandra M.; Boice-Mallach, Christina H.; Briesch, Amy

    2011-01-01

    In this study, evaluation of direct behavior rating (DBR) occurred with regard to two primary areas: (a) accuracy of ratings with varied instrumentation (anchoring: proportional or absolute) and procedures (observation length: 5 min, 10 min, or 20 min) and (b) one-week test-retest reliability. Participants viewed video clips of a typical third…

  14. Affective Evaluations of Objects Are Influenced by Observed Gaze Direction and Emotional Expression

    ERIC Educational Resources Information Center

    Bayliss, Andrew P.; Frischen, Alexandra; Fenske, Mark J.; Tipper, Steven P.

    2007-01-01

    Gaze direction signals another person's focus of interest. Facial expressions convey information about their mental state. Appropriate responses to these signals should reflect their combined influence, yet current evidence suggests that gaze-cueing effects for objects near an observed face are not modulated by its emotional expression. Here, we…

  15. Directly Observed Interaction within Adolescent Romantic Relationships: What Have We Learned?

    ERIC Educational Resources Information Center

    Welsh, Deborah P.; Shulman, Shmuel

    2008-01-01

    Review and conceptual analysis of the papers in this special issue calls attention to several important methodological and conceptual issues surrounding the direct observation of adolescent romantic couples. It also provides an important new foundation of knowledge about the nature of adolescents' romantic relationships. Connections with previous…

  16. Observational Learning of Academic and Social Behaviors during Small-Group Direct Instruction

    ERIC Educational Resources Information Center

    Ledford, Jennifer R.; Wolery, Mark

    2015-01-01

    Many studies have shown that small-group direct instruction is effective and efficient for teaching students with and without disabilities, although relatively few studies have been conducted with heterogeneous groups of preschool participants. In addition, previous studies have primarily assessed whether observational learning occurred for…

  17. Three-Item Direct Observation Screen (TIDOS) for Autism Spectrum Disorder

    ERIC Educational Resources Information Center

    Oner, Pinar; Oner, Ozgur; Munir, Kerim

    2014-01-01

    We compared ratings on the Three-Item Direct Observation Screen test for autism spectrum disorders completed by pediatric residents with the Social Communication Questionnaire parent reports as an augmentative tool for improving autism spectrum disorder screening performance. We examined three groups of children (18-60 months) comparable in age…

  18. Observational Learning of Academic and Social Behaviors during Small-Group Direct Instruction

    ERIC Educational Resources Information Center

    Ledford, Jennifer R.; Wolery, Mark

    2015-01-01

    Many studies have shown that small-group direct instruction is effective and efficient for teaching students with and without disabilities, although relatively few studies have been conducted with heterogeneous groups of preschool participants. In addition, previous studies have primarily assessed whether observational learning occurred for…

  19. Direct observation of the optical plasma resonance of Ag by photon-assisted tunneling

    NASA Technical Reports Server (NTRS)

    Jain, R. K.; Farrier, M. G.; Gustafson, T. K.

    1976-01-01

    Photon-assisted tunneling is proposed for the investigation of optical plasma resonances; this is demonstrated by the direct observation of the Ag resonance in appropriate Ag-Al2O3-Al structures. A spectral scan of the ratio of the signals photoinduced by the p and s polarizations shows a large enhancement corresponding to the plasma resonance of Ag.

  20. Considering Systematic Direct Observation after a Century of Research--Commentary on the Special Issue

    ERIC Educational Resources Information Center

    Stichter, Janine P.; Riley-Tillman, T. Chris

    2014-01-01

    Systematic Direct Observation (SDO) has played a pivotal role in the field of Emotional and/or Behavioral Disorders (EBD) since its inception as a key part of understanding more about the behaviors, contexts that impact them, and the effective supports necessary for this population. This methodology is an ongoing charge for everyone. The authors…

  1. Considering Systematic Direct Observation after a Century of Research--Commentary on the Special Issue

    ERIC Educational Resources Information Center

    Stichter, Janine P.; Riley-Tillman, T. Chris

    2014-01-01

    Systematic Direct Observation (SDO) has played a pivotal role in the field of Emotional and/or Behavioral Disorders (EBD) since its inception as a key part of understanding more about the behaviors, contexts that impact them, and the effective supports necessary for this population. This methodology is an ongoing charge for everyone. The authors…

  2. A comparison of in situ and airborne radar observations of ocean wave directionality

    NASA Technical Reports Server (NTRS)

    Jackson, F. C.; Walton, W. T.; Peng, C. Y.

    1985-01-01

    The directional spectrum of a fully arisen, about 3 m sea as measured by an experimental airborne radar, the NASA K(u)-band radar ocean wave spectrometer (ROWS), is compared to reference pitch-roll buoy data and to the classical SWOP (stereo wave observations project) spectrum for fully developed conditions. The ROWS spectrum, inferred indirectly from backscattered power measurements at 5-km altitude, is shown to be in excellent agreement with the buoy spectrum. Specifically, excellent agreement is found between the two nondirectional height spectra, and mean wave directions and directional spreads as functions of frequency. A comparison of the ROWS and SWOP spectra shows the two spectra to be very similar, in detailed shape as well as in terms of the gross spreading characteristics. Both spectra are seen to exhibit bimodal structures which accord with the Phillips' (1958) resonance mechanism. This observation is thus seen to support Phillips' contention that the SWOP modes were indeed resonance modes, not statistical artifacts.

  3. A comparison of in situ and airborne radar observations of ocean wave directionality

    NASA Technical Reports Server (NTRS)

    Jackson, F. C.; Walton, W. T.; Peng, C. Y.

    1985-01-01

    The directional spectrum of a fully arisen, about 3 m sea as measured by an experimental airborne radar, the NASA K(u)-band radar ocean wave spectrometer (ROWS), is compared to reference pitch-roll buoy data and to the classical SWOP (stereo wave observations project) spectrum for fully developed conditions. The ROWS spectrum, inferred indirectly from backscattered power measurements at 5-km altitude, is shown to be in excellent agreement with the buoy spectrum. Specifically, excellent agreement is found between the two nondirectional height spectra, and mean wave directions and directional spreads as functions of frequency. A comparison of the ROWS and SWOP spectra shows the two spectra to be very similar, in detailed shape as well as in terms of the gross spreading characteristics. Both spectra are seen to exhibit bimodal structures which accord with the Phillips' (1958) resonance mechanism. This observation is thus seen to support Phillips' contention that the SWOP modes were indeed resonance modes, not statistical artifacts.

  4. Real-Space Imaging of Carrier Dynamics of Materials Surfaces by Second-Generation Four-Dimensional Scanning Ultrafast Electron Microscopy.

    PubMed

    Sun, Jingya; Melnikov, Vasily A; Khan, Jafar I; Mohammed, Omar F

    2015-10-01

    In the fields of photocatalysis and photovoltaics, ultrafast dynamical processes, including carrier trapping and recombination on material surfaces, are among the key factors that determine the overall energy conversion efficiency. A precise knowledge of these dynamical events on the nanometer (nm) and femtosecond (fs) scales was not accessible until recently. The only way to access such fundamental processes fully is to map the surface dynamics selectively in real space and time. In this study, we establish a second generation of four-dimensional scanning ultrafast electron microscopy (4D S-UEM) and demonstrate the ability to record time-resolved images (snapshots) of material surfaces with 650 fs and ∼5 nm temporal and spatial resolutions, respectively. In this method, the surface of a specimen is excited by a clocking optical pulse and imaged using a pulsed primary electron beam as a probe pulse, generating secondary electrons (SEs), which are emitted from the surface of the specimen in a manner that is sensitive to the local electron/hole density. This method provides direct and controllable information regarding surface dynamics. We clearly demonstrate how the surface morphology, grains, defects, and nanostructured features can significantly impact the overall dynamical processes on the surface of photoactive-materials. In addition, the ability to access two regimes of dynamical probing in a single experiment and the energy loss of SEs in semiconductor-nanoscale materials will also be discussed.

  5. Rupture directivity of fluid-induced microseismic events: Observations from an enhanced geothermal system

    NASA Astrophysics Data System (ADS)

    Folesky, Jonas; Kummerow, Jörn; Shapiro, Serge A.; Häring, Markus; Asanuma, Hiroshi

    2016-11-01

    The rupture process of fluid-induced microseismic events is still poorly understood, mainly due to usually small magnitudes and sparse monitoring geometries. The high-quality recordings of the earthquake sequence 2006-2007 at the enhanced geothermal system at Basel, Switzerland, constitute a rare exception, allowing a systematic directivity study of 195 events using the empirical Green's function method. We observe clear directivity signatures for about half the events which demonstrates that rupture directivity persists down to small magnitudes (ML˜1). The predominant rupture behavior is unilateral. We further find evidence that directivity is magnitude dependent and varies systematically with distance from the injection source. Whereas pore pressure seems to play the dominant role close to the injection source and no preferred rupture direction is observable, directivity aligns parallel to the event distribution with increasing distance (≳100 m) and is preferably oriented away from the injection point. The largest analyzed events (ML˜2) show a distinct behavior: They rupture toward the injection source, suggesting that they nucleate in the vicinity of the pressure front and propagate backward into the perturbed volume. This finding is of particular relevance for seismic hazard assessment of georeservoirs, since it implies that maximum event size is related to dimension of the fluid-perturbed volume. Our study also resolves rupture complexities for a small group of events. This shows that small fault heterogeneities exist down to a scale of a few tens of meters. The observation of directivity and complexity in induced microseismic events suggest that future source studies account for these phenomena.

  6. Direct observation of the transition from calcite to aragonite growth as induced by abalone shell proteins.

    PubMed Central

    Thompson, J B; Paloczi, G T; Kindt, J H; Michenfelder, M; Smith, B L; Stucky, G; Morse, D E; Hansma, P K

    2000-01-01

    The mixture of EDTA-soluble proteins found in abalone nacre are known to cause the nucleation and growth of aragonite on calcite seed crystals in supersaturated solutions of calcium carbonate. Past atomic force microscope studies of the interaction of these proteins with calcite crystals did not observe this transition because no information about the crystal polymorph on the surface was obtained. Here we have used the atomic force microscope to directly observe changes in the atomic lattice on a calcite seed crystal after the introduction of abalone shell proteins. The observed changes are consistent with a transition to (001) aragonite growth on a (1014) calcite surface. PMID:11106633

  7. Three-item Direct Observation Screen (TIDOS) for autism spectrum disorder.

    PubMed

    Oner, Pinar; Oner, Ozgur; Munir, Kerim

    2014-08-01

    We compared ratings on the Three-Item Direct Observation Screen test for autism spectrum disorders completed by pediatric residents with the Social Communication Questionnaire parent reports as an augmentative tool for improving autism spectrum disorder screening performance. We examined three groups of children (18-60 months) comparable in age (18-24 month, 24-36 month, 36-60 preschool subgroups) and gender distribution: n = 86 with Diagnostic and Statistical Manual of Mental Disorders (4th ed., text rev.) autism spectrum disorders; n = 76 with developmental delay without autism spectrum disorders; and n = 97 with typical development. The Three-Item Direct Observation Screen test included the following (a) Joint Attention, (b) Eye Contact, and (c) Responsiveness to Name. The parent Social Communication Questionnaire ratings had a sensitivity of .73 and specificity of .70 for diagnosis of autism spectrum disorders. The Three-Item Direct Observation Screen test item Joint Attention had a sensitivity of .82 and specificity of .90, Eye Contact had a sensitivity of .89 and specificity of .91, and Responsiveness to Name had a sensitivity of .67 and specificity of .87. In the Three-Item Direct Observation Screen test, having at least one of the three items positive had a sensitivity of .95 and specificity of .85. Age, diagnosis of autism spectrum disorder, and developmental level were important factors affecting sensitivity and specificity. The results indicate that augmentation of autism spectrum disorder screening by observational items completed by trained pediatric-oriented professionals can be a highly effective tool in improving screening performance. If supported by future population studies, the results suggest that primary care practitioners will be able to be trained to use this direct procedure to augment screening for autism spectrum disorders in the community.

  8. Atomic scale real-space mapping of holes in YBa2Cu3O(6+δ).

    PubMed

    Gauquelin, N; Hawthorn, D G; Sawatzky, G A; Liang, R X; Bonn, D A; Hardy, W N; Botton, G A

    2014-07-15

    The high-temperature superconductor YBa2Cu3O(6+δ) consists of two main structural units--a bilayer of CuO2 planes that are central to superconductivity and a CuO(2+δ) chain layer. Although the functional role of the planes and chains has long been established, most probes integrate over both, which makes it difficult to distinguish the contribution of each. Here we use electron energy loss spectroscopy to directly resolve the plane and chain contributions to the electronic structure in YBa2Cu3O6 and YBa2Cu3O7. We directly probe the charge transfer of holes from the chains to the planes as a function of oxygen content, and show that the change in orbital occupation of Cu is large in the chain layer but modest in CuO2 planes, with holes in the planes doped primarily into the O 2p states. These results provide direct insight into the local electronic structure and charge transfers in this important high-temperature superconductor.

  9. Spherical harmonic analysis of the PSCz galaxy catalogue: redshift distortions and the real-space power spectrum

    NASA Astrophysics Data System (ADS)

    Tadros, H.; Ballinger, W. E.; Taylor, A. N.; Heavens, A. F.; Efstathiou, G.; Saunders, W.; Frenk, C. S.; Keeble, O.; McMahon, R.; Maddox, S. J.; Oliver, S.; Rowan-Robinson, M.; Sutherland, W. J.; White, S. D. M.

    1999-05-01

    We apply the formalism of spherical harmonic decomposition to the galaxy density field of the IRAS PSCz redshift survey. The PSCz redshift survey has almost all-sky coverage and includes IRAS galaxies to a flux limit of 0.6 Jy. Using maximum likelihood methods to examine (to first order) the distortion of the galaxy pattern resulting from redshift coordinates, we have measured the parameter beta=Omega^{0.6}/b. We also simultaneously measure either (a) the undistorted amplitude of perturbations in the galaxy distribution when a parametrized power spectrum is assumed, or (b) the shape and amplitude of the real-space power spectrum if the band-power in a set of passbands is measured in a step-wise fashion. These methods are extensively tested on a series of CDM, Lambda CDM and MDM simulations and are found to be unbiased. We obtain consistent results for the subset of the PSCz catalogue with flux above 0.75 Jy, but inclusion of galaxies to the formal flux limit of the catalogue gives variations which are larger than our internal errors. For the 0.75-Jy catalogue we find, in the case of a parametrized power spectrum, beta=0.58+/-0.26 and the amplitude of the real-space power measured at wavenumber k=0.1h Mpc^-1 is Delta_0.1=0.42+/-0.03. Freeing the shape of the power spectrum we find that beta=0.47+/-0.16 (conditional error) and Delta_0.1=0.47+/-0.03. The shape of the real-space power spectrum is consistent with a Gamma=0.2 CDM-like model, but does not strongly rule out a number of other models. Finally by combining our estimate of the amplitude of galaxy clustering and the distortion parameter we find the amplitude of mass fluctuations on a scale k=0.1h Mpc^-1 is Delta_rho=0.24Omega_0^-0.6, with an uncertainty of 50 per cent.

  10. Tools for direct observation and assessment of clinical skills of medical trainees: a systematic review.

    PubMed

    Kogan, Jennifer R; Holmboe, Eric S; Hauer, Karen E

    2009-09-23

    Direct observation of medical trainees with actual patients is important for performance-based clinical skills assessment. Multiple tools for direct observation are available, but their characteristics and outcomes have not been compared systematically. To identify observation tools used to assess medical trainees' clinical skills with actual patients and to summarize the evidence of their validity and outcomes. Electronic literature search of PubMed, ERIC, CINAHL, and Web of Science for English-language articles published between 1965 and March 2009 and review of references from article bibliographies. Included studies described a tool designed for direct observation of medical trainees' clinical skills with actual patients by educational supervisors. Tools used only in simulated settings or assessing surgical/procedural skills were excluded. Of 10 672 citations, 199 articles were reviewed and 85 met inclusion criteria. Two authors independently abstracted studies using a modified Best Evidence Medical Education coding form to inform judgment of key psychometric characteristics. Differences were reconciled by consensus. A total of 55 tools were identified. Twenty-one tools were studied with students and 32 with residents or fellows. Two were used across the educational continuum. Most (n = 32) were developed for formative assessment. Rater training was described for 26 tools. Only 11 tools had validity evidence based on internal structure and relationship to other variables. Trainee or observer attitudes about the tool were the most commonly measured outcomes. Self-assessed changes in trainee knowledge, skills, or attitudes (n = 9) or objectively measured change in knowledge or skills (n = 5) were infrequently reported. The strongest validity evidence has been established for the Mini Clinical Evaluation Exercise (Mini-CEX). Although many tools are available for the direct observation of clinical skills, validity evidence and description of educational outcomes

  11. A Review of Direct Observation Research within the Past Decade in the Field of Emotional and Behavioral Disorders

    ERIC Educational Resources Information Center

    Adamson, Reesha M.; Wachsmuth, Sean T.

    2014-01-01

    This study reviewed prominent journals within the field of emotional and behavioral disorders to identify direct observation approaches, reported reliability statistics, and key features of direct observation. Selected journals were systematically reviewed for the past 10 years identifying and quantifying specific direct observation systems and…

  12. THE STRUCTURE OF A SELF-GRAVITATING PROTOPLANETARY DISK AND ITS IMPLICATIONS FOR DIRECT IMAGING OBSERVATIONS

    SciTech Connect

    Muto, Takayuki

    2011-09-20

    We consider the effects of self-gravity on the hydrostatic balance in the vertical direction of a gaseous disk and discuss the possible signature of the self-gravity that may be captured by direct imaging observations of protoplanetary disks in the future. In this paper, we consider a vertically isothermal disk in order to isolate the effects of self-gravity. The specific disk model we consider in this paper is the one with a radial surface density gap, at which the Toomre's Q-parameter of the disk varies rapidly in the radial direction. We calculate the vertical structure of the disk including the effects of self-gravity. We then calculate the scattered light and the dust thermal emission. We find that if the disk is massive enough and the effects of self-gravity come into play, a weak bump-like structure at the gap edge appears in the near-infrared (NIR) scattered light, while no such bump-like structure is seen in the submillimeter (sub-mm) dust continuum image. The appearance of the bump is caused by the variation of the height of the surface in the NIR wavelength. If such a bump-like feature is detected in future direct imaging observations, combined with sub-mm observations, it will give us useful information about the physical states of the disk.

  13. Classification of epitaxy in reciprocal and real space: rigid versus flexible lattices.

    PubMed

    Forker, Roman; Meissner, Matthias; Fritz, Torsten

    2017-03-01

    Early investigations of epitaxy focused on inorganic adsorbates consisting of atoms or few-atom molecules, where commensurate registries are predominantly encountered. Expanding such studies to larger (organic) molecules has revealed hitherto unknown types of epitaxy with coherence between adlayer and substrate lattices in just one direction. Here we review recent contributions to the fundamental understanding and modeling of epitaxy. By sorting the ideas brought forward in the literature and amending some basic algebraic considerations a universal scheme for the classification of lattice epitaxy is presented. Ultimately, the occurrence of the different types of epitaxy is made plausible by easy-to-grasp energetic arguments.

  14. Mid-Cretaceous charred fossil flowers reveal direct observation of arthropod feeding strategies

    PubMed Central

    Hartkopf-Fröder, Christoph; Rust, Jes; Wappler, Torsten; Friis, Else Marie; Viehofen, Agnes

    2012-01-01

    Although plant–arthropod relationships underpin the dramatic rise in diversity and ecological dominance of flowering plants and their associated arthropods, direct observations of such interactions in the fossil record are rare, as these ephemeral moments are difficult to preserve. Three-dimensionally preserved charred remains of Chloranthistemon flowers from the Late Albian to Early Cenomanian of Germany preserve scales of mosquitoes and an oribatid mite with mouthparts inserted into the pollen sac. Mosquitoes, which today are frequent nectar feeders, and the mite were feeding on pollen at the time wildfire consumed the flowers. These findings document directly arthropod feeding strategies and their role in decomposition. PMID:21900310

  15. Decay Rate of Correlated Real-Space Delocalization Measures: Insights into Chemical Bonding and Mott Transitions from Hydrogen Chains.

    PubMed

    Gallo-Bueno, A; Kohout, M; Martı́n Pendás, A

    2016-07-12

    We study in this contribution the spatial decay rate of real-space localization and delocalization indices in correlated systems. To that end, we examine Hubbard and quantum chemical models of simple cyclic hydrogen chains, showing that all descriptors of delocalization converge quickly toward the infinite chain limits. It is then shown that the localization index may be understood as a generalization of the standard order parameter in Mott insulator transitions and that the origin of the enigmatic sigmoidal profile of delocalization indices in chemical bond-breaking processes lies in the nonlinear mapping between intersite distances and correlation parameters. Although the long-range asymptotic decay of delocalization indices is exponential, we show that as the correlation parameter decreases quantum mechanical interference sets in and a switch to an oscillating pattern, related to core chemical concepts such as resonance or mesomerism, appears.

  16. Real-space phase field investigation of evolving magnetic domains and twin structures in a ferromagnetic shape memory alloy

    NASA Astrophysics Data System (ADS)

    Wu, H. H.; Pramanick, A.; Ke, Y. B.; Wang, X.-L.

    2016-11-01

    A real-space phase field model combining Landau-Lifshitz-Gilbert equation and time-dependent Ginzburg-Landau equation is developed to investigate the evolution of ferromagnetic domains and martensitic twin structures in a ferromagnetic shape memory alloy at different lengthscales. Both domain and twin structures are obtained by simultaneously solving for minimization of magnetic, elastic, and magnetoelastic coupling energy terms via a nonlinear finite element method. The model is applied to simulate magneto-structural evolution within a nanoparticle and a bulk single-crystal of the alloy Ni2MnGa, which are subjected to mechanical strains. It is shown that a nanoparticle contains magnetic vortex structures within a single twin variant, whereas for a bulk crystal both 90° and 180° domain structures are present within multiple twin variants.

  17. Efimov effect of triple-stranded DNA: real-space renormalization group and zeros of the partition function.

    PubMed

    Maji, Jaya; Bhattacharjee, Somendra M

    2012-10-01

    We study the melting of three-stranded DNA by using the real-space renormalization group and exact recursion relations. The prediction of an unusual Efimov-analog three-chain bound state, that appears at the critical melting of two-chain DNA, is corroborated by the zeros of the partition function. The distribution of the zeros has been studied in detail for various situations. We show that the Efimov DNA can occur even if the three-chain (i.e., three-monomer) interaction is repulsive in nature. In higher dimensions, a striking result that emerged in this repulsive zone is a continuous transition from the critical state to the Efimov DNA.

  18. Raman spectra calculations for Si-Ge core-shell nanocrystals using ab initio real-space methods

    NASA Astrophysics Data System (ADS)

    Bobbitt, N. Scott; Chelikowsky, James R.

    We use a real-space pseudopotential method within density functional theory to calculate Raman spectra for Si-Ge core-shell nanocrystals. We examine the lattice strain induced by the interface of the core and the shell. We calculate how this strain affects the vibrational modes and Raman spectra. We also find that the relative size of the Si and Ge peaks in the Raman spectrum is proportional to the size of the Si core and Ge shell regions, which suggests that Raman spectroscopy can be used to experimentally determine the relative size of the core and the outer shell in these nanocrystals. This work is supported by the DOE under Grant Number DE-FG02-06ER46286. Computations were performed on machines at TACC and NERSC.

  19. Real-Space and Reciprocal-Space Berry Phases in the Hall Effect of Mn1-xFexSi

    NASA Astrophysics Data System (ADS)

    Franz, C.; Freimuth, F.; Bauer, A.; Ritz, R.; Schnarr, C.; Duvinage, C.; Adams, T.; Blügel, S.; Rosch, A.; Mokrousov, Y.; Pfleiderer, C.

    2014-05-01

    We report an experimental and computational study of the Hall effect in Mn1-xFexSi, as complemented by measurements in Mn1-xCoxSi, when helimagnetic order is suppressed under substitutional doping. For small x the anomalous Hall effect (AHE) and the topological Hall effect (THE) change sign. Under larger doping the AHE remains small and consistent with the magnetization, while the THE grows by over a factor of 10. Both the sign and the magnitude of the AHE and the THE are in excellent agreement with calculations based on density functional theory. Our study provides the long-sought material-specific microscopic justification that, while the AHE is due to the reciprocal-space Berry curvature, the THE originates in real-space Berry phases.

  20. The complexity of seismic wave propagation direction observed from air-gun source and dense array

    NASA Astrophysics Data System (ADS)

    Zhai, Q.; Yao, H.; Wang, B.; Wang, W.; Bai, Z.

    2016-12-01

    In recent years, many experiments using large-volume air gun array sources have been carried out in China to image subsurface structure and monitor its temporal variations. There are some advantages of this large-volume air gun array source, such as good repeatability, strong energy, green and safe. These air-gun sources can excite effective seismic signals, and the P-wave signals, especially the travel-time information, have been well used in some recent studies. We have observed strong high-frequency (~1Hz) surface waves from the recorded signals. We use the array method and three-component single station method to detect the seismic wave propagation direction and its temporal changes, which can be used to study the subsurface structure and its temporal variations. The beamforming method can be used to detect the direction and velocity information of seismic wave propagation simultaneously. We use this method to analyze the data from a dense array (543 stations within about a 1.0km x 0.5km region) across a fault zone in Binchuan county, Yunnan province, China. We observe ~90odifference between the great circle path direction and the real propagation direction at the dense array, which is about 15-km south-east of the air-gun source excited in a water reservoir. There is a 90o phase difference between the radial and vertical components of the Rayleigh wave. Based on this property, we can search for the optimal direction of Rayleigh wave propagation for a single station. For example, we observe that there is ~11odifference between the great circle direction and the real Rayleigh wave propagation direction at one station. We will perform more accurate detections of the seismic wave propagation direction and its temporal variations using the air-gun source data. The complexity of seismic wave propagation direction is probably related to strong lateral heterogeneity and anisotropy of the shallow subsurface structure, e.g., due to fault zones.

  1. Full reduction of large finite random Ising systems by real space renormalization group.

    PubMed

    Efrat, Avishay; Schwartz, Moshe

    2003-08-01

    We describe how to evaluate approximately various physical interesting quantities in random Ising systems by direct renormalization of a finite system. The renormalization procedure is used to reduce the number of degrees of freedom to a number that is small enough, enabling direct summing over the surviving spins. This procedure can be used to obtain averages of functions of the surviving spins. We show how to evaluate averages that involve spins that do not survive the renormalization procedure. We show, for the random field Ising model, how to obtain Gamma(r)=-, the "connected" correlation function, and S(r)=, the "disconnected" correlation function. Consequently, we show how to obtain the average susceptibility and the average energy. For an Ising system with random bonds and random fields, we show how to obtain the average specific heat. We conclude by presenting our numerical results for the average susceptibility and the function Gamma(r) along one of the principal axes. (In this work, the full three-dimensional (3D) correlation is calculated and not just parameters such nu or eta). The results for the average susceptibility are used to extract the critical temperature and critical exponents of the 3D random field Ising system.

  2. Magnetic phase diagram of a five-orbital Hubbard model in the real-space Hartree-Fock approximation varying the electronic density

    NASA Astrophysics Data System (ADS)

    Luo, Qinlong; Dagotto, Elbio

    2014-01-01

    Using the real-space Hartree-Fock approximation, the magnetic phase diagram of a five-orbital Hubbard model for the iron-based superconductors is studied varying the electronic density n in the range from five to seven electrons per transition metal atom. The Hubbard interaction U is also varied, at a fixed Hund coupling J /U=0.25. Several qualitative trends and a variety of competing magnetic states are observed. At n =5, a robust G-type antiferromagnetic insulator is found, in agreement with experimental results for BaMn2As2. As n increases away from 5, magnetic states with an increasing number of nearest-neighbors ferromagnetic links become energetically stable. This includes the well-known C-type antiferromagnetic state at n =6, the E-phase known to exist in FeTe, and also a variety of novel states not found yet experimentally, some of them involving blocks of ferromagnetically oriented spins. Regions of phase separation, as in Mn oxides, have also been detected. Comparison to previous theoretical investigations indicate that these qualitative trends may be generic characteristics of phase diagrams of multi-orbital Hubbard models.

  3. Light intensity simulation in real space by viewing locations for autostereoscopic display design

    NASA Astrophysics Data System (ADS)

    Jo, Jungguen; Lee, Kwang-Hoon; Lee, Dong-Su; Park, Min-Chul; Son, Jung-Young; Ju, Byeong-Kwon

    2013-05-01

    Autostereoscopy is a common method for providing 3D perception to viewers without glasses. They produce 3D images with a wide perspective, and can achieve the effect of observing different images visible on the same plane from difference point of view. In autostereoscopic displays, crosstalk occurs when incomplete isolation of the left and right images so that one leakage into the other. This paper addresses a light intensity simulator that can calculate crosstalk according to variable viewing positions by automatically tracking heads of viewers. In doing so, we utilize head tracking technique based on infrared laser sensors to detect the observers' viewing positions. Preliminary results show that the proposed system was appropriate to be operated in designing the autostereoscopic displays ensuring human safety.

  4. Real-space imaging of nanotip plasmons using electron energy loss spectroscopy

    NASA Astrophysics Data System (ADS)

    Schröder, Benjamin; Weber, Thorsten; Yalunin, Sergey V.; Kiel, Thomas; Matyssek, Christian; Sivis, Murat; Schäfer, Sascha; von Cube, Felix; Irsen, Stephan; Busch, Kurt; Ropers, Claus; Linden, Stefan

    2015-08-01

    We report the spatial mapping of surface plasmons on conical gold nanotips by electron energy loss spectroscopy. We observe standing-wave patterns resulting from reflections of the fundamental surface-plasmon mode at the nanotip apex. The experimental results are in very good agreement with numerical calculations using the discontinuous Galerkin time-domain method and analytical computations based on a cylindrical mode expansion.

  5. Real-space measurement of potential distribution in PECVD ONO electrets by Kelvin probe force microscopy.

    PubMed

    Emmerich, F; Thielemann, C

    2016-05-20

    Multilayers of silicon oxide/silicon nitride/silicon oxide (ONO) are known for their good electret properties due to deep energy traps near the material interfaces, facilitating charge storage. However, measurement of the space charge distribution in such multilayers is a challenge for conventional methods if layer thickness dimensions shrink below 1 μm. In this paper, we propose an atomic force microscope based method to determine charge distributions in ONO layers with spatial resolution below 100 nm. By applying Kelvin probe force microscopy (KPFM) on freshly cleaved, corona-charged multilayers, the surface potential is measured directly along the z-axis and across the interfaces. This new method gives insights into charge distribution and charge movement in inorganic electrets with a high spatial resolution.

  6. Gravity Waves Generated by Convection: A New Idealized Model Tool and Direct Validation with Satellite Observations

    NASA Astrophysics Data System (ADS)

    Alexander, M. Joan; Stephan, Claudia

    2015-04-01

    In climate models, gravity waves remain too poorly resolved to be directly modelled. Instead, simplified parameterizations are used to include gravity wave effects on model winds. A few climate models link some of the parameterized waves to convective sources, providing a mechanism for feedback between changes in convection and gravity wave-driven changes in circulation in the tropics and above high-latitude storms. These convective wave parameterizations are based on limited case studies with cloud-resolving models, but they are poorly constrained by observational validation, and tuning parameters have large uncertainties. Our new work distills results from complex, full-physics cloud-resolving model studies to essential variables for gravity wave generation. We use the Weather Research Forecast (WRF) model to study relationships between precipitation, latent heating/cooling and other cloud properties to the spectrum of gravity wave momentum flux above midlatitude storm systems. Results show the gravity wave spectrum is surprisingly insensitive to the representation of microphysics in WRF. This is good news for use of these models for gravity wave parameterization development since microphysical properties are a key uncertainty. We further use the full-physics cloud-resolving model as a tool to directly link observed precipitation variability to gravity wave generation. We show that waves in an idealized model forced with radar-observed precipitation can quantitatively reproduce instantaneous satellite-observed features of the gravity wave field above storms, which is a powerful validation of our understanding of waves generated by convection. The idealized model directly links observations of surface precipitation to observed waves in the stratosphere, and the simplicity of the model permits deep/large-area domains for studies of wave-mean flow interactions. This unique validated model tool permits quantitative studies of gravity wave driving of regional

  7. Validation of simulated flow direction and hydraulic gradients with hydraulic head observations using open source GIS

    NASA Astrophysics Data System (ADS)

    Vandersteen, Katrijn; Rogiers, Bart; Gedeon, Matej

    2015-04-01

    It is recommended to check hydraulic gradients and flow directions predicted by a groundwater flow model that is calibrated solely with hydraulic head observations. It has been demonstrated in literature that substantial errors can be made when the model is not calibrated on these state variables. Therefore, in this work, we perform a validation of a steady-state groundwater flow model, representing part of the Neogene aquifer (60 km2) in Belgium. This model was developed and calibrated solely on groundwater head measurements, in the framework of the environmental impact assessment of the near surface repository for low- and intermediate-level short-lived waste, realized by ONDRAF/NIRAS at Dessel, Belgium. Horizontal flow directions, horizontal and vertical gradients for the entire area of the groundwater model were estimated from measurements at shallow monitoring wells within the groundwater flow model domain, and compared to the flow directions and vertical gradients predicted by the model. For obtaining horizontal flow directions and gradients, triangulation of groundwater levels was performed for combinations of three neighboring hydraulic head observations in the same hydrogeological layer within the model. The simulated equivalents at the same monitoring wells were used to repeat the same methodology, and calculate flow direction components. This analysis was performed in SAGA GIS and was visualized through QGIS. Comparison of the flow directions and flow gradients obtained from measurements and simulations gives an indication on the model performance. The calculations were performed for three sandy hydrogeological units used in the model. A similar procedure was performed for the vertical hydraulic head gradients, where any combination of two hydraulic head observations at the same location but at different levels within the aquifer were used to validate the vertical gradients predicted by the model. Besides model validation on average hydraulic heads, the

  8. Direct observation of quantum phonon fluctuations in a one-dimensional Bose gas.

    PubMed

    Armijo, Julien

    2012-06-01

    We report the first direct observation of collective quantum fluctuations in a continuous field. Shot-to-shot atom number fluctuations in small subvolumes of a weakly interacting, ultracold atomic 1D cloud are studied using in situ absorption imaging and statistical analysis of the density profiles. In the cloud centers, well in the quantum quasicondensate regime, the ratio of chemical potential to thermal energy is μ/k(B)T≃4, and, owing to high resolution, up to 20% of the microscopically observed fluctuations are quantum phonons. Within a nonlocal analysis at variable observation length, we observe a clear deviation from a classical field prediction, which reveals the emergence of dominant quantum fluctuations at short length scales, as the thermodynamic limit breaks down.

  9. Direct Observation of Nanosecond Water Exchange Dynamics at a Protein Metal Site

    PubMed Central

    Stachura, Monika; Chakraborty, Saumen; Gottberg, Alexander; Ruckthong, Leela; Pecoraro, Vincent L.; Hemmingsen, Lars

    2017-01-01

    Nanosecond ligand exchange dynamics at metal sites within proteins is essential in catalysis, metal ion transport, and regulatory metallobiochemistry. Herein we present direct observation of the exchange dynamics of water at a Cd2+ binding site within two de novo designed metalloprotein constructs using 111mCd perturbed angular correlation (PAC) of γ-rays and 113Cd NMR spectroscopy. The residence time of the Cd2+-bound water molecule is tens of nanoseconds at 20 °C in both proteins. This constitutes the first direct experimental observation of the residence time of Cd2+ coordinated water in any system, including the simple aqua ion. A Leu to Ala amino acid substitution ~10 Å from the Cd2+ site affects both the equilibrium constant and the residence time of water, while, surprisingly, the metal site structure, as probed by PAC spectroscopy, remains essentially unaltered. This implies that remote mutations may affect metal site dynamics, even when structure is conserved. PMID:27973778

  10. Direct observation of electric field induced pattern formation and particle aggregation in ferrofluids

    NASA Astrophysics Data System (ADS)

    Rajnak, Michal; Petrenko, Viktor I.; Avdeev, Mikhail V.; Ivankov, Olexandr I.; Feoktystov, Artem; Dolnik, Bystrik; Kurimsky, Juraj; Kopcansky, Peter; Timko, Milan

    2015-08-01

    Ferrofluids typically respond to magnetic fields and can be manipulated by external magnetic fields. Here, we report on formation of visually observable patterns in a diluted low-polarity ferrofluid exposed to external electric fields. This presents a specific type of ferrofluid structure driven by a combined effect of electrohydrodynamics and electrical body forces. The free charge and permittivity variation are considered to play a key role in the observed phenomenon. The corresponding changes in the ferrofluid structure have been found at nanoscale as well. By small-angle neutron scattering (SANS), we show that the magnetic nanoparticles aggregate in direct current (dc) electric field with a strong dependence on the field intensity. The anisotropic aggregates preferably orient in the direction of the applied electric field. Conducting SANS experiments with alternating current (ac) electric fields of various frequencies, we found a critical frequency triggering the aggregation process. Our experimental study could open future applications of ferrofluids based on insulating liquids.

  11. Direct Observation of Spatiotemporal Dynamics of Short Electron Bunches in Storage Rings.

    PubMed

    Evain, C; Roussel, E; Le Parquier, M; Szwaj, C; Tordeux, M-A; Brubach, J-B; Manceron, L; Roy, P; Bielawski, S

    2017-02-03

    In recent synchrotron radiation facilities, the use of short (picosecond) electron bunches is a powerful method for producing giant pulses of terahertz coherent synchrotron radiation. Here we report on the first direct observation of these pulse shapes with a few picoseconds resolution, and of their dynamics over a long time. We thus confirm in a very direct way the theories predicting an interplay between two physical processes. Below a critical bunch charge, we observe a train of identical THz pulses (a broadband Terahertz comb) stemming from the shortness of the electron bunches. Above this threshold, a large part of the emission is dominated by drifting structures, which appear through spontaneous self-organization. These challenging single-shot THz recordings are made possible by using a recently developed photonic time stretch detector with a high sensitivity. The experiment has been realized at the SOLEIL storage ring.

  12. Bi-directional reflectance and other radiation parameters of cirrus from ER-2 observations

    NASA Technical Reports Server (NTRS)

    Spinhime, James

    1993-01-01

    Passive and active remote sensing of cirrus were acquired from the ER-2 high altitude aircraft in the 1991 Cirrus Experiment. The observations include direct measurements of cirrus bi-directional reflectance from a new translinear scanning radiometer and the previously employed measurements by lidar and visible-infrared imaging radiometers. For any cirrus radiative transfer application, it is necessary to know the appropriate model for visible reflectance in relation to angle and also the optical thickness and infrared emissivity of the clouds. At a more complicated level, for remote sensing and overall cloud effects it is ultimately required to understand effects from multiple cloud layers, broken clouds, and variable microphysics. Our overall data set from the scanning radiometers and lidar is intended to provide the necessary observations to investigate these problems.

  13. Direct observation of the crystallographic relationship between interlamellar membranes and aragonite tablets in bivalve nacre.

    PubMed

    Xu, Jun; Zhang, Gangsheng

    2016-12-23

    Nacre is one of the most attractive models for understanding the fundamental principles of biomineralization and for designing bio-inspired materials due to its simple structure but with unusual mechanical properties. It is made up of lamellae of aragonite tablets bonded together by the organic interlamellar membranes (ILMs), of which the latter occupy less than 5wt% of nacre. For a long time, previous authors failed to directly observe the crystallographic relationship between the ILM and aragonite tablet in bivalve shells. Here, using high resolution transmission electron microscope (HRTEM), we investigate the interfacial structure of the domed tablets that coexist with the flat ones in green mussels. We directly observed that the ILMs are oriented with the underlying tablets and connected with the latter via a superlattice region. The finding advances our current knowledge of nacre biomineralization and may help to design novel nacre-like materials.

  14. Microbunching instability in relativistic electron bunches: direct observations of the microstructures using ultrafast YBCO detectors.

    PubMed

    Roussel, E; Evain, C; Szwaj, C; Bielawski, S; Raasch, J; Thoma, P; Scheuring, A; Hofherr, M; Ilin, K; Wünsch, S; Siegel, M; Hosaka, M; Yamamoto, N; Takashima, Y; Zen, H; Konomi, T; Adachi, M; Kimura, S; Katoh, M

    2014-08-29

    Relativistic electron bunches circulating in accelerators are subjected to a dynamical instability leading to microstructures at millimeter to centimeter scale. Although this is a well-known fact, direct experimental observations of the structures, or the field that they emit, remained up to now an open problem. Here, we report the direct, shot-by-shot, time-resolved recording of the shapes (including envelope and carrier) of the pulses of coherent synchrotron radiation that are emitted, and that are a "signature" of the electron bunch microstructure. The experiments are performed on the UVSOR-III storage ring, using electrical field sensitive YBa2Cu3O(7-x) thin-film ultrafast detectors. The observed patterns are subjected to permanent drifts, that can be explained from a reasoning in phase space, using macroparticle simulations.

  15. Direct observation of electric field induced pattern formation and particle aggregation in ferrofluids

    SciTech Connect

    Rajnak, Michal; Kopcansky, Peter; Timko, Milan; Petrenko, Viktor I.; Avdeev, Mikhail V.; Ivankov, Olexandr I.; Feoktystov, Artem; Dolnik, Bystrik; Kurimsky, Juraj

    2015-08-17

    Ferrofluids typically respond to magnetic fields and can be manipulated by external magnetic fields. Here, we report on formation of visually observable patterns in a diluted low-polarity ferrofluid exposed to external electric fields. This presents a specific type of ferrofluid structure driven by a combined effect of electrohydrodynamics and electrical body forces. The free charge and permittivity variation are considered to play a key role in the observed phenomenon. The corresponding changes in the ferrofluid structure have been found at nanoscale as well. By small-angle neutron scattering (SANS), we show that the magnetic nanoparticles aggregate in direct current (dc) electric field with a strong dependence on the field intensity. The anisotropic aggregates preferably orient in the direction of the applied electric field. Conducting SANS experiments with alternating current (ac) electric fields of various frequencies, we found a critical frequency triggering the aggregation process. Our experimental study could open future applications of ferrofluids based on insulating liquids.

  16. Direct spectroscopic observation of a shallow hydrogenlike donor state in insulating SrTiO3.

    PubMed

    Salman, Z; Prokscha, T; Amato, A; Morenzoni, E; Scheuermann, R; Sedlak, K; Suter, A

    2014-10-10

    We present a direct spectroscopic observation of a shallow hydrogenlike muonium state in SrTiO(3) which confirms the theoretical prediction that interstitial hydrogen may act as a shallow donor in this material. The formation of this muonium state is temperature dependent and appears below ∼ 70K. From the temperature dependence we estimate an activation energy of ∼ 50 meV in the bulk and ∼ 23 meV near the free surface. The field and directional dependence of the muonium precession frequencies further supports the shallow impurity state with a rare example of a fully anisotropic hyperfine tensor. From these measurements we determine the strength of the hyperfine interaction and propose that the muon occupies an interstitial site near the face of the oxygen octahedron in SrTiO(3). The observed shallow donor state provides new insight for tailoring the electronic and optical properties of SrTiO(3)-based oxide interface systems.

  17. Directly Observed Highly Active Antiretroviral Therapy for HIV-Infected Children in Cambodia

    PubMed Central

    Myung, Patricia; Pugatch, David; Brady, Mark F.; Many, Phok; Harwell, Joseph I.; Lurie, Mark; Tucker, John

    2007-01-01

    Antiretroviral medications are becoming available for HIV-infected children in resource-limited settings. Maryknoll, an international Catholic charity, provided directly observed antiretroviral therapy to HIV-infected children in Phnom Penh, Cambodia. Child care workers administered generic antiretroviral drugs twice daily to children, ensuring adherence. Treatment began with 117 late-stage HIV-infected children; 22 died of AIDS during the first 6 months. The rest were treated for at least 6 months and showed CD4 count increases comparable to those achieved in US and European children. Staffing cost for this program was approximately US $5 per child per month, or 15% more than the price of the medications. Drug toxicities were uncommon and easily managed. Directly observed antiretroviral therapy appears to be a promising, low-cost strategy for ensuring adherent treatment for HIV-infected children in a resource-limited setting. PMID:17463375

  18. Direct Observation of Spatiotemporal Dynamics of Short Electron Bunches in Storage Rings

    NASA Astrophysics Data System (ADS)

    Evain, C.; Roussel, E.; Le Parquier, M.; Szwaj, C.; Tordeux, M.-A.; Brubach, J.-B.; Manceron, L.; Roy, P.; Bielawski, S.

    2017-02-01

    In recent synchrotron radiation facilities, the use of short (picosecond) electron bunches is a powerful method for producing giant pulses of terahertz coherent synchrotron radiation. Here we report on the first direct observation of these pulse shapes with a few picoseconds resolution, and of their dynamics over a long time. We thus confirm in a very direct way the theories predicting an interplay between two physical processes. Below a critical bunch charge, we observe a train of identical THz pulses (a broadband Terahertz comb) stemming from the shortness of the electron bunches. Above this threshold, a large part of the emission is dominated by drifting structures, which appear through spontaneous self-organization. These challenging single-shot THz recordings are made possible by using a recently developed photonic time stretch detector with a high sensitivity. The experiment has been realized at the SOLEIL storage ring.

  19. Direct optical observation of magnetic domains in Ni-Mn-Ga martensite

    NASA Astrophysics Data System (ADS)

    Ge, Y.; Heczko, O.; Söderberg, O.; Hannula, S.-P.

    2006-08-01

    This letter reports the direct optical observation, i.e., without polarization, of the magnetic domain structure explained by a large surface relief in Ni-Mn-Ga martensite. The authors suggest that the relief is due to the different straining of the surface and the bulk caused by the internal stresses associated with the magnetic shape memory effect. As a result of the relief the projection of the (011) twin traces upon the (010) plane creates the observed zigzag pattern. The surface tilt angle calculated from the zigzag pattern is ˜3°.

  20. Earth Science System of the Future: Observing, Processing, and Delivering Data Products Directly to Users

    NASA Technical Reports Server (NTRS)

    Crisp, David; Komar, George (Technical Monitor)

    2001-01-01

    Advancement of our predictive capabilities will require new scientific knowledge, improvement of our modeling capabilities, and new observation strategies to generate the complex data sets needed by coupled modeling networks. New observation strategies must support remote sensing from a variety of vantage points and will include "sensorwebs" of small satellites in low Earth orbit, large aperture sensors in Geostationary orbits, and sentinel satellites at L1 and L2 to provide day/night views of the entire globe. Onboard data processing and high speed computing and communications will enable near real-time tailoring and delivery of information products (i.e., predictions) directly to users.

  1. A woman's lived experience with directly observed therapy for tuberculosis-a case study.

    PubMed

    Zuñiga, Julie Ann

    2012-01-01

    This is a case study to investigate the lived experience of tuberculosis (TB) treatment for a Hispanic female. The theme was accumulating aggravation. Her daily life was interrupted with appointments and negative side effects. She had to wear a mask that made her feel isolated. She felt ignored by her doctors. Although she experienced the opposite feeling of being overly observed, the informant began to feel like she was always being watched. The participant described herself as paranoid due to the threat of imprisonment for nonadherence. The accumulating aggravation made the directly observed therapy short-course (DOTS) experience a difficulty and stressful experience.

  2. Direct observation of depth-dependent atomic displacements associated with dislocations in gallium nitride.

    PubMed

    Lozano, J G; Yang, H; Guerrero-Lebrero, M P; D'Alfonso, A J; Yasuhara, A; Okunishi, E; Zhang, S; Humphreys, C J; Allen, L J; Galindo, P L; Hirsch, P B; Nellist, P D

    2014-09-26

    We demonstrate that the aberration-corrected scanning transmission electron microscope has a sufficiently small depth of field to observe depth-dependent atomic displacements in a crystal. The depth-dependent displacements associated with the Eshelby twist of dislocations in GaN normal to the foil with a screw component of the Burgers vector are directly imaged. We show that these displacements are observed as a rotation of the lattice between images taken in a focal series. From the sense of the rotation, the sign of the screw component can be determined.

  3. Compliance with hygiene guidelines: the effect of a multimodal hygiene intervention and validation of direct observations.

    PubMed

    Mernelius, Sara; Svensson, Per-Olof; Rensfeldt, Gunhild; Davidsson, Ewa; Isaksson, Barbro; Löfgren, Sture; Matussek, Andreas

    2013-05-01

    Good compliance with hygiene guidelines is essential to prevent bacterial transmission and health care-associated infections. However, the compliance is usually <50%. A multimodal and multidisciplinary hygiene intervention was launched once the baseline compliance was determined through direct observations in 4 departments of obstetrics and gynecology. Detailed evaluations of the compliance rates were performed at point of stability (at 80%) and follow-up (3 years after hygiene intervention). Validation of direct observations was performed using blinded double appraisal and multiappraisal. At baseline, the compliance with barrier precautions and the dress code at the 4 departments were 39% to 47% and 79% to 98%, respectively. Point of stability was reached approximately 1 year after the hygiene intervention was launched. The compliance with barrier precautions was significantly higher at follow-up compared with baseline in 3 departments. In the validation by double appraisal, 471 of 483 components were judged identical between observers. In the multiappraisal, 95% to 100% of the observers correctly judged the 7 components. It is possible to improve compliance with hygiene guidelines, but, to ensure a long-lasting effect, a continuous focus on barrier precautions is required. Observation is a valid method to monitor compliance. Copyright © 2013 Association for Professionals in Infection Control and Epidemiology, Inc. Published by Mosby, Inc. All rights reserved.

  4. Determination of acceleration mechanism characteristics directly and nonparametrically from observations: Application to supernova remnants

    NASA Astrophysics Data System (ADS)

    Petrosian, Vahé; Chen, Qingrong

    2014-05-01

    We have developed an inversion method for determination of the characteristics of the acceleration mechanism directly and nonparametrically from observations, in contrast to the usual forward fitting of parametric model variables to observations. In two recent papers [V. Petrosian and Q. Chen, Astrophys. J. 712, L131 (2010); Q. Chen and V. Petrosian, Astrophys. J. 777, 33 (2013)], we demonstrated the efficacy of this inversion method by its application to acceleration of electrons in solar flares based on stochastic acceleration by turbulence. Here we explore its application for determining the characteristics of shock acceleration in supernova remnants (SNRs) based on the electron spectra deduced from the observed nonthermal radiation from SNRs and the spectrum of the cosmic ray electrons observed near the Earth. These spectra are related by the process of escape of the electrons from SNRs and energy loss during their transport in the Galaxy. Thus, these observations allow us to determine spectral characteristics of the momentum and pitch angle diffusion coefficients, which play crucial roles in both direct acceleration by turbulence and in high Mach number shocks. Assuming that the average electron spectrum deduced from a few well-known SNRs is representative of those in the solar neighborhood, we find interesting discrepancies between our deduced forms for these coefficients and those expected from well-known wave-particle interactions. This may indicate that the standard assumptions made in the treatment of shock acceleration need revision. In particular, the escape of particles from SNRs may be more complex than generally assumed.

  5. Assessing the potential for bias in direct observation of adult commuter cycling and helmet use.

    PubMed

    Kraemer, John D; Zaccaro, Heather N; Roffenbender, Jason S; Baig, Sabeeh A; Graves, Megan E; Hauler, Katherine J; Hussain, Aamir N; Mulroy, Faith E

    2015-02-01

    Bicycling and helmet surveillance, research, and programme evaluation depend on accurate measurement by direct observation, but it is unclear whether weather and other exogenous factors introduce bias into observed counts of cyclists and helmet use. To address this issue, a time series was created of cyclists observed at two observation points in Washington, DC, at peak commuting times and locations between September 2012 and February 2013. Using multiple linear regression with Newey-West SEs to account for possible serial correlation, the association between various factors and cyclist counts and helmet use was investigated. The number of cyclists observed per 1 h session was significantly associated with predicted daily high temperature, chance of rain, and actual rain. Additionally, fewer cyclists were observed on Fridays. Helmet use was significantly lower during evening commutes than morning and also lower on Fridays. Helmet use was not associated with weather variables. Controlling for observable cyclists characteristics weakened the association between helmet use and the time of day and day of the week, but it did not eliminate that association. Direct observation to measure commuter cycling trends or evaluate interventions should control for weather and day of week. Measurement of helmet use is unlikely to be meaningfully biased by weather factors, but time of day and day of week should be taken into account. Failing to control for these factors could lead to significant bias in assessments of the level of, and trends in, commuter cycling and helmet use. Published by the BMJ Publishing Group Limited. For permission to use (where not already granted under a licence) please go to http://group.bmj.com/group/rights-licensing/permissions.

  6. Three-dimensional atomic force microscopy: interaction force vector by direct observation of tip trajectory.

    PubMed

    Sigdel, Krishna P; Grayer, Justin S; King, Gavin M

    2013-11-13

    The prospect of a robust three-dimensional atomic force microscope (AFM) holds significant promise in nanoscience. Yet, in conventional AFM, the tip-sample interaction force vector is not directly accessible. We scatter a focused laser directly off an AFM tip apex to rapidly and precisely measure the tapping tip trajectory in three-dimensional space. This data also yields three-dimensional cantilever spring constants, effective masses, and hence, the tip-sample interaction force components via Newton's second law. Significant lateral forces representing 49 and 13% of the normal force (Fz = 152 ± 17 pN) were observed in common tapping mode conditions as a silicon tip intermittently contacted a glass substrate in aqueous solution; as a consequence, the direction of the force vector tilted considerably more than expected. When addressing the surface of a lipid bilayer, the behavior of the force components differed significantly from that observed on glass. This is attributed to the lateral mobility of the lipid membrane coupled with its elastic properties. Direct access to interaction components Fx, Fy, and Fz provides a more complete view of tip dynamics that underlie force microscope operation and can form the foundation of a three-dimensional AFM in a plurality of conditions.

  7. Controllability and observability analysis for vertex domination centrality in directed networks

    PubMed Central

    Wang, Bingbo; Gao, Lin; Gao, Yong; Deng, Yue; Wang, Yu

    2014-01-01

    Topological centrality is a significant measure for characterising the relative importance of a node in a complex network. For directed networks that model dynamic processes, however, it is of more practical importance to quantify a vertex's ability to dominate (control or observe) the state of other vertices. In this paper, based on the determination of controllable and observable subspaces under the global minimum-cost condition, we introduce a novel direction-specific index, domination centrality, to assess the intervention capabilities of vertices in a directed network. Statistical studies demonstrate that the domination centrality is, to a great extent, encoded by the underlying network's degree distribution and that most network positions through which one can intervene in a system are vertices with high domination centrality rather than network hubs. To analyse the interaction and functional dependence between vertices when they are used to dominate a network, we define the domination similarity and detect significant functional modules in glossary and metabolic networks through clustering analysis. The experimental results provide strong evidence that our indices are effective and practical in accurately depicting the structure of directed networks. PMID:24954137

  8. Controllability and observability analysis for vertex domination centrality in directed networks

    NASA Astrophysics Data System (ADS)

    Wang, Bingbo; Gao, Lin; Gao, Yong; Deng, Yue; Wang, Yu

    2014-06-01

    Topological centrality is a significant measure for characterising the relative importance of a node in a complex network. For directed networks that model dynamic processes, however, it is of more practical importance to quantify a vertex's ability to dominate (control or observe) the state of other vertices. In this paper, based on the determination of controllable and observable subspaces under the global minimum-cost condition, we introduce a novel direction-specific index, domination centrality, to assess the intervention capabilities of vertices in a directed network. Statistical studies demonstrate that the domination centrality is, to a great extent, encoded by the underlying network's degree distribution and that most network positions through which one can intervene in a system are vertices with high domination centrality rather than network hubs. To analyse the interaction and functional dependence between vertices when they are used to dominate a network, we define the domination similarity and detect significant functional modules in glossary and metabolic networks through clustering analysis. The experimental results provide strong evidence that our indices are effective and practical in accurately depicting the structure of directed networks.

  9. Direct observation of porous SiC formed by anodization in HF

    NASA Technical Reports Server (NTRS)

    Shor, Joseph S.; Grimberg, Ilana; Weiss, Ben-Zion; Kurtz, Anthony D.

    1993-01-01

    A process for forming porous SiC from single-crystal SiC wafers has been demonstrated. Porous SiC can be fabricated by anodizing n-type 6H-SiC in HF under UV illumination. TEM reveals pores of sizes 10-30 nm with interpore spacings ranging from roughly 5 to 150 nm. This is the first reported direct observation of porous SiC formation.

  10. Directivity Patterns of Complex Solar Type III Radio Bursts: Stereoscopic Observations

    NASA Astrophysics Data System (ADS)

    Golla, T.; MacDowall, R. J.

    2014-12-01

    Complex solar type III-like radio bursts are a group of type III bursts that occur in association with slowly drifting type II radio bursts excited by coronal mass ejection (CME) driven shock waves. We presentsimultaneous observations of these radio bursts from the STEREO A, B and WIND spacecraft at low frequencies, located at different vantage points in the ecliptic plane. Using these stereoscopic observations, wedetermine the directivity of these complex radio bursts. We estimate the angles between the directions of the magnetic field at the sources and the lines connecting the source to the spacecraft (viewing angles) by assuming that the sources are located on the Parker spiral magnetic field lines emerging from the associated active regions into the spherically symmetric solar atmosphere. We estimate the normalized peak intensities of these bursts (directivity factors) at each spacecraft using their time profiles at each spacecraft. These observations indicate that the complex type III bursts can be divided into two groups: (1) bursts emitting into a very narrow cone centered around the tangent to the magnetic field, and (2) bursts emitting into a wider cone. We show that the bursts , which are emitted along the tangent to the spiral magnetic field lines at the source are very intense, and their intensities steadily fall as the viewing angles increase to higher values. We have developed a ray tracing code and computed the distributions of the trajectories of rays emitted at the fundamental and second harmonic of the electron plasma frequency. The comparison of the observed emission patterns with the computed distributions of the ray trajectories indicate that the intense bursts visible in a narrow range of angles around the magnetic field directions probably are emitted in the fundamental mode, whereas the relativelyweaker bursts visible to a wide range of angles are probably emitted in the harmonic mode.

  11. Direct observation of the orientational Kerr effect in the self-focusing of picosecond pulses.

    NASA Technical Reports Server (NTRS)

    Reintjes, J.; Carman, R. L.

    1972-01-01

    Direct measurements of the relaxation time of the birefringence within the self-focusing region of mode-locked laser pulses in several anisotropic liquids establish the importance of the orientational Kerr effect in the picosecond time regime. This result leads to some speculation as to the origin of the high degree of symmetry in the phase-modulated filament spectra observed with picosecond pulses.

  12. Warming experiments elucidate the drivers of observed directional changes in tundra vegetation

    PubMed Central

    Hollister, Robert D; May, Jeremy L; Kremers, Kelseyann S; Tweedie, Craig E; Oberbauer, Steven F; Liebig, Jennifer A; Botting, Timothy F; Barrett, Robert T; Gregory, Jessica L

    2015-01-01

    Few studies have clearly linked long-term monitoring with in situ experiments to clarify potential drivers of observed change at a given site. This is especially necessary when findings from a site are applied to a much broader geographic area. Here, we document vegetation change at Barrow and Atqasuk, Alaska, occurring naturally and due to experimental warming over nearly two decades. An examination of plant cover, canopy height, and community indices showed more significant differences between years than due to experimental warming. However, changes with warming were more consistent than changes between years and were cumulative in many cases. Most cases of directional change observed in the control plots over time corresponded with a directional change in response to experimental warming. These included increases in canopy height and decreases in lichen cover. Experimental warming resulted in additional increases in evergreen shrub cover and decreases in diversity and bryophyte cover. This study suggests that the directional changes occurring at the sites are primarily due to warming and indicates that further changes are likely in the next two decades if the regional warming trend continues. These findings provide an example of the utility of coupling in situ experiments with long-term monitoring to accurately document vegetation change in response to global change and to identify the underlying mechanisms driving observed changes. PMID:26140204

  13. Full data acquisition in Kelvin Probe Force Microscopy: Mapping dynamic electric phenomena in real space

    NASA Astrophysics Data System (ADS)

    Collins, Liam; Belianinov, Alex; Somnath, Suhas; Balke, Nina; Kalinin, Sergei V.; Jesse, Stephen

    2016-08-01

    Kelvin probe force microscopy (KPFM) has provided deep insights into the local electronic, ionic and electrochemical functionalities in a broad range of materials and devices. In classical KPFM, which utilizes heterodyne detection and closed loop bias feedback, the cantilever response is down-sampled to a single measurement of the contact potential difference (CPD) per pixel. This level of detail, however, is insufficient for materials and devices involving bias and time dependent electrochemical events; or at solid-liquid interfaces, where non-linear or lossy dielectrics are present. Here, we demonstrate direct recovery of the bias dependence of the electrostatic force at high temporal resolution using General acquisition Mode (G-Mode) KPFM. G-Mode KPFM utilizes high speed detection, compression, and storage of the raw cantilever deflection signal in its entirety at high sampling rates. We show how G-Mode KPFM can be used to capture nanoscale CPD and capacitance information with a temporal resolution much faster than the cantilever bandwidth, determined by the modulation frequency of the AC voltage. In this way, G-Mode KPFM offers a new paradigm to study dynamic electric phenomena in electroactive interfaces as well as a promising route to extend KPFM to the solid-liquid interface.

  14. Real-space quadrature: A convenient, efficient representation for multipole expansions

    SciTech Connect

    Rogers, David M.

    2015-02-21

    Multipoles are central to the theory and modeling of polarizable and nonpolarizable molecular electrostatics. This has made a representation in terms of point charges a highly sought after goal, since rotation of multipoles is a bottleneck in molecular dynamics implementations. All known point charge representations are orders of magnitude less efficient than spherical harmonics due to either using too many fixed charge locations or due to nonlinear fitting of fewer charge locations. We present the first complete solution to this problem—completely replacing spherical harmonic basis functions by a dramatically simpler set of weights associated to fixed, discrete points on a sphere. This representation is shown to be space optimal. It reduces the spherical harmonic decomposition of Poisson’s operator to pairwise summations over the point set. As a corollary, we also shows exact quadrature-based formulas for contraction over trace-free supersymmetric 3D tensors. Moreover, multiplication of spherical harmonic basis functions translates to a direct product in this representation.

  15. Full data acquisition in Kelvin Probe Force Microscopy: Mapping dynamic electric phenomena in real space

    PubMed Central

    Collins, Liam; Belianinov, Alex; Somnath, Suhas; Balke, Nina; Kalinin, Sergei V.; Jesse, Stephen

    2016-01-01

    Kelvin probe force microscopy (KPFM) has provided deep insights into the local electronic, ionic and electrochemical functionalities in a broad range of materials and devices. In classical KPFM, which utilizes heterodyne detection and closed loop bias feedback, the cantilever response is down-sampled to a single measurement of the contact potential difference (CPD) per pixel. This level of detail, however, is insufficient for materials and devices involving bias and time dependent electrochemical events; or at solid-liquid interfaces, where non-linear or lossy dielectrics are present. Here, we demonstrate direct recovery of the bias dependence of the electrostatic force at high temporal resolution using General acquisition Mode (G-Mode) KPFM. G-Mode KPFM utilizes high speed detection, compression, and storage of the raw cantilever deflection signal in its entirety at high sampling rates. We show how G-Mode KPFM can be used to capture nanoscale CPD and capacitance information with a temporal resolution much faster than the cantilever bandwidth, determined by the modulation frequency of the AC voltage. In this way, G-Mode KPFM offers a new paradigm to study dynamic electric phenomena in electroactive interfaces as well as a promising route to extend KPFM to the solid-liquid interface. PMID:27514987

  16. Full data acquisition in Kelvin Probe Force Microscopy: Mapping dynamic electric phenomena in real space.

    PubMed

    Collins, Liam; Belianinov, Alex; Somnath, Suhas; Balke, Nina; Kalinin, Sergei V; Jesse, Stephen

    2016-08-12

    Kelvin probe force microscopy (KPFM) has provided deep insights into the local electronic, ionic and electrochemical functionalities in a broad range of materials and devices. In classical KPFM, which utilizes heterodyne detection and closed loop bias feedback, the cantilever response is down-sampled to a single measurement of the contact potential difference (CPD) per pixel. This level of detail, however, is insufficient for materials and devices involving bias and time dependent electrochemical events; or at solid-liquid interfaces, where non-linear or lossy dielectrics are present. Here, we demonstrate direct recovery of the bias dependence of the electrostatic force at high temporal resolution using General acquisition Mode (G-Mode) KPFM. G-Mode KPFM utilizes high speed detection, compression, and storage of the raw cantilever deflection signal in its entirety at high sampling rates. We show how G-Mode KPFM can be used to capture nanoscale CPD and capacitance information with a temporal resolution much faster than the cantilever bandwidth, determined by the modulation frequency of the AC voltage. In this way, G-Mode KPFM offers a new paradigm to study dynamic electric phenomena in electroactive interfaces as well as a promising route to extend KPFM to the solid-liquid interface.

  17. Direction-sensitive codes for observed head turns in human superior temporal sulcus.

    PubMed

    Carlin, Johan D; Rowe, James B; Kriegeskorte, Nikolaus; Thompson, Russell; Calder, Andrew J

    2012-04-01

    Humans and other primates are adept at using the direction of another's gaze or head turn to infer where that individual is attending. Research in macaque neurophysiology suggests that anterior superior temporal sulcus (STS) contains a direction-sensitive code for such social attention cues. By contrast, most human functional Magnetic resonance imaging (fMRI) studies report that posterior STS is responsive to social attention cues. It is unclear whether this functional discrepancy is caused by a species difference or by experimental design differences. Furthermore, social attention cues are dynamic in naturalistic social interaction, but most studies to date have been restricted to static displays. In order to address these issues, we used multivariate pattern analysis of fMRI data to test whether response patterns in human right STS distinguish between leftward and rightward dynamic head turns. Such head turn discrimination was observed in right anterior STS/superior temporal gyrus (STG). Response patterns in this region were also significantly more discriminable for head turn direction than for rotation direction in physically matched ellipsoid control stimuli. Our findings suggest a role for right anterior STS/STG in coding the direction of motion in dynamic social attention cues.

  18. Anisotropic magnification distortion of the 3D galaxy correlation. I. Real space

    NASA Astrophysics Data System (ADS)

    Hui, Lam; Gaztañaga, Enrique; Loverde, Marilena

    2007-11-01

    It has long been known that gravitational lensing, primarily via magnification bias, modifies the observed galaxy (or quasar) clustering. Such discussions have largely focused on the 2D angular correlation function. Here and in paper II [L. Hui, E. Gaztañaga, and M. LoVerde, arXiv:0710.4191] we explore how magnification bias distorts the 3D correlation function and power spectrum, as first considered by Matsubara [Astrophys. J. Lett. 537, L77 (2000).AJLEEY0004-637X10.1086/312762]. The interesting point is that the distortion is anisotropic. Magnification bias in general preferentially enhances the observed correlation in the line-of-sight (LOS) orientation, especially on large scales. For instance, at a LOS separation of ˜100Mpc/h, where the intrinsic galaxy-galaxy correlation is rather weak, the observed correlation can be enhanced by lensing by a factor of a few, even at a modest redshift of z˜0.35. This effect presents an interesting opportunity as well as a challenge. The opportunity: this lensing anisotropy is distinctive, making it possible to separately measure the galaxy-galaxy, galaxy-magnification, and magnification-magnification correlations, without measuring galaxy shapes. The anisotropy is distinguishable from the well-known distortion due to peculiar motions, as will be discussed in paper II. The challenge: the magnification distortion of the galaxy correlation must be accounted for in interpreting data as precision improves. For instance, the ˜100Mpc/h baryon acoustic oscillation scale in the correlation function is shifted by up to ˜3% in the LOS orientation, and up to ˜0.6% in the monopole, depending on the galaxy bias, redshift, and number count slope. The corresponding shifts in the inferred Hubble parameter and angular diameter distance, if ignored, could significantly bias measurements of the dark energy equation of state. Lastly, magnification distortion offers a plausible explanation for the well-known excess correlations seen in

  19. CO Adsorption on GaPd-Unravelling the Chemical Bonding in Real Space.

    PubMed

    Villaseca, Sebastián Alarcón; Ormeci, Alim; Levchenko, Sergey V; Schlögl, Robert; Grin, Yuri; Armbrüster, Marc

    2017-02-17

    The electron localizability indicator-an efficient quantum chemical tool for analysis of chemical bonding-is applied to unveil the chemical bonding behind the CO adsorption on the (1‾ 1‾ 1‾ ) surface of the highly selective semi-hydrogenation catalyst GaPd. Refining the commonly applied Blyholder model, the obtained results are in excellent agreement with previous experimental and theoretical findings. The clean GaPd(1‾ 1‾ 1‾ ) surface presents unshielded negatively charged Pd centers and positively charged Ga species partially shielded by dangling bonds. The CO molecule adsorbs on-top of the Pd centers perperdicular to the surface, while no CO-Ga interaction is observed. The chemical bonding analysis results in deep understanding, thus enabling a cost efficient route to innovative materials by reverse engineering. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  20. VLA Observations of Solar Decimetric Spike Bursts: Direct Signature of Accelerated Electrons in Reconnection Outflow Region

    NASA Astrophysics Data System (ADS)

    Chen, B.; Bastian, T.; Gary, D. E.

    2014-12-01

    Solar decimetric spike bursts, which appear in a radio dynamic spectrum as a cluster of short-lived and narrowband brightenings, have been suggested as a possible signature of many, "elementary" particle accelerations at or near a magnetic reconnection site. Their dynamic spectral feature can be potentially used to diagnose important parameters of the reconnection site such as plasma density and spatial size of the fragmentation. Yet direct observational evidence supporting this scenario has been elusive mainly due to the lack of imaging observations. The upgraded Karl G. Jansky Very Large Array (VLA) provides the first opportunity of performing simultaneous radio imaging and dynamic spectroscopy, which allows radio sources to be imaged at every spatio-temporal pixel in the dynamic spectrum. Here we report Jansky VLA observations of decimetric spike bursts recorded during an eruptive solar limb flare. Combined with EUV and X-ray data from SDO and RHESSI, we show that the spike bursts coincide spatially with a loop-top hard X-ray source, which are located in a region where supra-arcade downflows meet the underlying hot, EUV/X-ray loops. We interpret the observed spike bursts as a direct signature of non-thermal electrons accelerated by turbulences and/or shocks in the reconnection outflow region.

  1. Direct observation of imprinted antiferromagnetic vortex state in CoO/Fe/Ag(001) disks

    SciTech Connect

    Wu, J.; Carlton, D.; Park, J. S.; Meng, Y.; Arenholz, E.; Doran, A.; Young, A.T.; Scholl, A.; Hwang, C.; Zhao, H. W.; Bokor, J.; Qiu, Z. Q.

    2010-12-21

    In magnetic thin films, a magnetic vortex is a state in which the magnetization vector curls around the center of a confined structure. A vortex state in a thin film disk, for example, is a topological object characterized by the vortex polarity and the winding number. In ferromagnetic (FM) disks, these parameters govern many fundamental properties of the vortex such as its gyroscopic rotation, polarity reversal, core motion, and vortex pair excitation. However, in antiferromagnetic (AFM) disks, though there has been indirect evidence of the vortex state through observations of the induced FM-ordered spins in the AFM disk, they have never been observed directly in experiment. By fabricating single crystalline NiO/Fe/Ag(001) and CoO/Fe/Ag(001) disks and using X-ray Magnetic Linear Dichroism (XMLD), we show direct observation of the vortex state in an AFM disk of AFM/FM bilayer system. We observe that there are two types of AFM vortices, one of which has no analog in FM structures. Finally, we show that a frozen AFM vortex can bias a FM vortex at low temperature.

  2. The Direct Observation of Nurse Practitioner Care study: An overview of the NP/patient visit.

    PubMed

    Weyer, Sharon M; Cook, Michelle L; Riley, Lydia

    2017-01-01

    While there is a preponderance of studies that demonstrate the quality of nurse practitioner (NP) practice, little is known on the practice style of NPs. The Direct Observation of Nurse Practitioner Care study provided the first national direct observation and characterization of patient care delivered by primary care NPs. The setting for this study was ambulatory care practices of NPs located throughout the United States. A nested sample was utilized, consisting of 22 NPs during visits with 245 patients. Observational data were collected during each visit using the Davis observation code (DOC). Patient information was collected from chart reviews and postvisit surveys. Each NP filled out a demographic and practice survey. Visits to NPs were 18 min on average, and were most frequently for new/acute problems (45.1%) or routine chronic problems (30.2%). Overall, NPs spent the most time planning treatment, history taking, and providing health education. Topics that NPs frequently provided health education about included medication action and side effects, disease process education, diet, and nutrition. Data from this study will allow for detailed characterizations of a patient-NP visit and average length of the visit and the time use based on the DOC. ©2016 American Association of Nurse Practitioners.

  3. Direct observation of liquid-like behavior of a single Au grain boundary

    NASA Astrophysics Data System (ADS)

    Casillas, Gilberto; Ponce, Arturo; Velázquez-Salazar, J. Jesús; José-Yacamán, Miguel

    2013-06-01

    Behavior of matter at the nanoscale differs from that of the bulk due to confinement and surface effects. Here, we report a direct observation of liquid-like behavior of a single grain boundary formed by cold-welding Au nanoparticles, 40 nm in size, by mechanical manipulation in situ TEM. The grain boundary rotates almost freely due to the free surfaces and can rotate about 90 degrees. The grain boundary sustains more stress than the bulk, confirming a strong bonding between the nanoparticles. Moreover, this technique allows the measurement of the surface diffusion coefficient from experimental observations, which we compute for the Au nanoparticles. This methodology can be used for any metal, oxide, semiconductor or combination of them.Behavior of matter at the nanoscale differs from that of the bulk due to confinement and surface effects. Here, we report a direct observation of liquid-like behavior of a single grain boundary formed by cold-welding Au nanoparticles, 40 nm in size, by mechanical manipulation in situ TEM. The grain boundary rotates almost freely due to the free surfaces and can rotate about 90 degrees. The grain boundary sustains more stress than the bulk, confirming a strong bonding between the nanoparticles. Moreover, this technique allows the measurement of the surface diffusion coefficient from experimental observations, which we compute for the Au nanoparticles. This methodology can be used for any metal, oxide, semiconductor or combination of them. Electronic supplementary information (ESI) available. See DOI: 10.1039/c3nr01501g

  4. CRITIC2: A program for real-space analysis of quantum chemical interactions in solids

    NASA Astrophysics Data System (ADS)

    Otero-de-la-Roza, A.; Johnson, Erin R.; Luaña, Víctor

    2014-03-01

    -chemical interactions in periodic solids by means of atoms-in-molecules and related formalisms. Solution method: Critical point search using Newton’s algorithm, atomic basin integration using bisection, qtree and grid-based algorithms, diverse graphical representations and computation of the non-covalent interactions index on a three-dimensional grid. Additional comments: !!!!! The distribution file for this program is over 330 Mbytes and therefore is not delivered directly when download or Email is requested. Instead a html file giving details of how the program can be obtained is sent. !!!!! Running time: Variable, depending on the crystal and the source of the underlying scalar field.

  5. Feedback in formative OSCEs: comparison between direct observation and video-based formats.

    PubMed

    Junod Perron, Noëlle; Louis-Simonet, Martine; Cerutti, Bernard; Pfarrwaller, Eva; Sommer, Johanna; Nendaz, Mathieu

    2016-01-01

    Medical students at the Faculty of Medicine, University of Geneva, Switzerland, have the opportunity to practice clinical skills with simulated patients during formative sessions in preparation for clerkships. These sessions are given in two formats: 1) direct observation of an encounter followed by verbal feedback (direct feedback) and 2) subsequent review of the videotaped encounter by both student and supervisor (video-based feedback). The aim of the study was to evaluate whether content and process of feedback differed between both formats. In 2013, all second- and third-year medical students and clinical supervisors involved in formative sessions were asked to take part in the study. A sample of audiotaped feedback sessions involving supervisors who gave feedback in both formats were analyzed (content and process of the feedback) using a 21-item feedback scale. Forty-eight audiotaped feedback sessions involving 12 supervisors were analyzed (2 direct and 2 video-based sessions per supervisor). When adjusted for the length of feedback, there were significant differences in terms of content and process between both formats; the number of communication skills and clinical reasoning items addressed were higher in the video-based format (11.29 vs. 7.71, p=0.002 and 3.71 vs. 2.04, p=0.010, respectively). Supervisors engaged students more actively during the video-based sessions than during direct feedback sessions (self-assessment: 4.00 vs. 3.17, p=0.007; active problem-solving: 3.92 vs. 3.42, p=0.009). Students made similar observations and tended to consider that the video feedback was more useful for improving some clinical skills. Video-based feedback facilitates discussion of clinical reasoning, communication, and professionalism issues while at the same time actively engaging students. Different time and conceptual frameworks may explain observed differences. The choice of feedback format should depend on the educational goal.

  6. Feedback in formative OSCEs: comparison between direct observation and video-based formats

    PubMed Central

    Junod Perron, Noëlle; Louis-Simonet, Martine; Cerutti, Bernard; Pfarrwaller, Eva; Sommer, Johanna; Nendaz, Mathieu

    2016-01-01

    Introduction Medical students at the Faculty of Medicine, University of Geneva, Switzerland, have the opportunity to practice clinical skills with simulated patients during formative sessions in preparation for clerkships. These sessions are given in two formats: 1) direct observation of an encounter followed by verbal feedback (direct feedback) and 2) subsequent review of the videotaped encounter by both student and supervisor (video-based feedback). The aim of the study was to evaluate whether content and process of feedback differed between both formats. Methods In 2013, all second- and third-year medical students and clinical supervisors involved in formative sessions were asked to take part in the study. A sample of audiotaped feedback sessions involving supervisors who gave feedback in both formats were analyzed (content and process of the feedback) using a 21-item feedback scale. Results Forty-eight audiotaped feedback sessions involving 12 supervisors were analyzed (2 direct and 2 video-based sessions per supervisor). When adjusted for the length of feedback, there were significant differences in terms of content and process between both formats; the number of communication skills and clinical reasoning items addressed were higher in the video-based format (11.29 vs. 7.71, p=0.002 and 3.71 vs. 2.04, p=0.010, respectively). Supervisors engaged students more actively during the video-based sessions than during direct feedback sessions (self-assessment: 4.00 vs. 3.17, p=0.007; active problem-solving: 3.92 vs. 3.42, p=0.009). Students made similar observations and tended to consider that the video feedback was more useful for improving some clinical skills. Conclusion Video-based feedback facilitates discussion of clinical reasoning, communication, and professionalism issues while at the same time actively engaging students. Different time and conceptual frameworks may explain observed differences. The choice of feedback format should depend on the educational

  7. Feedback in formative OSCEs: comparison between direct observation and video-based formats.

    PubMed

    Perron, Noëlle Junod; Louis-Simonet, Martine; Cerutti, Bernard; Pfarrwaller, Eva; Sommer, Johanna; Nendaz, Mathieu

    2016-01-01

    Introduction Medical students at the Faculty of Medicine, University of Geneva, Switzerland, have the opportunity to practice clinical skills with simulated patients during formative sessions in preparation for clerkships. These sessions are given in two formats: 1) direct observation of an encounter followed by verbal feedback (direct feedback) and 2) subsequent review of the videotaped encounter by both student and supervisor (video-based feedback). The aim of the study was to evaluate whether content and process of feedback differed between both formats. Methods In 2013, all second- and third-year medical students and clinical supervisors involved in formative sessions were asked to take part in the study. A sample of audiotaped feedback sessions involving supervisors who gave feedback in both formats were analyzed (content and process of the feedback) using a 21-item feedback scale. Results Forty-eight audiotaped feedback sessions involving 12 supervisors were analyzed (2 direct and 2 video-based sessions per supervisor). When adjusted for the length of feedback, there were significant differences in terms of content and process between both formats; the number of communication skills and clinical reasoning items addressed were higher in the video-based format (11.29 vs. 7.71, p=0.002 and 3.71 vs. 2.04, p=0.010, respectively). Supervisors engaged students more actively during the video-based sessions than during direct feedback sessions (self-assessment: 4.00 vs. 3.17, p=0.007; active problem-solving: 3.92 vs. 3.42, p=0.009). Students made similar observations and tended to consider that the video feedback was more useful for improving some clinical skills. Conclusion Video-based feedback facilitates discussion of clinical reasoning, communication, and professionalism issues while at the same time actively engaging students. Different time and conceptual frameworks may explain observed differences. The choice of feedback format should depend on the educational

  8. Real-space mapping of tailored sheet and edge plasmons in graphene nanoresonators

    NASA Astrophysics Data System (ADS)

    Nikitin, A. Y.; Alonso-González, P.; Vélez, S.; Mastel, S.; Centeno, A.; Pesquera, A.; Zurutuza, A.; Casanova, F.; Hueso, L. E.; Koppens, F. H. L.; Hillenbrand, R.

    2016-04-01

    Plasmons in graphene nanoresonators have many potential applications in photonics and optoelectronics, including room-temperature infrared and terahertz photodetectors, sensors, reflect arrays or modulators. The development of efficient devices will critically depend on precise knowledge and control of the plasmonic modes. Here, we use near-field microscopy between λ0 = 10-12 μm to excite and image plasmons in tailored disk and rectangular graphene nanoresonators, and observe a rich variety of coexisting Fabry-Perot modes. Disentangling them by a theoretical analysis allows the identification of sheet and edge plasmons, the latter exhibiting mode volumes as small as 10-8λ03. By measuring the dispersion of the edge plasmons we corroborate their superior confinement compared with sheet plasmons, which among others could be applied for efficient 1D coupling of quantum emitters. Our understanding of graphene plasmon images is a key to unprecedented in-depth analysis and verification of plasmonic functionalities in future flatland technologies.

  9. Phases and Interfaces from Real Space Atomically Resolved Data: Physics-Based Deep Data Image Analysis.

    PubMed

    Vasudevan, Rama K; Ziatdinov, Maxim; Jesse, Stephen; Kalinin, Sergei V

    2016-09-14

    Advances in electron and scanning probe microscopies have led to a wealth of atomically resolved structural and electronic data, often with ∼1-10 pm precision. However, knowledge generation from such data requires the development of a physics-based robust framework to link the observed structures to macroscopic chemical and physical descriptors, including single phase regions, order parameter fields, interfaces, and structural and topological defects. Here, we develop an approach based on a synergy of sliding window Fourier transform to capture the local analog of traditional structure factors combined with blind linear unmixing of the resultant 4D data set. This deep data analysis is ideally matched to the underlying physics of the problem and allows reconstruction of the a priori unknown structure factors of individual components and their spatial localization. We demonstrate the principles of this approach using a synthetic data set and further apply it for extracting chemical and physically relevant information from electron and scanning tunneling microscopy data. This method promises to dramatically speed up crystallographic analysis in atomically resolved data, paving the road toward automatic local structure-property determinations in crystalline and quasi-ordered systems, as well as systems with competing structural and electronic order parameters.

  10. Phases and interfaces from real space atomically resolved data: Physics-based deep data image analysis

    SciTech Connect

    Vasudevan, Rama K.; Ziatdinov, Maxim; Jesse, Stephen; Kalinin, Sergei V.

    2016-08-12

    Advances in electron and scanning probe microscopies have led to a wealth of atomically resolved structural and electronic data, often with ~1–10 pm precision. However, knowledge generation from such data requires the development of a physics-based robust framework to link the observed structures to macroscopic chemical and physical descriptors, including single phase regions, order parameter fields, interfaces, and structural and topological defects. Here, we develop an approach based on a synergy of sliding window Fourier transform to capture the local analog of traditional structure factors combined with blind linear unmixing of the resultant 4D data set. This deep data analysis is ideally matched to the underlying physics of the problem and allows reconstruction of the a priori unknown structure factors of individual components and their spatial localization. We demonstrate the principles of this approach using a synthetic data set and further apply it for extracting chemical and physically relevant information from electron and scanning tunneling microscopy data. Furthermore, this method promises to dramatically speed up crystallographic analysis in atomically resolved data, paving the road toward automatic local structure–property determinations in crystalline and quasi-ordered systems, as well as systems with competing structural and electronic order parameters.

  11. Phases and interfaces from real space atomically resolved data: Physics-based deep data image analysis

    DOE PAGES

    Vasudevan, Rama K.; Ziatdinov, Maxim; Jesse, Stephen; ...

    2016-08-12

    Advances in electron and scanning probe microscopies have led to a wealth of atomically resolved structural and electronic data, often with ~1–10 pm precision. However, knowledge generation from such data requires the development of a physics-based robust framework to link the observed structures to macroscopic chemical and physical descriptors, including single phase regions, order parameter fields, interfaces, and structural and topological defects. Here, we develop an approach based on a synergy of sliding window Fourier transform to capture the local analog of traditional structure factors combined with blind linear unmixing of the resultant 4D data set. This deep data analysismore » is ideally matched to the underlying physics of the problem and allows reconstruction of the a priori unknown structure factors of individual components and their spatial localization. We demonstrate the principles of this approach using a synthetic data set and further apply it for extracting chemical and physically relevant information from electron and scanning tunneling microscopy data. Furthermore, this method promises to dramatically speed up crystallographic analysis in atomically resolved data, paving the road toward automatic local structure–property determinations in crystalline and quasi-ordered systems, as well as systems with competing structural and electronic order parameters.« less

  12. Phases and interfaces from real space atomically resolved data: Physics-based deep data image analysis

    SciTech Connect

    Vasudevan, Rama K.; Ziatdinov, Maxim; Jesse, Stephen; Kalinin, Sergei V.

    2016-08-12

    Advances in electron and scanning probe microscopies have led to a wealth of atomically resolved structural and electronic data, often with ~1–10 pm precision. However, knowledge generation from such data requires the development of a physics-based robust framework to link the observed structures to macroscopic chemical and physical descriptors, including single phase regions, order parameter fields, interfaces, and structural and topological defects. Here, we develop an approach based on a synergy of sliding window Fourier transform to capture the local analog of traditional structure factors combined with blind linear unmixing of the resultant 4D data set. This deep data analysis is ideally matched to the underlying physics of the problem and allows reconstruction of the a priori unknown structure factors of individual components and their spatial localization. We demonstrate the principles of this approach using a synthetic data set and further apply it for extracting chemical and physically relevant information from electron and scanning tunneling microscopy data. Furthermore, this method promises to dramatically speed up crystallographic analysis in atomically resolved data, paving the road toward automatic local structure–property determinations in crystalline and quasi-ordered systems, as well as systems with competing structural and electronic order parameters.

  13. Home Videophones Improve Direct Observation in Tuberculosis Treatment: A Mixed Methods Evaluation

    PubMed Central

    Wade, Victoria A.; Karnon, Jonathan; Eliott, Jaklin A.; Hiller, Janet E.

    2012-01-01

    Background The use of direct observation to monitor tuberculosis treatment is controversial: cost, practical difficulties, and lack of patient acceptability limit effectiveness. Telehealth is a promising alternative delivery method for improving implementation. This study aimed to evaluate the clinical and cost-effectiveness of a telehealth service delivering direct observation, compared to an in-person drive-around service. Methodology/Principal Findings The study was conducted within a community nursing service in South Australia. Telehealth patients received daily video calls at home on a desktop videophone provided by the nursing call center. A retrospective cohort study assessed the effectiveness of the telehealth and traditional forms of observation, defined by the proportion of missed observations recorded in case notes. This data was inputted to a model, estimating the incremental cost-effectiveness ratio (ICER) of telehealth. Semi-structured interviews were conducted with current patients, community nursing and Chest Clinic staff, concerning service acceptability, usability and sustainability. The percentage of missed observations for the telehealth service was 12.1 (n = 58), compared to 31.1 for the in-person service (n = 70). Most of the difference of 18.9% (95% CI: 12.2 – 25.4) was due to fewer pre-arranged absences. The economic analysis calculated the ICER to be AUD$1.32 (95% CI: $0.51 – $2.26) per extra day of successful observation. The video service used less staff time, and became dominant if implemented on a larger scale and/or with decreased technology costs. Qualitative analysis found enabling factors of flexible timing, high patient acceptance, staff efficiency, and Chest Clinic support. Substantial technical problems were manageable, and improved liaison between the nursing service and Chest Clinic was an unexpected side-benefit. Conclusions/Significance Home video observation is a patient-centered, resource efficient way of

  14. Direct observation of the microstructure in cluster glass compound U(2)IrSi(3).

    PubMed

    Yubuta, K; Yamamura, T; Shiokawa, Y

    2006-07-05

    We have examined the structure of a U(2)IrSi(3) compound exhibiting ferromagnetic cluster glass behaviour by means of electron diffraction observation and high-resolution electron microscopy. The structure of U(2)IrSi(3) has been proposed as a new one of the U(2)RuSi(3)-type with a short-range ordered double stacking sequence of the U(2)RuSi(3)-type structure along the c-axis, and long-range ordered atomic arrangements in the a-b plane. The calculated patterns reproduce the characteristic features of observed electron patterns well. The Fourier-filtered high-resolution image clearly exhibits a micro-domain structure, which is considered to relate directly to the origin of the observed cluster glass behaviour in U(2)IrSi(3).

  15. Direct Observation of Tube-Like Motion of a Single Polymer Chain

    NASA Astrophysics Data System (ADS)

    Perkins, Thomas T.; Smith, Douglas E.; Chu, Steven

    1994-05-01

    Tube-like motion of a single, fluorescently labeled molecule of DNA in an entangled solution of unlabeled lambda-phage DNA molecules was observed by fluorescence microscopy. One end of a 16- to 100-micrometer-long DNA was attached to a 1-micrometer bead and moved with optical tweezers. The molecule was stretched into various conformations having bends, kinks, and loops. As the polymer relaxed, it closely followed a path defined by its initial contour. The relaxation time of the disturbance caused by the bead was roughly 1 second, whereas tube-like motion in small loops persisted for longer than 2 minutes. Tube deformation, constraint release, and excess chain segment diffusion were also observed. These observations provide direct evidence for several key assumptions in the reptation model developed by de Gennes, Edwards, and Doi.

  16. Direct observation of tube-like motion of a single polymer chain.

    PubMed

    Perkins, T T; Smith, D E; Chu, S

    1994-05-06

    Tube-like motion of a single, fluorescently labeled molecule of DNA in an entangled solution of unlabeled lambda-phage DNA molecules was observed by fluorescence microscopy. One end of a 16- to 100-micrometer-long DNA was attached to a 1-micrometer bead and moved with optical tweezers. The molecule was stretched into various conformations having bends, kinks, and loops. As the polymer relaxed, it closely followed a path defined by its initial contour. The relaxation time of the disturbance caused by the bead was roughly 1 second, whereas tube-like motion in small loops persisted for longer than 2 minutes. Tube deformation, constraint release, and excess chain segment diffusion were also observed. These observations provide direct evidence for several key assumptions in the reptation model developed by de Gennes, Edwards, and Doi.

  17. Direct observation of Li diffusion in Li-doped ZnO nanowires

    NASA Astrophysics Data System (ADS)

    Li, Guohua; Yu, Lei; Hudak, Bethany M.; Chang, Yao-Jen; Baek, Hyeonjun; Sundararajan, Abhishek; Strachan, Douglas R.; Yi, Gyu-Chul; Guiton, Beth S.

    2016-05-01

    The direct observation of Li diffusion in Li-doped zinc oxide nanowires (NWs) was realized by using in situ heating in the scanning transmission electron microscope (STEM). A continuous increase of low atomic mass regions within a single NW was observed between 200 °C and 600 °C when heated in vacuum, which was explained by the conversion of interstitial to substitutional Li in the ZnO NW host lattice. A kick-out mechanism is introduced to explain the migration and conversion of the interstitial Li (Lii) to Zn-site substitutional Li (LiZn), and this mechanism is verified with low-temperature (11 K) photoluminescence measurements on as-grown and annealed Li-doped zinc oxide NWs, as well as the observation of an increase of NW surface roughing with applied bias.

  18. Intense deformation field at oceanic front inferred from directional sea surface roughness observations

    NASA Astrophysics Data System (ADS)

    Rascle, Nicolas; Molemaker, Jeroen; Marié, Louis; Nouguier, Frédéric; Chapron, Bertrand; Lund, Björn; Mouche, Alexis

    2017-06-01

    Fine-scale current gradients at the ocean surface can be observed by sea surface roughness. More specifically, directional surface roughness anomalies are related to the different horizontal current gradient components. This paper reports results from a dedicated experiment during the Lagrangian Submesoscale Experiment (LASER) drifter deployment. A very sharp front, 50 m wide, is detected simultaneously in drifter trajectories, sea surface temperature, and sea surface roughness. A new observational method is applied, using Sun glitter reflections during multiple airplane passes to reconstruct the multiangle roughness anomaly. This multiangle anomaly is consistent with wave-current interactions over a front, including both cross-front convergence and along-front shear with cyclonic vorticity. Qualitatively, results agree with drifters and X-band radar observations. Quantitatively, the sharpness of roughness anomaly suggests intense current gradients, 0.3 m s-1 over the 50 m wide front. This work opens new perspectives for monitoring intense oceanic fronts using drones or satellite constellations.

  19. A Genetic Algorithm Method for Direct estimation of paleostress states from heterogeneous fault-slip observations

    NASA Astrophysics Data System (ADS)

    Srivastava, D. C.

    2016-12-01

    A Genetic Algorithm Method for Direct estimation of paleostress states from heterogeneous fault-slip observationsDeepak C. Srivastava, Prithvi Thakur and Pravin K. GuptaDepartment of Earth Sciences, Indian Institute of Technology Roorkee, Roorkee 247667, India. Abstract Paleostress estimation from a group of heterogeneous fault-slip observations entails first the classification of the observations into homogeneous fault sets and then a separate inversion of each homogeneous set. This study combines these two issues into a nonlinear inverse problem and proposes a heuristic search method that inverts the heterogeneous fault-slip observations. The method estimates different paleostress states in a group of heterogeneous fault-slip observations and classifies it into homogeneous sets as a byproduct. It uses the genetic algorithm operators, elitism, selection, encoding, crossover and mutation. These processes translate into a guided search that finds successively fitter solutions and operate iteratively until the termination criteria is met and the globally fittest stress tensors are obtained. We explain the basic steps of the algorithm on a working example and demonstrate validity of the method on several synthetic and a natural group of heterogeneous fault-slip observations. The method is independent of any user-defined bias or any entrapment of solution in a local optimum. It succeeds even in the difficult situations where other classification methods are found to fail.

  20. Investigating common clinical presentations in first opinion small animal consultations using direct observation

    PubMed Central

    Robinson, N. J.; Dean, R. S.; Cobb, M.; Brennan, M. L.

    2015-01-01

    Understanding more about the clinical presentations encountered in veterinary practice is vital in directing research towards areas relevant to practitioners. The aim of this study was to describe all problems discussed during a convenience sample of consultations using a direct observation method. A data collection tool was used to gather data by direct observation during small animal consultations at eight sentinel practices. Data were recorded for all presenting and non-presenting specific health problems discussed. A total of 1901 patients were presented with 3206 specific health problems discussed. Clinical presentation varied widely between species and between presenting and non-presenting problems. Skin lump, vomiting and inappetence were the most common clinical signs reported by the owner while overweight/obese, dental tartar and skin lump were the most common clinical examination findings. Skin was the most frequently affected body system overall followed by non-specific problems then the gastrointestinal system. Consultations are complex, with a diverse range of different clinical presentations seen. Considering the presenting problem only may give an inaccurate view of the veterinary caseload, as some common problems are rarely the reason for presentation. Understanding the common diagnoses made is the next step and will help to further focus questions for future research. PMID:25564472

  1. Investigating common clinical presentations in first opinion small animal consultations using direct observation.

    PubMed

    Robinson, N J; Dean, R S; Cobb, M; Brennan, M L

    2015-05-02

    Understanding more about the clinical presentations encountered in veterinary practice is vital in directing research towards areas relevant to practitioners. The aim of this study was to describe all problems discussed during a convenience sample of consultations using a direct observation method. A data collection tool was used to gather data by direct observation during small animal consultations at eight sentinel practices. Data were recorded for all presenting and non-presenting specific health problems discussed. A total of 1901 patients were presented with 3206 specific health problems discussed. Clinical presentation varied widely between species and between presenting and non-presenting problems. Skin lump, vomiting and inappetence were the most common clinical signs reported by the owner while overweight/obese, dental tartar and skin lump were the most common clinical examination findings. Skin was the most frequently affected body system overall followed by non-specific problems then the gastrointestinal system. Consultations are complex, with a diverse range of different clinical presentations seen. Considering the presenting problem only may give an inaccurate view of the veterinary caseload, as some common problems are rarely the reason for presentation. Understanding the common diagnoses made is the next step and will help to further focus questions for future research.

  2. An accuracy measurement method for star trackers based on direct astronomic observation

    PubMed Central

    Sun, Ting; Xing, Fei; Wang, Xiaochu; You, Zheng; Chu, Daping

    2016-01-01

    Star tracker is one of the most promising optical attitude measurement devices and it is widely used in spacecraft for its high accuracy. However, how to realize and verify such an accuracy remains a crucial but unsolved issue until now. The authenticity of the accuracy measurement method of a star tracker will eventually determine the satellite performance. A new and robust accuracy measurement method for a star tracker based on the direct astronomical observation is proposed here. In comparison with the conventional method with simulated stars, this method utilizes real navigation stars as observation targets which makes the measurement results more authoritative and authentic. Transformations between different coordinate systems are conducted on the account of the precision movements of the Earth, and the error curves of directional vectors are obtained along the three axes. Based on error analysis and accuracy definitions, a three-axis accuracy evaluation criterion has been proposed in this paper, which could determine pointing and rolling accuracy of a star tracker directly. Experimental measurements confirm that this method is effective and convenient to implement. Such a measurement environment is close to the in-orbit conditions and it can satisfy the stringent requirement for high-accuracy star trackers. PMID:26948412

  3. Capturing the complexity of first opinion small animal consultations using direct observation

    PubMed Central

    Robinson, N. J.; Brennan, M. L.; Cobb, M.; Dean, R. S.

    2015-01-01

    Various different methods are currently being used to capture data from small animal consultations. The aim of this study was to develop a tool to record detailed data from consultations by direct observation. A second aim was to investigate the complexity of the consultation by examining the number of problems discussed per patient. A data collection tool was developed and used during direct observation of small animal consultations in eight practices. Data were recorded on consultation type, patient signalment and number of problems discussed. During 16 weeks of data collection, 1901 patients were presented. Up to eight problems were discussed for some patients; more problems were discussed during preventive medicine consultations than during first consultations (P<0.001) or revisits (P<0.001). Fewer problems were discussed for rabbits than cats (P<0.001) or dogs (P<0.001). Age was positively correlated with discussion of specific health problems and negatively correlated with discussion of preventive medicine. Consultations are complex with multiple problems frequently discussed, suggesting comorbidity may be common. Future research utilising practice data should consider how much of this complexity needs to be captured, and use appropriate methods accordingly. The findings here have implications for directing research and education as well as application in veterinary practice. PMID:25262057

  4. An accuracy measurement method for star trackers based on direct astronomic observation.

    PubMed

    Sun, Ting; Xing, Fei; Wang, Xiaochu; You, Zheng; Chu, Daping

    2016-03-07

    Star tracker is one of the most promising optical attitude measurement devices and it is widely used in spacecraft for its high accuracy. However, how to realize and verify such an accuracy remains a crucial but unsolved issue until now. The authenticity of the accuracy measurement method of a star tracker will eventually determine the satellite performance. A new and robust accuracy measurement method for a star tracker based on the direct astronomical observation is proposed here. In comparison with the conventional method with simulated stars, this method utilizes real navigation stars as observation targets which makes the measurement results more authoritative and authentic. Transformations between different coordinate systems are conducted on the account of the precision movements of the Earth, and the error curves of directional vectors are obtained along the three axes. Based on error analysis and accuracy definitions, a three-axis accuracy evaluation criterion has been proposed in this paper, which could determine pointing and rolling accuracy of a star tracker directly. Experimental measurements confirm that this method is effective and convenient to implement. Such a measurement environment is close to the in-orbit conditions and it can satisfy the stringent requirement for high-accuracy star trackers.

  5. An accuracy measurement method for star trackers based on direct astronomic observation

    NASA Astrophysics Data System (ADS)

    Sun, Ting; Xing, Fei; Wang, Xiaochu; You, Zheng; Chu, Daping

    2016-03-01

    Star tracker is one of the most promising optical attitude measurement devices and it is widely used in spacecraft for its high accuracy. However, how to realize and verify such an accuracy remains a crucial but unsolved issue until now. The authenticity of the accuracy measurement method of a star tracker will eventually determine the satellite performance. A new and robust accuracy measurement method for a star tracker based on the direct astronomical observation is proposed here. In comparison with the conventional method with simulated stars, this method utilizes real navigation stars as observation targets which makes the measurement results more authoritative and authentic. Transformations between different coordinate systems are conducted on the account of the precision movements of the Earth, and the error curves of directional vectors are obtained along the three axes. Based on error analysis and accuracy definitions, a three-axis accuracy evaluation criterion has been proposed in this paper, which could determine pointing and rolling accuracy of a star tracker directly. Experimental measurements confirm that this method is effective and convenient to implement. Such a measurement environment is close to the in-orbit conditions and it can satisfy the stringent requirement for high-accuracy star trackers.

  6. Direct observation and quantification of extracellular long-range electron flow in anaerobic bacteria

    NASA Astrophysics Data System (ADS)

    Malvankar, Nikhil; Yalcin, Sibel; Vargas, Madeline; Tuominen, Mark; Lovley, Derek

    2013-03-01

    Some anaerobic microorganisms are capable of transporting electrons outside their cell to distant electron acceptors such as metals, minerals or partner species. Previous studies have focused primarily on transport over short distances (< 1 μm) via diffusion of molecular intermediates, or alternatively via tunneling or thermally-activated hopping across biomolecules. However, we have found that Geobacter sulfurreducens can transport electrons over long distances (> 10 μm) using pili filaments that show organic metal-like conductivity. Pili also enable direct exchange of electrons among syntrophic Geobacter co-cultures. In order to establish the physical principles underlying this remarkable electron transport, we have employed a novel scanning probe microscopy-based method to perform quantitative measurements of electron flow at a single cell level under physiological conditions. Using this nanoscopic approach, we have directly observed the propagation and distribution of injected electrons in individual native bacterial extracellular proteins. Our direct measurements demonstrate unambiguously for the first time that the pili of G. sulfurreducens are a novel class of electronically functional proteins that can sustain electron flow in a surprising manner that has not been observed previously in any other natural protein. Funded by Office of Naval Research, DOE Genomic Sciences and NSF-NSEC Center for Hierarchical Manufacturing grant no. CMMI-1025020.

  7. Apparatus for Direct Optical Fiber Through-Lens Illumination of Microscopy or Observational Objects

    NASA Technical Reports Server (NTRS)

    Kadogawa, Hiroshi (Inventor)

    2001-01-01

    In one embodiment of the invention, a microscope or other observational apparatus, comprises a hollow tube, a lens mounted to the tube, a light source and at least one flexible optical fiber having an input end and an output end. The input end is positioned to receive light from the light source, and the output end is positioned within the tube so as to directly project light along a straight path to the lens to illuminate an object to be viewed. The path of projected light is uninterrupted and free of light deflecting elements. By passing the light through the lens, the light can be diffused or otherwise defocused to provide more uniform illumination across the surface of the object, increasing the quality of the image of the object seen by the viewer. The direct undeflected and uninterrupted projection of light, without change of direction, eliminates the need for light-deflecting elements, such as beam-splitters, mirrors, prisms, or the like, to direct the projected light towards the object.

  8. Photoacoustics of single laser-trapped nanodroplets for the direct observation of nanofocusing in aerosol photokinetics

    PubMed Central

    Cremer, Johannes W.; Thaler, Klemens M.; Haisch, Christoph; Signorell, Ruth

    2016-01-01

    Photochemistry taking place in atmospheric aerosol droplets has a significant impact on the Earth's climate. Nanofocusing of electromagnetic radiation inside aerosols plays a crucial role in their absorption behaviour, since the radiation flux inside the droplet strongly affects the activation rate of photochemically active species. However, size-dependent nanofocusing effects in the photokinetics of small aerosols have escaped direct observation due to the inability to measure absorption signatures from single droplets. Here we show that photoacoustic measurements on optically trapped single nanodroplets provide a direct, broadly applicable method to measure absorption with attolitre sensitivity. We demonstrate for a model aerosol that the photolysis is accelerated by an order of magnitude in the sub-micron to micron size range, compared with larger droplets. The versatility of our technique promises broad applicability to absorption studies of aerosol particles, such as atmospheric aerosols where quantitative photokinetic data are critical for climate predictions. PMID:26979973

  9. Direct assessment of groundwater vulnerability from single observations of multiple contaminants

    USGS Publications Warehouse

    Worrall, F.; Kolpin, D.W.

    2003-01-01

    Groundwater vulnerability is a central concept in pollution risk assessment, yet its estimation has been largely a matter of expert judgment. This work applies a method for the direct calculation of vulnerability from monitoring well observations of pesticide concentrations. The method has two major advantages: it is independent of the compounds being examined, and it has a direct probabilistic interpretation making it ideal for risk assessment. The methodology was applied to data from a groundwater monitoring program in the midwestern United States. The distribution of the vulnerabilities was skewed toward zero. Spatial distribution of the vulnerabilities shows them to be controlled by both regional and local factors. Methods are presented for estimating the necessary sample sizes for vulnerability studies. The further application of the approach developed in this study to understanding groundwater pollution is discussed.

  10. Observation of flux-creep in direction opposite to the Lorentz force

    NASA Astrophysics Data System (ADS)

    Sawh, R.-P.; Weinstein, R.; Carpenter, K.; Parks, D.; Davey, K.

    2017-04-01

    The conclusion that free fluxoids move in the direction of \\mathop{{\\boldsymbol{F}}}\\limits \\rightharpoonup ={\\mathop{J}\\limits \\rightharpoonup }{{c}}× \\mathop{{\\boldsymbol{B}}}\\limits \\rightharpoonup is broadly accepted. For certain spatial distributions of flux in HTS bulks, this requires free fluxoids to collect at the center of the bulk. Here, we report experiments in which such spatial distributions are created by means of zero-field-cool partial magnetization of the bulk, and the temporal changes in flux are measured. We report that the direction of the flux creep is observed to be opposite to \\mathop{{\\boldsymbol{F}}}\\limits \\rightharpoonup ={\\mathop{J}\\limits \\rightharpoonup }{{c}}× \\mathop{{\\boldsymbol{B}}.}\\limits \\rightharpoonup

  11. Direct observation shows superposition and large scale flexibility within cytoplasmic dynein motors moving along microtubules

    PubMed Central

    Imai, Hiroshi; Shima, Tomohiro; Sutoh, Kazuo; Walker, Matthew L.; Knight, Peter J.; Kon, Takahide; Burgess, Stan A.

    2015-01-01

    Cytoplasmic dynein is a dimeric AAA+ motor protein that performs critical roles in eukaryotic cells by moving along microtubules using ATP. Here using cryo-electron microscopy we directly observe the structure of Dictyostelium discoideum dynein dimers on microtubules at near-physiological ATP concentrations. They display remarkable flexibility at a hinge close to the microtubule binding domain (the stalkhead) producing a wide range of head positions. About half the molecules have the two heads separated from one another, with both leading and trailing motors attached to the microtubule. The other half have the two heads and stalks closely superposed in a front-to-back arrangement of the AAA+ rings, suggesting specific contact between the heads. All stalks point towards the microtubule minus end. Mean stalk angles depend on the separation between their stalkheads, which allows estimation of inter-head tension. These findings provide a structural framework for understanding dynein's directionality and unusual stepping behaviour. PMID:26365535

  12. Direct observation of multistep energy transfer in LHCII with fifth-order 3D electronic spectroscopy

    NASA Astrophysics Data System (ADS)

    Zhang, Zhengyang; Lambrev, Petar H.; Wells, Kym L.; Garab, Győző; Tan, Howe-Siang

    2015-07-01

    During photosynthesis, sunlight is efficiently captured by light-harvesting complexes, and the excitation energy is then funneled towards the reaction centre. These photosynthetic excitation energy transfer (EET) pathways are complex and proceed in a multistep fashion. Ultrafast two-dimensional electronic spectroscopy (2DES) is an important tool to study EET processes in photosynthetic complexes. However, the multistep EET processes can only be indirectly inferred by correlating different cross peaks from a series of 2DES spectra. Here we directly observe multistep EET processes in LHCII using ultrafast fifth-order three-dimensional electronic spectroscopy (3DES). We measure cross peaks in 3DES spectra of LHCII that directly indicate energy transfer from excitons in the chlorophyll b (Chl b) manifold to the low-energy level chlorophyll a (Chl a) via mid-level Chl a energy states. This new spectroscopic technique allows scientists to move a step towards mapping the complete complex EET processes in photosynthetic systems.

  13. Direct observation shows superposition and large scale flexibility within cytoplasmic dynein motors moving along microtubules

    NASA Astrophysics Data System (ADS)

    Imai, Hiroshi; Shima, Tomohiro; Sutoh, Kazuo; Walker, Matthew L.; Knight, Peter J.; Kon, Takahide; Burgess, Stan A.

    2015-09-01

    Cytoplasmic dynein is a dimeric AAA+ motor protein that performs critical roles in eukaryotic cells by moving along microtubules using ATP. Here using cryo-electron microscopy we directly observe the structure of Dictyostelium discoideum dynein dimers on microtubules at near-physiological ATP concentrations. They display remarkable flexibility at a hinge close to the microtubule binding domain (the stalkhead) producing a wide range of head positions. About half the molecules have the two heads separated from one another, with both leading and trailing motors attached to the microtubule. The other half have the two heads and stalks closely superposed in a front-to-back arrangement of the AAA+ rings, suggesting specific contact between the heads. All stalks point towards the microtubule minus end. Mean stalk angles depend on the separation between their stalkheads, which allows estimation of inter-head tension. These findings provide a structural framework for understanding dynein's directionality and unusual stepping behaviour.

  14. Direct observation of multistep energy transfer in LHCII with fifth-order 3D electronic spectroscopy

    PubMed Central

    Zhang, Zhengyang; Lambrev, Petar H.; Wells, Kym L.; Garab, Győző; Tan, Howe-Siang

    2015-01-01

    During photosynthesis, sunlight is efficiently captured by light-harvesting complexes, and the excitation energy is then funneled towards the reaction centre. These photosynthetic excitation energy transfer (EET) pathways are complex and proceed in a multistep fashion. Ultrafast two-dimensional electronic spectroscopy (2DES) is an important tool to study EET processes in photosynthetic complexes. However, the multistep EET processes can only be indirectly inferred by correlating different cross peaks from a series of 2DES spectra. Here we directly observe multistep EET processes in LHCII using ultrafast fifth-order three-dimensional electronic spectroscopy (3DES). We measure cross peaks in 3DES spectra of LHCII that directly indicate energy transfer from excitons in the chlorophyll b (Chl b) manifold to the low-energy level chlorophyll a (Chl a) via mid-level Chl a energy states. This new spectroscopic technique allows scientists to move a step towards mapping the complete complex EET processes in photosynthetic systems. PMID:26228055

  15. Photoacoustics of single laser-trapped nanodroplets for the direct observation of nanofocusing in aerosol photokinetics

    NASA Astrophysics Data System (ADS)

    Cremer, Johannes W.; Thaler, Klemens M.; Haisch, Christoph; Signorell, Ruth

    2016-03-01

    Photochemistry taking place in atmospheric aerosol droplets has a significant impact on the Earth's climate. Nanofocusing of electromagnetic radiation inside aerosols plays a crucial role in their absorption behaviour, since the radiation flux inside the droplet strongly affects the activation rate of photochemically active species. However, size-dependent nanofocusing effects in the photokinetics of small aerosols have escaped direct observation due to the inability to measure absorption signatures from single droplets. Here we show that photoacoustic measurements on optically trapped single nanodroplets provide a direct, broadly applicable method to measure absorption with attolitre sensitivity. We demonstrate for a model aerosol that the photolysis is accelerated by an order of magnitude in the sub-micron to micron size range, compared with larger droplets. The versatility of our technique promises broad applicability to absorption studies of aerosol particles, such as atmospheric aerosols where quantitative photokinetic data are critical for climate predictions.

  16. Direct observation of a highly spin-polarized organic spinterface at room temperature

    PubMed Central

    Djeghloul, F.; Ibrahim, F.; Cantoni, M.; Bowen, M.; Joly, L.; Boukari, S.; Ohresser, P.; Bertran, F.; Le Fèvre, P.; Thakur, P.; Scheurer, F.; Miyamachi, T.; Mattana, R.; Seneor, P.; Jaafar, A.; Rinaldi, C.; Javaid, S.; Arabski, J.; Kappler, J. -P; Wulfhekel, W.; Brookes, N. B.; Bertacco, R.; Taleb-Ibrahimi, A.; Alouani, M.; Beaurepaire, E.; Weber, W.

    2013-01-01

    Organic semiconductors constitute promising candidates toward large-scale electronic circuits that are entirely spintronics-driven. Toward this goal, tunneling magnetoresistance values above 300% at low temperature suggested the presence of highly spin-polarized device interfaces. However, such spinterfaces have not been observed directly, let alone at room temperature. Thanks to experiments and theory on the model spinterface between phthalocyanine molecules and a Co single crystal surface, we clearly evidence a highly efficient spinterface. Spin-polarised direct and inverse photoemission experiments reveal a high degree of spin polarisation at room temperature at this interface. We measured a magnetic moment on the molecule's nitrogen π orbitals, which substantiates an ab-initio theoretical description of highly spin-polarised charge conduction across the interface due to differing spinterface formation mechanisms in each spin channel. We propose, through this example, a recipe to engineer simple organic-inorganic interfaces with remarkable spintronic properties that can endure well above room temperature. PMID:23412079

  17. Tracking individual membrane proteins and their biochemistry: The power of direct observation.

    PubMed

    Barden, Adam O; Goler, Adam S; Humphreys, Sara C; Tabatabaei, Samaneh; Lochner, Martin; Ruepp, Marc-David; Jack, Thomas; Simonin, Jonathan; Thompson, Andrew J; Jones, Jeffrey P; Brozik, James A

    2015-11-01

    The advent of single molecule fluorescence microscopy has allowed experimental molecular biophysics and biochemistry to transcend traditional ensemble measurements, where the behavior of individual proteins could not be precisely sampled. The recent explosion in popularity of new super-resolution and super-localization techniques coupled with technical advances in optical designs and fast highly sensitive cameras with single photon sensitivity and millisecond time resolution have made it possible to track key motions, reactions, and interactions of individual proteins with high temporal resolution and spatial resolution well beyond the diffraction limit. Within the purview of membrane proteins and ligand gated ion channels (LGICs), these outstanding advances in single molecule microscopy allow for the direct observation of discrete biochemical states and their fluctuation dynamics. Such observations are fundamentally important for understanding molecular-level mechanisms governing these systems. Examples reviewed here include the effects of allostery on the stoichiometry of ligand binding in the presence of fluorescent ligands; the observation of subdomain partitioning of membrane proteins due to microenvironment effects; and the use of single particle tracking experiments to elucidate characteristics of membrane protein diffusion and the direct measurement of thermodynamic properties, which govern the free energy landscape of protein dimerization. The review of such characteristic topics represents a snapshot of efforts to push the boundaries of fluorescence microscopy of membrane proteins to the absolute limit. This article is part of the Special Issue entitled 'Fluorescent Tools in Neuropharmacology'.

  18. Direct observation of the ferroelectric polarization in the layered perovskite Bi4Ti3O12

    NASA Astrophysics Data System (ADS)

    Urushihara, Daisuke; Komabuchi, Mai; Ishizawa, Nobuo; Iwata, Makoto; Fukuda, Koichiro; Asaka, Toru

    2016-10-01

    We investigated the crystal structure and ferroelectric domains of Bi4Ti3O12 (BTO) by means of transmission electron microscopy (TEM) and single-crystal X-ray diffractometry. From the extinction rule, we determined that the space group in the ferroelectric phase of BTO is P1a1 rather than B2cb and B1a1 which have been proposed previously. We successfully refined the crystal structure based on the space group P1a1. The 180° and 90° ferroelectric domain structures were observed by the [001]-zone dark-field TEM imaging. In the 180° domain structure, we determined that one component of the polarization vector is parallel to the a-axis. An annular bright-field scanning transmission electron microscopy (ABF-STEM) was performed for the direct observation of the crystal structures. The ABF-STEM images displayed the contrasts with respect to every atomic position in spite of the highly distorted structure of BTO. We could evaluate the tilting and distortion of the [TiO6] octahedra relatively. Therefore, we directly observed the ferroelectric displacements of Bi and Ti ions.

  19. Direct Observation of Aggregative Nanoparticle Growth: Kinetic Modeling of the Size Distribution and Growth Rate

    SciTech Connect

    Woehl, Taylor J.; Park, Chiwoo; Evans, James E.; Arslan, Ilke; Ristenpart, William D.; Browning, Nigel D.

    2014-01-08

    Direct observations of solution-phase nanoparticle growth using in situ liquid transmission electron microscopy (TEM) have demonstrated the importance of “non-classical” growth mechanisms, such as aggregation and coalescence, on the growth and final morphology of nanocrystals at the atomic and single nanoparticle scales. To date, groups have quantitatively interpreted the mean growth rate of nanoparticles in terms of the Lifshitz-Slyozov-Wagner (LSW) model for Ostwald ripening, but less attention has been paid to modeling the corresponding particle size distribution. Here we use in situ fluid stage scanning TEM to demonstrate that silver nanoparticles grow by a length-scale dependent mechanism, where individual nanoparticles grow by monomer attachment but ensemble-scale growth is dominated by aggregation. Although our observed mean nanoparticle growth rate is consistent with the LSW model, we show that the corresponding particle size distribution is broader and more symmetric than predicted by LSW. Following direct observations of aggregation, we interpret the ensemble-scale growth using Smoluchowski kinetics and demonstrate that the Smoluchowski model quantitatively captures the mean growth rate and particle size distribution.

  20. An Unroofing Method to Observe the Cytoskeleton Directly at Molecular Resolution Using Atomic Force Microscopy

    PubMed Central

    Usukura, Eiji; Narita, Akihiro; Yagi, Akira; Ito, Shuichi; Usukura, Jiro

    2016-01-01

    An improved unroofing method enabled the cantilever of an atomic force microscope (AFM) to reach directly into a cell to visualize the intracellular cytoskeletal actin filaments, microtubules, clathrin coats, and caveolae in phosphate-buffered saline (PBS) at a higher resolution than conventional electron microscopy. All of the actin filaments clearly exhibited a short periodicity of approximately 5–6 nm, which was derived from globular actins linked to each other to form filaments, as well as a long helical periodicity. The polarity of the actin filaments appeared to be determined by the shape of the periodic striations. Microtubules were identified based on their thickness. Clathrin coats and caveolae were observed on the cytoplasmic surface of cell membranes. The area containing clathrin molecules and their terminal domains was directly visualized. Characteristic ridge structures located at the surface of the caveolae were observed at high resolution, similar to those observed with electron microscopy (EM). Overall, unroofing allowed intracellular AFM imaging in a liquid environment with a level of quality equivalent or superior to that of EM. Thus, AFMs are anticipated to provide cutting-edge findings in cell biology and histology. PMID:27273367

  1. Investigations on the mechanism of superlubricity achieved with phosphoric acid solution by direct observation

    NASA Astrophysics Data System (ADS)

    Li, Jinjin; Ma, Liran; Zhang, Shaohua; Zhang, Chenhui; Liu, Yuhong; Luo, Jianbin

    2013-09-01

    In this work, the contact region between a Si3N4 ball and a SiO2 plate with the lubrication of phosphoric acid solution is observed directly by an optical microscope combined with a Raman microscope to understand the superlubricity mechanism. It is found that the wear on the friction surfaces mainly occurs at the beginning of the test and nearly disappears after the friction coefficient reduces to 0.05. When the superlubricity appears (μ = 0.004), there is only a limited amount of solution available to the contact (forming starvation state), resulting in an "H" distribution surrounding the contact region. Moreover, it is observed that the hydrogen bond effect in the solution is enhanced with time going by, and finally a thin film with hydrogen bond network among H3PO4, H2PO4-, and H2O is formed on the friction surfaces, leading to the superlubricity. By employing this direct observation approach, the structure of the confined solution and the superlubricity mechanism of phosphoric acid solution are finally investigated and discussed.

  2. Direct observations of ecosystem light use efficiency from MAIAC/MODIS

    NASA Astrophysics Data System (ADS)

    Hall, F. G.; Hilker, T.; Lyapustin, A.; Wang, Y.; Coops, N.; Drolet, G.

    2009-12-01

    The fraction of photosynthetically active radiation (FPAR) incident upon and absorbed by vegetated ecosystems is a standard MODIS product. From this and satellite observations of incident PAR flux, ecosystem photosynthetic capacity can be measured remotely, but not ecosystem photosynthetic rate. The missing link is remotely sensed observations of ecosystem light-use efficiency (LUE) (the efficiency with which ecosystems convert absorbed PAR into carbon), which is modulated by plant physiology in response to rapidly changing extant environmental conditions. LUE is currently estimated from models that attempt to relate plant physiological response to their environment (soil moisture, fertility etc); however accuracies are limited by the uncertainty of the required inputs at landscape scales - primarily precipitation and soil hydrological characteristics. To rectify this situation, a number of recent studies were directed at measuring ecosystem LUE directly from MODIS using a photochemical reflectance index (PRI) - based on the reflectance measurements from MODIS bands 11 and 12 (~531 and ~550 nm). Results however have shown that quantifying the relationship between MODIS PRI and ecosystem LUE remains challenging. In addition, atmospherically induced aerosol variability confounds the subtle PRI signal. Here, we introduce and evaluate a new approach (MAIAC) that minimizes cloud interference, and aerosol and surface bidirectional reflectance effects on PRI. Using tower measured LUE, we evaluate our approach and demonstrate a strong relationship (r2=0.74, p<0.01) between tower based observations of both PRI and LUE and those from atmospherically corrected MODIS data; these correlations remained robust throughout the vegetation period of 2006. Swath observations yielded better results than gridded data (r2=0.58, p<0.01) both of which included forward and backscatter observations. As expected from theoretical considerations, MODIS PRI values were strongly related to canopy

  3. Direct atmosphere opacity observations from CALIPSO provide new constraints on cloud-radiation interactions

    NASA Astrophysics Data System (ADS)

    Guzman, R.; Chepfer, H.; Noel, V.; Vaillant de Guélis, T.; Kay, J. E.; Raberanto, P.; Cesana, G.; Vaughan, M. A.; Winker, D. M.

    2017-01-01

    The spaceborne lidar CALIPSO (Cloud-Aerosol Lidar and Infrared Pathfinder Satellite Observation) directly measures atmospheric opacity. In 8 years of CALIPSO observations, we find that 69% of vertical profiles penetrate through the complete atmosphere. The remaining 31% do not reach the surface, due to opaque clouds. The global mean altitude of full attenuation of the lidar beam (z_opaque) is 3.2 km, but there are large regional variations in this altitude. Of relevance to cloud-climate studies, the annual zonal mean longwave cloud radiative effect and annual zonal mean z_opaque weighted by opaque cloud cover are highly correlated (0.94). The annual zonal mean shortwave cloud radiative effect and annual zonal mean opaque cloud cover are also correlated (-0.95). The new diagnostics introduced here are implemented within a simulator framework to enable scale-aware and definition-aware evaluation of the LMDZ5B global climate model. The evaluation shows that the model overestimates opaque cloud cover (31% obs. versus 38% model) and z_opaque (3.2 km obs. versus 5.1 km model). In contrast, the model underestimates thin cloud cover (35% obs. versus 14% model). Further assessment shows that reasonable agreement between modeled and observed longwave cloud radiative effects results from compensating errors between insufficient warming by thin clouds and excessive warming due to overestimating both z_opaque and opaque cloud cover. This work shows the power of spaceborne lidar observations to directly constrain cloud-radiation interactions in both observations and models.

  4. Increasing Reliability of Direct Observation Measurement Approaches in Emotional and/or Behavioral Disorders Research Using Generalizability Theory

    ERIC Educational Resources Information Center

    Gage, Nicholas A.; Prykanowski, Debra; Hirn, Regina

    2014-01-01

    Reliability of direct observation outcomes ensures the results are consistent, dependable, and trustworthy. Typically, reliability of direct observation measurement approaches is assessed using interobserver agreement (IOA) and the calculation of observer agreement (e.g., percentage of agreement). However, IOA does not address intraobserver…

  5. Increasing Reliability of Direct Observation Measurement Approaches in Emotional and/or Behavioral Disorders Research Using Generalizability Theory

    ERIC Educational Resources Information Center

    Gage, Nicholas A.; Prykanowski, Debra; Hirn, Regina

    2014-01-01

    Reliability of direct observation outcomes ensures the results are consistent, dependable, and trustworthy. Typically, reliability of direct observation measurement approaches is assessed using interobserver agreement (IOA) and the calculation of observer agreement (e.g., percentage of agreement). However, IOA does not address intraobserver…

  6. Diversity of sub-bandgap states in lead-sulfide nanocrystals: real-space spectroscopy and mapping at the atomic-scale

    NASA Astrophysics Data System (ADS)

    Gervasi, Christian F.; Kislitsyn, Dmitry A.; Allen, Thomas L.; Hackley, Jason D.; Maruyama, Ryuichiro; Nazin, George V.

    2015-11-01

    Colloidal semiconductor nanocrystals have emerged as a promising class of technological materials with optoelectronic properties controllable through quantum-confinement effects. Despite recent successes in this field, an important factor that remains difficult to control is the impact of the nanocrystal surface structure on the photophysics and electron transport in nanocrystal-based materials. In particular, the presence of surface defects and irregularities can result in the formation of localized sub-bandgap states that can dramatically affect the dynamics of charge carriers and electronic excitations. Here we use Scanning Tunneling Spectroscopy (STS) to investigate, in real space, sub-bandgap states in individual ligand-free PbS nanocrystals. In the majority of studied PbS nanocrystals, spatial mapping of electronic density of states with STS shows atomic-scale variations attributable to the presence of surface reconstructions. STS spectra show that the presence of surface reconstructions results in formation of surface-bound sub-bandgap electronic states. The nature of the surface reconstruction varies depending on the surface stoichiometry, with lead-rich surfaces producing unoccupied sub-bandgap states, and sulfur-rich areas producing occupied sub-bandgap states. Highly off-stoichiometric areas produce both occupied and unoccupied states showing dramatically reduced bandgaps. Different reconstruction patterns associated with specific crystallographic directions are also found for different nanocrystals. This study provides insight into the mechanisms of sub-bandgap state formation that, in a modified form, are likely to be applicable to ligand-passivated nanocrystal surfaces, where steric hindrance between ligands can result in under-coordination of surface atoms.Colloidal semiconductor nanocrystals have emerged as a promising class of technological materials with optoelectronic properties controllable through quantum-confinement effects. Despite recent

  7. SPICA infrared coronagraph for the direct observation of exo-planets

    NASA Astrophysics Data System (ADS)

    Enya, Keigo; Spica Working Group

    2010-04-01

    We present a mid-infrared coronagraph to target the direct observation of extrasolar planets, for Space Infrared telescope for Cosmology and Astrophysics (SPICA). SPICA is a proposed JAXA-ESA mission, which will carry a telescope cooled to 5 K with a 3.5 m diameter aperture, and is planned to be launched in 2018 by an H II family rocket. The SPICA mission gives us a unique opportunity for high-contrast observations because of the large telescope aperture, the simple pupil shape, and the capability for infrared observations from space. We have commenced studies for a coronagraph for SPICA, in which this coronagraph is currently regarded as an option of the focal plane instruments. The primary target of the SPICA coronagraph is the direct observation of Jovian exo-planets. A strategy of the baseline survey and the specifications for the coronagraph instrument for the survey are introduced together. The main wavelengths and the contrast required for the observations are 3.5-27 μm, and 10 -6, respectively. Laboratory experiments were performed with a visible laser to demonstrate the principles of the coronagraphs. In an experiment using binary-shaped pupil coronagraphs, a contrast of 6.7 × 10 -8 was achieved, as derived from the linear average in the dark region and the core of the point spread function (PSF). A coronagraph by a binary-shaped pupil mask is a baseline solution for SPICA because of its feasibility and robustness. On the other hand, a laboratory experiment of the phase induced amplitude apodization/binary-mask hybrid coronagraph has been executed to obtain an option of higher performance (i.e., smaller inner working angle and higher throughput), and a contrast of 6.5 × 10 -7 was achieved with active wavefront control. Potentially important by-product of the instrument, transit monitoring for characterization of exo-planets, is also described. We also present recent progress of technology on a design of a binary-shaped pupil mask for the actual pupil of

  8. Enhancing management of tuberculosis treatment with video directly observed therapy in New York City.

    PubMed

    Chuck, C; Robinson, E; Macaraig, M; Alexander, M; Burzynski, J

    2016-05-01

    Directly observed therapy (DOT), the standard of care for monitoring patients on treatment for tuberculosis (TB), requires substantial health department resources, and can be inconvenient and disruptive for patients. To determine whether video technology for remote observation of patients on anti-tuberculosis treatment (VDOT) is as effective as in-person DOT. Eligible TB patients in New York City were prospectively enrolled in VDOT from September 2013 to September 2014. We compared treatment outcomes and worker output for VDOT and in-person DOT. Among 390 patients on DOT for the treatment of TB, 61 (16%) were on VDOT and 329 (84%) on in-person DOT. Adherence to scheduled VDOT sessions was 95% (3292/3455) compared to 91% (32 204/35 442) with in-person DOT (>P < 0.01). VDOT enabled a DOT worker to observe a maximum of 25 patients per day, similar to DOT workers who observed patients in clinic (n = 25), but twice that of DOT workers who observed patients in the community (n = 12). Treatment completion with VDOT was similar to that with in-person DOT (96% vs. 97%, P = 0.63). The primary problems encountered during VDOT sessions were interruption of video and audio connectivity. Implementation of VDOT resulted in successful anti-tuberculosis treatment outcomes while maximizing health department resources.

  9. Directly observed daily mouth care provided to care home residents in one area of Kent, UK.

    PubMed

    Zander, A; Boniface, D

    2017-03-01

    To gather accurate data on the daily mouth care provided in care homes including tooth brushing, oral health assessment, and recording of care provided. Direct observation and notes review. Both nursing and 'regular' care homes. 365 Residents living in 16 care homes and their carers underwent observation, notes review or data collection in some form. Provision of mouth morning care. Of 161 residents observed, most (93, 58%) did not have their teeth/dentures brushed. If performed, brushing was often carried out by the resident themselves (36 cases, 53%), rather than by a carer (32 cases, 44%). Carers used a toothbrush to clean inside a resident's mouth in just 7 cases (4.3% of all personal care routines observed). Smaller care homes were no more likely to brush residents teeth than larger care homes, and nursing homes were no more likely to brush teeth than other care homes. Of the 309 sets of notes available for review, 41 (13%) contained a dedicated oral health needs assessment, and 109 (35%) contained a daily oral care chart in some form. Mouth care was often recorded inaccurately (15% of cases). This is the first observational study in the UK to assess oral care actually provided to residents by carers in care homes. The findings reveal a substantially different picture of daily mouth care than was previously understood and suggest that many of the nation's care home residents may not be receiving adequate, or any, oral health care.

  10. A line rate calculation method for arbitrary directional imaging of an Earth observing satellite

    NASA Astrophysics Data System (ADS)

    Jeon, Moon-Jin; Kim, Eunghyun; Lim, Seong-Bin; Choi, Seok-Weon

    2016-10-01

    For an earth observing satellite, a line rate is the number of lines which the CCD of push broom type camera scans in a second. It can be easily calculated by ground velocity divided by ground sample distance. Accurate calculation of line rate is necessary to obtain high quality image using TDI CCD. The earth observing satellite has four types of imaging missions which are strip imaging, stereo imaging, multi-point imaging, and arbitrary directional imaging. For the first three types of imaging, ground scanning direction is aligned with satellite velocity direction. Therefore, if the orbit propagation and spacecraft attitude information are available, the ground velocity and ground sample distance could be easily calculated. However, the calculation method might not be applicable to the arbitrary directional imaging. In the arbitrary directional imaging mode, the ground velocity is not fixed value which could be directly derived by orbit information. Furthermore, the ground sample distance might not be easily calculated by simple trigonometry which is possible for the other types of imaging. In this paper, we proposed a line rate calculation method for the arbitrary directional imaging. We applied spherical geometry to derive the equation of ground point which is the intersection between the line of sight vector of the camera and earth surface. The derivative of this equation for time is the ground velocity except the factor of earth rotation. By adding this equation and earth rotation factor, the true ground velocity vector could be derived. For the ground sample distance, we applied the equation of circle and ellipse for yaw angle difference. The equation of circle is used for the yaw angle representation on the plane which is orthogonal to the line of sight vector. The equation of ellipse is used for the yaw angle representation on the ground surface. We applied the proposed method to the KOMPSAT-3A (Korea Multi-Purpose Satellite 3A) mission which is the first

  11. Direct Observation of the Injection Dynamics of a Laser Wakefield Accelerator Using Few-Femtosecond Shadowgraphy.

    PubMed

    Sävert, A; Mangles, S P D; Schnell, M; Siminos, E; Cole, J M; Leier, M; Reuter, M; Schwab, M B; Möller, M; Poder, K; Jäckel, O; Paulus, G G; Spielmann, C; Skupin, S; Najmudin, Z; Kaluza, M C

    2015-07-31

    We present few-femtosecond shadowgraphic snapshots taken during the nonlinear evolution of the plasma wave in a laser wakefield accelerator with transverse synchronized few-cycle probe pulses. These snapshots can be directly associated with the electron density distribution within the plasma wave and give quantitative information about its size and shape. Our results show that self-injection of electrons into the first plasma-wave period is induced by a lengthening of the first plasma period. Three-dimensional particle-in-cell simulations support our observations.

  12. Directly observed interaction within adolescent romantic relationships: What have we learned?

    PubMed Central

    Welsh, Deborah P; Shulman, Shmuel

    2008-01-01

    Review and conceptual analysis of the papers in this special issue calls attention to several important methodological and conceptual issues surrounding the direct observation of adolescent romantic couples. It also provides an important new foundation of knowledge about the nature of adolescents' romantic relationships. Connections with previous family relationships, new understandings of the distinctive nature of adolescent romantic relationships, and gender issues are clarified by this body of papers. Together, these papers move the scholarly field forward and generate new lines of questions for future investigators. PMID:18986697

  13. The 'semitorrid' gas observed in the direction of Gamma-2 Velorum and the Gum nebula

    NASA Technical Reports Server (NTRS)

    Bruhweiler, F. C.; Kondo, J.; Mccluskey, G. E., Jr.

    1979-01-01

    On the basis of recent IUE observations in the far-ultraviolet, the authors report the detection of a 'semitorrid' region of the interstellar medium in the direction of Gamma-2 Velorum and the Gum nebula. The characteristic temperature of this gas is in the 40,000 K range, between the warm (around 1000 K) and hot (roughly 100,000-1,000,000 K) regions reported by various investigators. This temperature is compatible with the theoretical temperature ascribed to the 'fossil Stromgren sphere' by Brandt et al. and Alexander et al.

  14. Direct observation of nodes and twofold symmetry in FeSe superconductor.

    PubMed

    Song, Can-Li; Wang, Yi-Lin; Cheng, Peng; Jiang, Ye-Ping; Li, Wei; Zhang, Tong; Li, Zhi; He, Ke; Wang, Lili; Jia, Jin-Feng; Hung, Hsiang-Hsuan; Wu, Congjun; Ma, Xucun; Chen, Xi; Xue, Qi-Kun

    2011-06-17

    We investigated the electron-pairing mechanism in an iron-based superconductor, iron selenide (FeSe), using scanning tunneling microscopy and spectroscopy. Tunneling conductance spectra of stoichiometric FeSe crystalline films in their superconducting state revealed evidence for a gap function with nodal lines. Electron pairing with twofold symmetry was demonstrated by direct imaging of quasiparticle excitations in the vicinity of magnetic vortex cores, Fe adatoms, and Se vacancies. The twofold pairing symmetry was further supported by the observation of striped electronic nanostructures in the slightly Se-doped samples. The anisotropy can be explained in terms of the orbital-dependent reconstruction of electronic structure in FeSe.

  15. Direct Observations of Silver Nanoink Sintering and Eutectic Remelt Reaction with Copper

    SciTech Connect

    Elmer, J. W.; Specht, Eliot D

    2010-01-01

    Ag nanoink sintering kinetics and subsequent melting is studied using in-situ synchrotron based x-ray diffraction. Direct observations of Ag nanoink sintering on Cu demonstrate its potential for materials joining since the Ag nanoink sinters at low temperatures but melts at high temperatures. Results show low expansion coefficient of sintered Ag, non-linear expansion as Ag densifies and interdiffuses with Cu above 500 C, remelting consistent with bulk Ag, and eutectic reaction with Cu demonstrating its usefulness as a high temperature bonding medium

  16. Direct Observation of the Controlled Magnetization Reversal Processes in Py/Al/Py Assymmetric Ring Stacks

    SciTech Connect

    Huang, L.; Schofield, M.A.; Zhu, Y.

    2009-07-27

    Electron holographic experiments were performed to study the magnetization reversal process of patterned Py/Al/Py (20nm/20nm/10nm) asymmetric ring stacks. By changing the in-plane field applied perpendicular to the ring's symmetric axis, we directly observed the vortex-based magnetization reversal process through controlled domain wall motion and annihilation. The two magnetic layers were found to switch at different critical fields, leading to the existence of various distinct domain state combinations. Quantitative agreement was obtained between measured phase shifts and those derived from micromagnetic calculations, which allows us to resolve the layer-by-layer magnetic behavior as a function of applied external field.

  17. Directly observed interaction within adolescent romantic relationships: What have we learned?

    PubMed

    Welsh, Deborah P; Shulman, Shmuel

    2008-12-01

    Review and conceptual analysis of the papers in this special issue calls attention to several important methodological and conceptual issues surrounding the direct observation of adolescent romantic couples. It also provides an important new foundation of knowledge about the nature of adolescents' romantic relationships. Connections with previous family relationships, new understandings of the distinctive nature of adolescent romantic relationships, and gender issues are clarified by this body of papers. Together, these papers move the scholarly field forward and generate new lines of questions for future investigators.

  18. Direct observation of {beta}-TaH phase precipitation in tantalum{endash}hydrogen solid solution

    SciTech Connect

    Chen, C.L.; Zhou, D.S.; Mitchell, T.E.; Ye, H.Q.

    1996-07-01

    An ordered {beta}-Ta{sub 2}H tantalum hydride precipitate and a disordered {alpha}-Ta{endash}H solid solution matrix have been observed directly by field ion microscopy and analyzed by atom probe analysis. The ordered and disordered field ion images have been explained by the electronic transition rate in the theory of field ionization. On the other hand, we found surprisingly that the field evaporation voltage dramatically decreased to approximately one half of its original evaporation voltage as the evaporation of the precipitate moves toward the phase boundary, which may due to the effects of the interface energy. {copyright} {ital 1996 American Vacuum Society}

  19. Direct Observation of Charge Transfer in Double-Perovskite-Like RbMn[Fe(CN)6

    NASA Astrophysics Data System (ADS)

    Kato, K.; Moritomo, Y.; Takata, M.; Sakata, M.; Umekawa, M.; Hamada, N.; Ohkoshi, S.; Tokoro, H.; Hashimoto, K.

    2003-12-01

    The charge density distribution has been determined for a transition metal cyanide, RbMn[Fe(CN)6], by means of the maximum entropy Rietveld method combined with the highly angularly resolved synchrotron radiation x-ray powder diffraction at SPring-8 BL02B2. We directly observed a charge transfer from the Mn site to the Fe site in the low-temperature phase. On the basis of a local density approximation calculation, we discuss the origin for the anisotropic bonding electron distribution around the Mn3+ ion in the low-temperature phase.

  20. Direct observation of enhanced magnetic moments in Fe/Ag(100)

    NASA Astrophysics Data System (ADS)

    Wooten, C. L.; Chen, J.; Mulhollan, G. A.; Erskine, J. L.; Markert, J. T.

    1994-04-01

    The magnetic properties of ultrathin (1-5 monolayer) Fe films on Ag(100) substrates were investigated using SQUID magnetometry. Films were grown in pairs (one bulklike, the other thin), and characterized in situ by low-energy electron diffraction, Auger spectroscopy, and the surface magneto-optic Kerr effect. The films were than capped with Au and studied with a SQUID magnetometer over the temperature range 2-340 K. We report here a direct observation of enhanced magnetic moments for Fe on Ag(100), with interface moments enhanced as much as 29%.