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Sample records for medium dynamics surface

  1. The dynamic deformation of a layered viscoelastic medium under surface excitation

    PubMed Central

    Aglyamov, Salavat R.; Wang, Shang; Karpiouk, Andrei B.; Li, Jiasong; Twa, Michael; Emelianov, Stanislav Y.; Larin, Kirill V.

    2015-01-01

    In this study the dynamic behavior of a layered viscoelastic medium in response to the harmonic and impulsive acoustic radiation force applied to its surface was investigated both theoretically and experimentally. An analytical solution for a layered viscoelastic compressible medium in frequency and time domains was obtained using the Hankel transform. A special incompressible case was considered to model soft biological tissues. To verify our theoretical model, experiments were performed using tissue-like gel-based phantoms with varying mechanical properties. A 3.5 MHz single-element focused ultrasound transducer was used to apply the radiation force at the surface of the phantoms. A phase-sensitive optical coherence tomography (OCT) system was used to track the displacements of the phantom surface. Theoretically predicted displacements were compared with experimental measurements. The role of the depth dependence of the elastic properties of a medium in its response to an acoustic pulse at the surface was studied. It was shown that the low-frequency vibrations at the surface are more sensitive to the deep layers than high-frequency ones. Therefore, the proposed model in combination with spectral analysis can be used to evaluate depth-dependent distribution of the mechanical properties based on the measurements of the surface deformation. PMID:25974168

  2. Molecular dynamics study of oil detachment from an amorphous silica surface in water medium

    NASA Astrophysics Data System (ADS)

    Chen, Jiaxuan; Si, Hao; Chen, Wenyang

    2015-10-01

    In this paper, the mechanism of oil detachment from optical glass in water medium is studied by using molecular dynamics simulation. At the beginning, some undecane molecules are adsorbed on the amorphous silica surface to get contaminated glass. Upon addition of 6000 water molecules, most of the undecane molecules on the substrate surface can be detached from an amorphous silica surface through three stages. The formation of different directions of water channels is vital for oil detachment. The electrostatic interaction of water substrate contributes to disturbing the aggregates of undecane molecules and the H-bonding interaction between the water molecules is helpful for the oil puddle away from the substrate. However, there is still some oil molecules residue on the substrate surface after water cleaning. The simulation results showed that the specific ring potential well of amorphous silica surface will hinder the detachment of oil molecules. We also find that the formation of the specific ring potential well is related to the number of atoms and the average radius in silica atomic rings. Increasing the upward lift force, which acts on the hydrocarbon tail of oil molecules, will be benefit to clear the oil pollution residues from the glass surface.

  3. Computational fluid dynamic modeling of a medium-sized surface mine blasthole drill shroud

    PubMed Central

    Zheng, Y.; Reed, W.R.; Zhou, L.; Rider, J.P.

    2016-01-01

    The Pittsburgh Mining Research Division of the U.S. National Institute for Occupational Safety and Health (NIOSH) recently developed a series of models using computational fluid dynamics (CFD) to study airflows and respirable dust distribution associated with a medium-sized surface blasthole drill shroud with a dry dust collector system. Previously run experiments conducted in NIOSH’s full-scale drill shroud laboratory were used to validate the models. The setup values in the CFD models were calculated from experimental data obtained from the drill shroud laboratory and measurements of test material particle size. Subsequent simulation results were compared with the experimental data for several test scenarios, including 0.14 m3/s (300 cfm) and 0.24 m3/s (500 cfm) bailing airflow with 2:1, 3:1 and 4:1 dust collector-to-bailing airflow ratios. For the 2:1 and 3:1 ratios, the calculated dust concentrations from the CFD models were within the 95 percent confidence intervals of the experimental data. This paper describes the methodology used to develop the CFD models, to calculate the model input and to validate the models based on the experimental data. Problem regions were identified and revealed by the study. The simulation results could be used for future development of dust control methods for a surface mine blasthole drill shroud. PMID:27932851

  4. The dynamics of the water droplet impacting onto hot solid surfaces at medium Weber numbers

    NASA Astrophysics Data System (ADS)

    Mitrakusuma, Windy H.; Kamal, Samsul; Indarto; Dyan Susila, M.; Hermawan; Deendarlianto

    2017-10-01

    The effects of the wettability of a droplet impacting onto a hot solid surface under medium Weber numbers were studied experimentally. The Weber numbers used in the present experiment were 52.1, 57.6, and 63.1. Three kinds of solid surfaces with different wettability were used. These were normal stainless steel (NSS), TiO2 coated NSS, and TiO2 coated NSS radiated with ultraviolet rays. The surface temperatures were varied from 60 to 200 °C. The image of side the view and 30° from horizontal were taken to explain the spreading and the interfacial behavior of a single droplet during impact the hot solid surfaces. It was found that under medium Weber numbers, the surface wettability plays an important role on the droplet spreading and evaporation time during the impact on the hot solid surfaces. The higher the wettability, the larger the droplet spreading on the hot surface, and the lower the evaporation time.

  5. On the nonlinear dynamics of a saline boundary layer formed by throughflow near the surface of a porous medium

    NASA Astrophysics Data System (ADS)

    Pieters, G. J. M.; Schuttelaars, H. M.

    2008-12-01

    We consider gravitational instability of saline boundary layers, observed at the subsurface of salt lakes. This boundary layer is the result of the convective transport induced by the evaporation at the horizontal surface of a confined porous medium. When this upward transport is balanced by salt dispersion, a steady state boundary layer is formed. However, this boundary layer can be unstable when perturbed. This results in complex groundwater motion and density fields. The aim of this paper is to investigate the existence of finite amplitude solutions describing these resulting patterns (both the number of solutions and their structure), their stability, and their dependency on the system Rayleigh and Péclet numbers. For this purpose we construct a low-dimensional dynamical system (a reduced model) by projecting the nonlinear model equations onto a relatively small set of eigenfunctions of the problem linearized at criticality. The Galerkin projection approach is complicated by the fact that the problem under consideration is non-self-adjoint due to the existing evaporation. This implies that the eigenfunctions do not form an orthogonal set and therefore the adjoint eigenfunctions are used for the projection. The reduced model is constructed in such a way that it is capable of providing solutions in the strongly nonlinear regime as well. Convergence of these solutions towards the fully nonlinear model results is shown by means of direct numerical simulations. Further, the reduced model seems to partly capture the complex nonlinear behavior as seen in Hele-Shaw experiments by Wooding et al. [R.A. Wooding, S.W. Tyler, I. White, P.A. Anderson, Convection in groundwater below an evaporating salt lake: 2. evolution of fingers or plumes, Water Resour. Res. 33 (6) (1997) 1219-1228]. The physical transition mechanism that explains the occurrence of some observed bifurcation types is presented as well.

  6. Dynamics of the interstellar medium

    NASA Technical Reports Server (NTRS)

    Jenkins, Edward B.

    1990-01-01

    An extraordinarily rich assortment of electronic transitions of atoms and ions at ultraviolet wavelengths can be exploited to probe the behavior of interstellar gases in different contexts. The Copernicus and IUE (International Ultraviolet Explorer) satellites are used to investigate dynamical phenomena and important physical interactions which develop in separate phases of the medium. Insights on the establishment and overall properties of the mechanical energy created by stellar winds and supernova explosions at specific locations are outlined. Investigations of how multiple sources of energy move the gas and mold its structure over both small and large scales are outlined.

  7. Particle dynamics in an active medium

    SciTech Connect

    Schaechter, L.

    1997-03-01

    When a point-charge moves in an active medium it can gain energy at the expense of that stored in the medium. The maximum gradient is evaluated and its relation to the energy stored in the medium is established. The dynamics of a distribution of electrons was also examined and it is reported here. {copyright} {ital 1997 American Institute of Physics.}

  8. Increasing the Thermal Conductivity of Graphene-Polyamide-6,6 Nanocomposites by Surface-Grafted Polymer Chains: Calculation with Molecular Dynamics and Effective-Medium Approximation.

    PubMed

    Gao, Yangyang; Müller-Plathe, Florian

    2016-02-25

    By employing reverse nonequilibrium molecular dynamics simulations in a full atomistic resolution, the effect of surface-grafted chains on the thermal conductivity of graphene-polyamide-6.6 (PA) nanocomposites has been investigated. The interfacial thermal conductivity perpendicular to the graphene plane is proportional to the grafting density, while it first increases and then saturates with the grafting length. Meanwhile, the intrinsic in-plane thermal conductivity of graphene drops sharply as the grafting density increases. The maximum overall thermal conductivity of nanocomposites appears at an intermediate grafting density because of these two competing effects. The thermal conductivity of the composite parallel to the graphene plane increases with the grafting density and grafting length which is attributed to better interfacial coupling between graphene and PA. There exists an optimal balance between grafting density and grafting length to obtain the highest interfacial and parallel thermal conductivity. Two empirical formulas are suggested, which quantitatively account for the effects of grafting length and density on the interfacial and parallel thermal conductivity. Combined with effective medium approximation, for ungrafted graphene in random orientation, the model overestimates the thermal conductivity at low graphene volume fraction (f < 10%) compared with experiments, while it underestimates it at high graphene volume fraction (f > 10%). For unoriented grafted graphene, the model matches the experimental results well. In short, this work provides some valuable guides to obtain the nanocomposites with high thermal conductivity by grafting chain on the surface of graphene.

  9. Mathematical Model of Porous Medium Dynamics

    NASA Astrophysics Data System (ADS)

    Gerschuk, Peotr; Sapozhnikov, Anatoly

    1999-06-01

    Semiempirical model describing porous material strains under pulse mechanical and thermal loadings is proposed. Porous medium is considered as continuous one but with special form of pressure dependence upon strain. This model takes into account principal features of porous materials behavior which can be observed when the material is strained in dynamic and static experiments ( non-reversibility of large strains, nonconvexity of loading curve). Elastoplastic properties of porous medium, its damages when it is strained and dynamic fracture are also taken into account. Dispersion of unidirectional motion caused by medium heterogeneity (porousness) is taken into acount by introducing the physical viscosity depending upon pores size. It is supposed that at every moment of time pores are in equilibrium with pressure i.e. kinetic of pores collapse is not taken into account. The model is presented by the system of differential equations connecting pressure and energy of porous medium with its strain. These equations close system of equations of motion and continuity which then is integrated numerically. The proposed model has been tested on carbon materials and porous copper . Results of calculation of these materials shock compressing are in satisfactory agreement with experimental data. Results of calculation of thin plate with porous copper layer collision are given as an illustration.

  10. Dynamics at Surfaces

    SciTech Connect

    Sylvia Ceyer, Nancy Ryan Gray

    2010-05-04

    The 2009 Gordon Conference on Dynamics at Surfaces is the 30th anniversary of a meeting held every two years that is attended by leading researchers in the area of experimental and theoretical dynamics at liquid and solid surfaces. The conference focuses on the dynamics of the interaction of molecules with either liquid or solid surfaces, the dynamics of the outermost layer of liquid and solid surfaces and the dynamics at the liquid-solid interface. Specific topics that are featured include state-to-state dynamics, non-adiabatic interactions in molecule-metal systems, photon induced desorption from semiconductor and metal surfaces, ultrafast x-ray and electron diffraction as probes of the dynamics of ablation, ultrafast vibrational spectroscopy of water surface dynamics, dynamics of a single adsorbate, growth at nano-scale mineral surfaces, dynamics of atom recombination on interstellar dust grains and the dynamics of the interaction of water with lipid bilayers. The conference brings together investigators from a variety of scientific disciplines including chemistry, physics, materials science, geology and biophysics.

  11. Formation of induced surface heterogeneity in a rarefied gas medium

    SciTech Connect

    Borisov, S.F.; Kochnev, A.A.; Kulev, A.N.; Shestakov, A.M.; Shveikin, G.P.

    1987-11-01

    Induced surface heterogeneity caused by gas adsorption exerts a substantial effect on the surface properties of a solid. In this work, in order to study the dynamics of metal surface coverage in vacuum caused by adsorption of components of the residual gas medium, an experimental approach has been realized that is based on a combination of the spark method with Auger electron spectroscopy of the surface. The choice of thin tungsten filament as the object of investigation was due to the wide use of similar samples in thermal experiments, particularly in measuring the accomodation coefficient of the energy of gaseous molecules. Preliminary thermal desorption experiments at approx. 300/sup 0/K established that mainly H/sub 2/ and N/sub 2/ were adsorbed on the surface. Adsorption of H/sub 2/O, CH/sub 4/, CO/sub 2/, and D/sub 2/ constituted a substantially smaller fraction.

  12. Erosion dynamics of a wet granular medium.

    PubMed

    Lefebvre, Gautier; Jop, Pierre

    2013-09-01

    Liquid may give strong cohesion properties to a granular medium, and confer a solidlike behavior. We study the erosion of a fixed circular aggregate of wet granular matter subjected to a flow of dry grains inside a half-filled rotating drum. During the rotation, the dry grains flow around the fixed obstacle. We show that its diameter decreases linearly with time for low liquid content, as wet grains are pulled out of the aggregate. This erosion phenomenon is governed by the properties of the liquids. The erosion rate decreases exponentially with the surface tension while it depends on the viscosity to the power -1. We propose a model based on the force fluctuations arising inside the flow, explaining both dependencies: The capillary force acts as a threshold and the viscosity controls the erosion time scale. We also provide experiments using different flowing grains, confirming our model.

  13. Cavitation dynamics in a viscoelastic medium with nonlinear elasticity

    NASA Astrophysics Data System (ADS)

    Gaudron, Renaud; Johnsen, Eric

    2013-11-01

    Past methods for modeling the dynamics of a spherical cavitation bubble in a viscoelastic medium (e.g., soft tissue) usually assume the elasticity to be linear. In this work, we develop a general framework to study cavitation in nonlinear (visco)elastic media, which are expected to be more accurate for large-amplitude bubble oscillations. By following an approach based on deformation tensors and Cauchy stresses, the models presented here not only take into account the usual viscous, inertial, pressure and surface tension effects, but also complex nonlinear elasticity directly derived from specific strain-energy functions. The present results are consistent with past studies of linear viscoelasticity, but additional elastic terms with different exponents emerge in the bubble dynamics equation (e.g., Rayleigh-Plesset) for more complicated strain-energy functions. Key quantities in cavitation dynamics (bubble natural frequency, minimum radius, etc.) are reported for the neo-Hookean model, the simplest nonlinear elastic model. This approach also readily leads to a full description of the physical variables of the medium where the bubble oscillates (pressure, strain/strain rate, stress, etc.).

  14. Tear film dynamics: modeling the glycocalyx as a porous medium

    NASA Astrophysics Data System (ADS)

    Siddique, Javed; Mastroberardinob, , Antonio; Braun, Richard; Anderson, Daniel

    2015-11-01

    The human tear film is a complex fluid structure composed of multiple layers: an aqueous layer that comprises most of the film and an outermost thinner lipid layer coat a forest of large transmembrane mucins at the epithelial surface. The glycocalyx helps provide stability to the ocular surface by assisting the tear film to wet it. It is also permeable to water, but less so to ions. We formulate a thin film model based on lubrication theory in order to understand the dynamics between the aqueous layer and the glycocalyx, which we treat as a rigid porous medium. We present numerical solutions for the evolution of the tear film and discuss the roles played by the key parameters of the system. This work was supported by the Simons Foundation Grant No. 281839.

  15. Dynamic equations of a prestressed magnetoelectroelastic medium

    NASA Astrophysics Data System (ADS)

    Belyankova, T. I.; Kalinchuk, V. V.

    2016-09-01

    The constitutive relations of nonlinear mechanics of a magnetoelectroelastic medium subjected to initial mechanical stresses are linearized in the framework of material (Lagrangian) coordinates. The final expressions are constructed independently of the choice of curvilinear coordinates and are represented in a form convenient for theoretical and applied studies. The constitutive relations for the motion of a prestressed magnetoelectroelastic medium are given in rectangular Cartesian coordinates. The influence of the initial mechanical stresses on piezomagnetoelectric materials of the class 6mm is studied.

  16. Structure and Dynamics of the Interstellar Medium

    NASA Astrophysics Data System (ADS)

    Tenorio-Tagle, Guillermo; Moles, Mariano; Melnick, Jorge

    Here for the first time is a book that treats practically all aspects of modern research in interstellar matter astrophysics. 20 review articles and 40 carefully selected and refereed papers give a thorough overview of the field and convey the flavor of enthusiastic colloquium discussions to the reader. The book includes sections on: - Molecular clouds, star formation and HII regions - Mechanical energy sources - Discs, outflows, jets and HH objects - The Orion Nebula - The extragalactic interstellar medium - Interstellar matter at high galactic latitudes - The structure of the interstellar medium

  17. Dynamics of osmosis in a porous medium

    PubMed Central

    Cardoso, Silvana S. S.; Cartwright, Julyan H. E.

    2014-01-01

    We derive from kinetic theory, fluid mechanics and thermodynamics the minimal continuum-level equations governing the flow of a binary, non-electrolytic mixture in an isotropic porous medium with osmotic effects. For dilute mixtures, these equations are linear and in this limit provide a theoretical basis for the widely used semi-empirical relations of Kedem & Katchalsky (Kedem & Katchalsky 1958 Biochim. Biophys. Acta 27, 229–246 (doi:10.1016/0006-3002(58)90330-5), which have hitherto been validated experimentally but not theoretically. The above linearity between the fluxes and the driving forces breaks down for concentrated or non-ideal mixtures, for which our equations go beyond the Kedem–Katchalsky formulation. We show that the heretofore empirical solute permeability coefficient reflects the momentum transfer between the solute molecules that are rejected at a pore entrance and the solvent molecules entering the pore space; it can be related to the inefficiency of a Maxwellian demi-demon. PMID:26064566

  18. Pulse dynamics in an unstable medium

    SciTech Connect

    Balmforth, N.J.; Ierley, G.R.; Worthing, R.

    1997-02-01

    A study is presented of a one-dimensional, nonlinear partial differential equation that describes evolution of dispersive, long wave instability. The solutions, under certain specific conditions, take the form of trains of well-separated pulses. The dynamics of such patterns of pulses is investigated using singular perturbation theory and numerical simulation. These tools permit the formulation of a theory of pulse interaction and enable the mapping out of the range of behavior in parameter space. There are regimes in which steady trains form; such states can be studied with the asymptotic, pulse-interaction theory. In other regimes, pulse trains are unstable to global, wavelike modes or radiation. This can precipitate more violent phenomena involving pulse creation or generate oscillating states which may follow Shil`nikov`s route to temporal chaos. The asymptotic theory is generalized to take some account of radiative dynamics. In the limit of small dispersion, steady trains largely cease to exist; the system follows various pathways to temporal complexity, and typical bifurcation sequences are sketched out. The investigation guides one to a critical appraisal of the asymptotic theory and uncovers the wealth of different types of behavior present in the system.

  19. Nanomotor dynamics in a chemically oscillating medium

    SciTech Connect

    Robertson, Bryan Kapral, Raymond

    2015-04-21

    Synthetic nanomotors powered by chemical reactions have potential uses as cargo transport vehicles in both in vivo and in vitro applications. In many situations, motors will have to operate in out-of-equilibrium complex chemically reacting media, which supply fuel to the motors and remove the products they produce. Using molecular simulation and mean-field theory, this paper describes some of the new features that arise when a chemically powered nanomotor, operating through a diffusiophoretic mechanism, moves in an environment that supports an oscillatory chemical reaction network. It is shown how oscillations in the concentrations in chemical species in the environment give rise to oscillatory motor dynamics. More importantly, since the catalytic reactions on the motor that are responsible for its propulsion couple to the bulk phase reaction network, the motor can change its local environment. This process can give rise to distinctive spatiotemporal structures in reaction-diffusion media that occur as a result of active motor motion. Such locally induced nonequilibrium structure will play an important role in applications that involve motor dynamics in complex chemical media.

  20. Pulse dynamics in an unstable medium

    SciTech Connect

    Balmforth, N.J.; Ierley, G.R.; Worthing, R.

    1995-05-01

    A study is presented of a one-dimensional, nonlinear partial differential equation that describes evolution of dispersive, long-wave instability. The solutions, under certain specific conditions, take the form of trains of well-separated pulses. The dynamics of such patterns of pulses is investigated using singular perturbation theory and with numerical simulation. These tools permit the formulation of a theory of pulse interaction, and enable the mapping out of the range of behavior in parameter space. There are regimes in which steady trains form; such states can be studied with the asymptotic, pulse-interaction theory. In other regimes, pulse trains are unstable to global, wave-like modes or its radiation. This can precipitate more violent phenomena involving pulse creation, or generate periodic states which may follow Shil`nikov`s route to temporal chaos. The asymptotic theory is generalized lo take some account of radiative dynamics. In the limit of small dispersion, steady trains largely cease to exist; the system follows various pathways to temporal complexity and typical-bifurcation sequences are sketched out. The investigation guides us to a critical appraisal of the asymptotic theory and uncovers the wealth of different types of behavior present in the system.

  1. Dynamics of Brownian motors in deformable medium

    NASA Astrophysics Data System (ADS)

    Woulaché, Rosalie Laure; Kepnang Pebeu, Fabrice Maxime; Kofané, Timoléon C.

    2016-10-01

    The directed transport in a one-dimensional overdamped, Brownian motor subjected to a travelling wave potential with variable shape and exposed to an external bias is studied numerically. We focus our attention on the class of Remoissenet-Peyrard parametrized on-site potentials with slight modification, whose shape can be varied as a function of a parameter s, recovering the sine-Gordon shape as the special case. We demonstrate that in the presence of the travelling wave potential the observed dynamical properties of the Brownian motor which crucially depends on the travelling wave speed, the intensity of the noise and the external load is significantly influenced also by the geometry of the system. In particular, we notice that systems with sharp wells and broad barriers favour the transport under the influence of an applied load. The efficiency of transport of Brownian motors in deformable systems remains equal to 1 (in the absence of an applied load) up to a critical value of the travelling wave speed greater than that of the pure sine-Gordon shape.

  2. Storage Medium Affects the Surface Porosity of Dental Cements.

    PubMed

    Saghiri, M Ali; Shabani, Asal; Asatourian, Armen; Sheibani, Nader

    2017-08-01

    Calcium silicate-based cements physical properties is influenced by environmental changes. Here, we intended to evaluate the effect of storage medium on surface porosity of root Mineral Trioxide Aggregate (MTA) and Biodentine cement. A total of 40 polyethylene tubes were selected and divided into two groups: Group A (MTA) and Group B (Biodentine). Each group was subdivided into two subgroups (n=10). In subgroups A1 and B1, tubes were transferred to Distilled Water (DW), while samples of subgroup A2 and B2 were transferred to Synthetic Tissue Fluid (STF) as storage medium and samples were stored for three days. All specimens were then placed in a desiccator for 24 hours and then subject to surface porosity evaluation by Scanning Electron Microscopy (SEM) at ×500, ×1000, ×2000 and ×5000 magnifications. The number and the surface porosities were determined by Image J analysis. Data were analyzed by ANOVA at level of significance of p<0.05. The lowest surface porosity was observed in MTA samples stored in STF and the highest was in Biodentine samples stored in DW. Significant differences were noted between groups and subgroups of each group (p< 0.05). MTA samples stored in DW and STF showed significantly lower surface porosities compared to Biodentine samples (p < 0.05). Storage medium can drastically affect the surface porosity of tested calcium silicate-based cements. However, MTA showed lower surface porosity compared to Biodentine cement, which can result in lower microleakage in applied area.

  3. Dynamic scheduling of medium-grained processes on multicomputers

    SciTech Connect

    Wei, S.; Kale, L.V. )

    1989-01-01

    This book presents a scheme for dynamic scheduling of medium-grained processes. The basic scheme and its adaptive extensions are described, and contrasted with two other schemes that have been proposed. The performance of all the three schemes on a 64 processor IPSC/2 hypercube is presented and analyzed. The experimental results are shown.

  4. Dynamic vapor sorption isotherms of medium grain rice varieties

    USDA-ARS?s Scientific Manuscript database

    It is known that the two popular medium rice varieties, namely M202 and M206, in California have different fissuring resistances. Therefore, the main goal of this study was to investigate the sorption behavior of these two varieties by a new approach using dynamic vapor sorption (DVS) method for elu...

  5. Analysis of Surface Waves in an Elastic Medium with Aquifer

    NASA Astrophysics Data System (ADS)

    Kon'kov, A. I.; Lebedev, A. V.; Razin, A. V.

    2016-09-01

    We study propagation of seismoacoustic waves in a three-layer medium consisting of a homogeneous isotropic solid deformable layer loaded on a uniform liquid layer above a homogeneous isotropic solid half-space. This medium models a geological section in which the top soil layer is separated from the deep rock by an aquifer. The dispersion relation is obtained and analyzed, and its solutions for cases that are important from the practical point of view are presented. Features of the dispersion curves and spatial distribution of the mode fields made it possible not only to reveal the existence of an aquifer under the top soil layer, but also determine its thickness and depth. It is shown that the ratio of vertical and horizontal components of the displacement vector measured on the Earth's surface is a significant parameter for solving the geological medium reconstruction problem.

  6. Effective reconstruction of dynamics of medium response spectrum

    NASA Astrophysics Data System (ADS)

    Trofimov, Vyacheslav A.; Varentsova, Svetlana A.

    2008-10-01

    A new algorithm is suggested to visualize the dynamics of medium response spectrum in terahertz diapason by the singly measured set of partially intersected integral characteristics of the signal. The algorithm is based on SVD method and window sliding method. The analysis, we carried out, demonstrates many advantages of the new algorithm in com-parison with the Gabor-Fourier approach, which allows obtaining the dynamics of only one spectral line for one set of measurements. Among which it is necessary to mention the possibility to get the dynamics of many spectral components simultaneously for one set of measurements as well and therefore to get the complete information about the spectrum dynamics. This allows to identify specific materials with known spectral lines and to distinguish materials with similar spectra, which is of great importance for the detection and identification of different chemicals, pharmaceutical substances and explosives. To demonstrate the efficiency of a proposed algorithm, we compare spectrum dynamics of chocolate and soap, which possess the similar spectra. Our investigation shows that their dynamics widely vary in spec-tral lines. The proposed algorithm can be also applied to voice identification and to reconstruction of a laser beam profile with a great number of local maxima. Developed algorithm allows to measure the characteristic time of medium responce. It is very important for various problems of spectroscopy.

  7. Dynamic electrowetting on microstructured surfaces

    NASA Astrophysics Data System (ADS)

    Nita, Satoshi; Wang, Jiayu; Do-Quang, Minh; Chen, Yu-Chung; Suzuki, Yuji; Amberg, Gustav; Shiomi, Junichiro

    2015-11-01

    Surface modification such as surface charging or microstructuring has been shown as an effective method to control static wetting, but its influence on dynamic wetting is still unclear. Previously, we found that the initial stage of droplet spreading can be significantly hindered by surface microstructures, while previous experiments showed that the effect of surface charge on dynamic wetting on a flat surface is minor. Here, we combine microstructuring and electrowetting to further enhance the controllability of the dynamic wetting. Microstructures are fabricated on silicon wafers and the spontaneous spreading of a droplet is imaged with a high-speed camera. We reveal that the spreading rate sensitivity to surface charge increases in the presence of microstructures. Furthermore, numerical simulations solving Cahn-Hilliard/Navier-Stokes equations are performed and the effect of surface modification is quantified in terms of the contact-line friction. This work was financially supported in part by the Japan Science and Technology Agency through CREST.

  8. Dynamical friction for supersonic motion in a homogeneous gaseous medium

    NASA Astrophysics Data System (ADS)

    Thun, Daniel; Kuiper, Rolf; Schmidt, Franziska; Kley, Wilhelm

    2016-05-01

    Context. The supersonic motion of gravitating objects through a gaseous ambient medium constitutes a classical problem in theoretical astrophysics. Its application covers a broad range of objects and scales from planetesimals, planets, and all kind of stars up to galaxies and black holes. In particular, the dynamical friction caused by the wake that forms behind the object plays an important role for the dynamics of the system. To calculate the dynamical friction for a particular system, standard formulae based on linear theory are often used. Aims: It is our goal to check the general validity of these formulae and provide suitable expressions for the dynamical friction acting on the moving object, based on the basic physical parameters of the problem: first, the mass, radius, and velocity of the perturber; second, the gas mass density, soundspeed, and adiabatic index of the gaseous medium; and finally, the size of the forming wake. Methods: We perform dedicated sequences of high-resolution numerical studies of rigid bodies moving supersonically through a homogeneous ambient medium and calculate the total drag acting on the object, which is the sum of gravitational and hydrodynamical drag. We study cases without gravity with purely hydrodynamical drag, as well as gravitating objects. In various numerical experiments, we determine the drag force acting on the moving body and its dependence on the basic physical parameters of the problem, as given above. From the final equilibrium state of the simulations, for gravitating objects we compute the dynamical friction by direct numerical integration of the gravitational pull acting on the embedded object. Results: The numerical experiments confirm the known scaling laws for the dependence of the dynamical friction on the basic physical parameters as derived in earlier semi-analytical studies. As a new important result we find that the shock's stand-off distance is revealed as the minimum spatial interaction scale of

  9. Force distribution in a granular medium under dynamic loading

    NASA Astrophysics Data System (ADS)

    Danylenko, Vyacheslav A.; Mykulyak, Sergiy V.; Polyakovskyi, Volodymyr O.; Kulich, Vasyl V.; Oleynik, Ivan I.

    2017-07-01

    Force distribution in a granular medium subjected to an impulse loading is investigated in experiment and computer simulations. An experimental technique is developed to measure forces acting on individual grains at the bottom of the granular sample consisting of steel balls. Discrete element method simulation also is performed under conditions mimicking those in experiment. Both theory and experiment display exponentially decaying maximum force distributions at the bottom of the sample in the range of large forces. In addition, the simulations also reveal exponential force distribution throughout the sample and uncover correlation properties of the interparticle forces during dynamic loading of the granular samples. Simulated time dependence of coordination number, orientational order parameter, correlation radius, and force distribution clearly demonstrates the nonequilibrium character of the deformation process in a granular medium under impulse loading.

  10. Comparison of Dey and Engley (D/E) neutralizing medium to Letheen medium and standard methods medium for recovery of Staphylococcus aureus from sanitized surfaces.

    PubMed

    Dey, B P; Engley, F B

    1995-01-01

    The ability of Dey and Engley (D/E) Neutralizing Medium to recover Staphylococcus aureus ATCC 6538 from tile surfaces exposed to a commercial phenol (Mikro-Bac) and a quaternary ammonium compound (Mikro-Quat) was compared to recovery with Letheen Medium. Standard Methods Medium was used as a control recovery medium. Organisms were exposed to both antimicrobials for varying time periods, then were recovered by swab and Rodac plate on both test media. The recovery by either procedure was significantly higher with Dey and Engley (D/E) Neutralizing Medium than with Letheen and Standard Methods Medium. The D/E Medium shows promise for evaluating antimicrobial chemicals used in environmental sanitation.

  11. Medium-term dynamics of a middle Adriatic barred beach

    NASA Astrophysics Data System (ADS)

    Postacchini, Matteo; Soldini, Luciano; Lorenzoni, Carlo; Mancinelli, Alessandro

    2017-09-01

    In recent years, attention has been paid to beach protection by means of soft and hard defenses. Along the Italian coast of the Adriatic Sea, sandy beaches are the most common landscape feature and around 70 % of the Marche region's coast (central Adriatic) is protected by defense structures. The longest free-from-obstacle nearshore area in the region includes the beach of Senigallia, frequently monitored in the last decades and characterized by a multiple bar system, which represents a natural beach defense. The bathymetries surveyed in 2006, 2010, 2011, 2012 and 2013 show long-term stability, confirmed by a good adaptation of an analyzed stretch of the beach to the Dean-type equilibrium profile, though a strong short- to medium-term variability of the wave climate has been observed during the monitored periods. The medium-term dynamics of the beach, which deal with the evolution of submerged bars and are of the order of years or seasons, have been related to the wave climate collected, during the analyzed temporal windows, by a wave buoy located about 40 km off Senigallia. An overall interpretation of the hydrodynamics, sediment characteristics and seabed morphology suggests that the wave climate is fundamental for the morphodynamic changes of the beach in the medium term. These medium-term time ranges during which waves mainly come from NNE/ESE are characterized by a larger/smaller steepness and by a larger/smaller relative wave height, and seem to induce seaward/shoreward bar migration as well as bar smoothing/steepening. Moving southeastward, the bar dimension increases, while the equilibrium profile shape suggests the adaptation to a decreasing sediment size in the submerged beach. This is probably due to the presence of both the harbor jetty and river mouth north of the investigated area.

  12. Surface and Near Surface Dynamics on Phobos

    NASA Astrophysics Data System (ADS)

    Hamelin, M.

    2008-12-01

    Phobos as a few small satellites in the solar system is orbiting around its primary inside the Roche limit. Therefore the surface material is loosely bounded and easily ejected by impactors. Whereas dynamics in the close vicinity of Phobos has been studied for both geophysical and navigation reasons, the dynamics on the surface itself has not been studied to the same extent. The gravitational field used here is the ellipsoidal model of Davis, 1981, that describes as well the past and future Phobos as it gets closer to Mars. We look at the trajectory of a test mass for any initial position and velocity. It can exhibit an unusual shape: for some initial positions a gliding test mass released with zero velocity can take off over some distance! Generally the trajectories are not 'down hill' as the motion is strongly dependent on the velocity. We discuss the consequences for material transport on or close to the surface, with in particular the possibility that some of the Phobos groves could have been dug out by rolling blocks.

  13. Towards an optical "black hole": surface reshaping for an optimal optical coupling into turbid medium

    NASA Astrophysics Data System (ADS)

    Thompson, Jonathan V.; Hokr, Brett H.; Yakovlev, Vladislav V.

    2017-02-01

    Light propagation in a turbid medium is typically considered for flat or regular surfaces. However, such an approximation often does not reflect an experimental reality, and, in this report, we attempt to optimize the surface of a scattering medium to improve the optical coupling into the medium. By making conical microchannels in a turbid medium using short-pulsed laser micro-drilling, we show that we were able to substantially increase the photon life-time and diffusion radius in the medium.

  14. Nanoparticle growth and surface chemistry changes in cell-conditioned culture medium

    PubMed Central

    Kendall, Michaela; Hodges, Nikolas J.; Whitwell, Harry; Tyrrell, Jess; Cangul, Hakan

    2015-01-01

    When biomolecules attach to engineered nanoparticle (ENP) surfaces, they confer the particles with a new biological identity. Physical format may also radically alter, changing ENP stability and agglomeration state within seconds. In order to measure which biomolecules are associated with early ENP growth, we studied ENPs in conditioned medium from A549 cell culture, using dynamic light scattering (DLS) and linear trap quadrupole electron transfer dissociation mass spectrometry. Two types of 100 nm polystyrene particles (one uncoated and one with an amine functionalized surface) were used to measure the influence of surface type. In identically prepared conditioned medium, agglomeration was visible in all samples after 1 h, but was variable, indicating inter-sample variability in secretion rates and extracellular medium conditions. In samples conditioned for 1 h or more, ENP agglomeration rates varied significantly. Agglomerate size measured by DLS was well correlated with surface sequestered peptide number for uncoated but not for amine coated polystyrene ENPs. Amine-coated ENPs grew much faster and into larger agglomerates associated with fewer sequestered peptides, but including significant sequestered lactose dehydrogenase. We conclude that interference with extracellular peptide balance and oxidoreductase activity via sequestration is worthy of further study, as increased oxidative stress via this new mechanism may be important for cell toxicity. PMID:25533102

  15. Surface structure determines dynamic wetting

    PubMed Central

    Wang, Jiayu; Do-Quang, Minh; Cannon, James J.; Yue, Feng; Suzuki, Yuji; Amberg, Gustav; Shiomi, Junichiro

    2015-01-01

    Liquid wetting of a surface is omnipresent in nature and the advance of micro-fabrication and assembly techniques in recent years offers increasing ability to control this phenomenon. Here, we identify how surface roughness influences the initial dynamic spreading of a partially wetting droplet by studying the spreading on a solid substrate patterned with microstructures just a few micrometers in size. We reveal that the roughness influence can be quantified in terms of a line friction coefficient for the energy dissipation rate at the contact line, and that this can be described in a simple formula in terms of the geometrical parameters of the roughness and the line-friction coefficient of the planar surface. We further identify a criterion to predict if the spreading will be controlled by this surface roughness or by liquid inertia. Our results point to the possibility of selectively controlling the wetting behavior by engineering the surface structure. PMID:25683872

  16. The dynamic mathematical model of heavy-medium cyclone

    SciTech Connect

    Xu Jianping

    1997-12-31

    For ascertaining the effect of the various variables during the coal separation process of heavy medium (HM) cyclone, a dynamic mathematical model for simulating the separating process of the HM cyclone has been developed based on data obtained through both laboratory and industrial experiments. As evidenced by the result of study, increase to a certain extent of inlet pressure and media-coal ratio may result in higher separating precision. The effect of rheological property of the suspension is particularly important, and often plays a decisive role in this respect. The research-derived model can either be used for predicting the separating process and performance or for effecting process control of a HM cyclone through simulating its operation.

  17. Dynamic lossless polarization gate using a coherently prepared atomic medium.

    PubMed

    Wu, J X; Zhu, Chengjie; Yang, Y P

    2015-11-01

    We propose a dynamic lossless all-optical polarization gate using coherently prepared atomic media. We show that the loss/gain of two circularly polarized components of a linearly polarized probe field can be simultaneously eliminated by locking the power of the pump field and the external magnetic field intensity simultaneously. Using the polarization selective Kerr phase shift method, we can write π/2 (-π/2) phase shift to the right (left) circularly polarized component of the linearly polarized probe field with a choice of "magic" wavelength for the probe field. Consequently, the linear polarization state for the probe field acquires a 90° rotation at the exit of the medium. The scheme proposed in this Letter is helpful for applications in optical and quantum information processing and computation.

  18. Anderson Localization: Dynamical Cluster Approximation - Typical Medium Theory Perspective

    NASA Astrophysics Data System (ADS)

    Ekuma, Chinedu; Meng, Ziyang; Terletska, Hanna; Moreno, Juana; Jarrell, Mark; Dobrosavljevic, Vladimir

    2013-03-01

    Mean field theories like the coherent potential approximation (CPA) and its cluster extensions, including the dynamical cluster approximation (DCA), fail to describe the Anderson localization transition in disordered systems. This failure is intrinsic to these theories as the algebraically averaged quantities used in them always favor the metallic state, and hence cannot describe the localization transition. Here we extend the Typical Medium Theory (TMT), which replaces the average quantities with their corresponding typical (geometrically averaged) equivalents, to its cluster form such that non-local correlations can be incorporated systematically. We apply our method to study the localization phenomena in various dimensions. Such an approach opens a new avenue to study localization effect both in model and in real materials. This work was supported by the National Science Foundation (NSF) [Award No. LA-SiGMA EPS-1003897, DMR-1005751], Department of Energy, DOE-CMCSN

  19. Optical Surface Transformation: Changing the optical surface by homogeneous optic-null medium at will

    PubMed Central

    Sun, Fei; He, Sailing

    2015-01-01

    A new theory on designing electromagnetic/optical devices is proposed, namely, an optical surface transformation (OST). One arbitrary surface can establish the corresponding relationship with another surface entirely optically with an optic-null medium (ONM), (i.e. the electromagnetic wave propagates from one surface to its equivalent surface without any phase delay). Many novel optical devices can be designed by an OST with the help of an ONM. Compared with traditional devices designed by Transformation Optics, our optical surface-reshaping devices have two main advantages. Firstly, the design process is very simple (i.e. we do not need to consider any mathematics on how to make a coordinate transformation, and what we need to do is simply to design the shapes of the input and the output surfaces of the devices). Secondly, we only need one homogeneous anisotropic medium to realize all devices designed by this method. Our method will explore a new way to design novel optical devices without considering any coordinate transformations. PMID:26515406

  20. Dynamical Modeling of Surface Tension

    NASA Technical Reports Server (NTRS)

    Brackbill, Jeremiah U.; Kothe, Douglas B.

    1996-01-01

    In a recent review it is said that free-surface flows 'represent some of the difficult remaining challenges in computational fluid dynamics'. There has been progress with the development of new approaches to treating interfaces, such as the level-set method and the improvement of older methods such as the VOF method. A common theme of many of the new developments has been the regularization of discontinuities at the interface. One example of this approach is the continuum surface force (CSF) formulation for surface tension, which replaces the surface stress given by Laplace's equation by an equivalent volume force. Here, we describe how CSF formulation might be made more useful. Specifically, we consider a derivation of the CSF equations from a minimization of surface energy as outlined by Jacqmin (1996). This reformulation suggests that if one eliminates the computation of curvature in terms of a unit normal vector, parasitic currents may be eliminated. For this reformulation to work, it is necessary that transition region thickness be controlled. Various means for this, in addition to the one discussed by Jacqmin (1996), are discussed.

  1. Dynamics of a Particle in a Viscoelastic Medium with Conformable Derivative

    NASA Astrophysics Data System (ADS)

    Chung, Won Sang; Hassanabadi, Hassan

    2017-03-01

    In this paper we use the conformable derivative to study the dynamics of a particle in a viscoelastic medium. We discuss two examples. One is the resisted horizontal motion of a particle in a viscoelastic medium and another is the resisted horizontal motion of a particle in a viscoelastic medium with a uniform force F 0.

  2. Dynamics of Nanostructures at Surfaces

    SciTech Connect

    Schmid, Andreas K.

    2001-02-28

    Currently, much effort is being devoted to the goal of achieving useful nanotechnologies, which depend on the ability to control and manipulate things on a very small scale. One promising approach to the construction of nanostructures is 'self-assembly', which means that under suitable conditions desired nanostructures might form automatically due to physical and chemical forces. Remarkably, the forces controlling such self-assembly mechanisms are only poorly understood, even though highly successful examples of self-assembly are known in nature (e.g., complex biochemical machinery regularly self-assembles in the conditions inside living cells). This talk will highlight basic measurements of fundamental forces governing the dynamics of nanostructures at prototypical metal surfaces. We use advanced surface microscopy techniques to track the motions of very small structures in real time and up to atomic resolution. One classic example of self-organized nanostructures are networks of surface dislocations (linear crystal defects). The direct observation of thermally activated atomic motions of dislocations in a reconstructed gold surface allows us to measure the forces stabilizing the remarkable long-range order of this nanostructure. In another example, the rapid migration of nano-scale tin crystals deposited on a pure copper surface was traced to an atomic repulsion between tin atoms absorbed on the crystal surface and bronze alloy formed in the footprint of the tin crystals. It is intriguing to consider the clusters as simple chemo-mechanical energy transducers, essentially tiny linear motors built of 100,000 Sn atoms. We can support this view by providing estimates of the power and energy-efficiency of these nano-motors.

  3. Multimodal dynamic imaging of therapeutic biomedical coatings in aqueous medium.

    PubMed

    Dong, Jinping; Foley, John D; Frethem, Chris D; Hoerr, Robert A; Matuszewski, Michael J; Puskas, Judit E; Haugstad, Greg

    2009-05-19

    Drug release from therapeutic biomedical films such as drug-polymer composite coatings on drug eluting stents is a highly complex and poorly understood process. The dynamics of drug release and the evolution of surface morphology during release have direct impact on the performance of the device. This information is not easily accessible, and there have been few systematic studies to investigate drug release from biomedical coatings in real time. In this study, the complementary analytical techniques of confocal Raman microscopy, in-liquid atomic force microscopy, scanning electron microscopy, and high performance liquid chromatography were used to examine real-time mobilization and release of the drug rapamycin from polyisobutylene-block-polystyrene thin films, during immersion in buffered saline for 12 h. Each technique was found to have distinct limitations in either temporal or spatial resolution; in combination, however, the overlapping techniques provided a level of detail that is not available using any single approach.

  4. Melting Properties of Medium-Sized Silicon Nanoclusters: A Molecular Dynamics Study

    NASA Astrophysics Data System (ADS)

    Li, Haipeng; Xu, Runfeng; Bi, Zetong; Shen, Xiaopeng; Han, Kui

    2017-07-01

    The structures and melting properties of the medium-sized silicon nanoclusters have been comparatively studied using the molecular dynamics method. Structural and thermodynamic parameters are used to characterize the melting properties of the clusters. The size dependence of the melting temperature of silicon nanoclusters is determined using the computation results. Different from the homogeneous melting of bulk silicon, melting of silicon nanoparticles proceeds over a finite temperature range due to surface effects, which shows the heterogeneous melting of nanoclusters. We found that the melting starts at the cluster surface and progressively shifts into the core region. This study provides a fundamental perspective on the melting behaviors of semiconductor silicon nanoclusters at the atomistic level.

  5. Melting Properties of Medium-Sized Silicon Nanoclusters: A Molecular Dynamics Study

    NASA Astrophysics Data System (ADS)

    Li, Haipeng; Xu, Runfeng; Bi, Zetong; Shen, Xiaopeng; Han, Kui

    2016-11-01

    The structures and melting properties of the medium-sized silicon nanoclusters have been comparatively studied using the molecular dynamics method. Structural and thermodynamic parameters are used to characterize the melting properties of the clusters. The size dependence of the melting temperature of silicon nanoclusters is determined using the computation results. Different from the homogeneous melting of bulk silicon, melting of silicon nanoparticles proceeds over a finite temperature range due to surface effects, which shows the heterogeneous melting of nanoclusters. We found that the melting starts at the cluster surface and progressively shifts into the core region. This study provides a fundamental perspective on the melting behaviors of semiconductor silicon nanoclusters at the atomistic level.

  6. Surface dielectric relaxation: probing technique and its application to thermal activation dynamics of polymer surface.

    PubMed

    Ishii, Masashi

    2010-09-01

    For dynamic analyses of a polymer surface, a dielectric relaxation measurement technique with parallel electrodes placed away from the surface was developed. In this technique, a liquid heating medium was filled in the space between the polymer surface and the electrodes. The construction that maintains the surface can clarify the physical interactions between the liquid and the bare surface and controlling the temperature of the liquid reveals the thermal activation property of the surface. The dielectric relaxation spectrum of the surface convoluted into the bulk and liquid spectra can be obtained by a reactance analysis and the surface spectrum is expressed with an equivalent resistance-capacitance parallel circuit. On the basis of the electromechanical analogy, the electric elements can be converted into mechanical elements that indicate the viscoelasticity of the polymer surface. Using these measurement and analysis techniques, the electric and mechanical properties of the surface of a gelatinized chloroprene rubber sample were analyzed.

  7. Dynamic contact angle measurements on superhydrophobic surfaces

    NASA Astrophysics Data System (ADS)

    Kim, Jeong-Hyun; Kavehpour, H. Pirouz; Rothstein, Jonathan P.

    2015-03-01

    In this paper, the dynamic advancing and receding contact angles of a series of aqueous solutions were measured on a number of hydrophobic and superhydrophobic surfaces using a modified Wilhelmy plate technique. Superhydrophobic surfaces are hydrophobic surfaces with micron or nanometer sized surface roughness. These surfaces have very large static advancing contact angles and little static contact angle hysteresis. In this study, the dynamic advancing and dynamic receding contact angles on superhydrophobic surfaces were measured as a function of plate velocity and capillary number. The dynamic contact angles measured on a smooth hydrophobic Teflon surface were found to obey the scaling with capillary number predicted by the Cox-Voinov-Tanner law, θD3 ∝ Ca. The response of the dynamic contact angle on the superhydrophobic surfaces, however, did not follow the same scaling law. The advancing contact angle was found to remain constant at θA = 160∘, independent of capillary number. The dynamic receding contact angle measurements on superhydrophobic surfaces were found to decrease with increasing capillary number; however, the presence of slip on the superhydrophobic surface was found to result in a shift in the onset of dynamic contact angle variation to larger capillary numbers. In addition, a much weaker dependence of the dynamic contact angle on capillary number was observed for some of the superhydrophobic surfaces tested.

  8. Modification of Surface Density of a Porous Medium

    NASA Technical Reports Server (NTRS)

    Stackpoole, Margaret M. (Inventor); Espinoza, Christian (Inventor)

    2016-01-01

    A method for increasing density of a region of a porous, phenolic bonded ("PPB") body adjacent to a selected surface to increase failure tensile strength of the adjacent region and/or to decrease surface recession at elevated temperatures. When the surface-densified PPB body is brought together with a substrate, having a higher failure tensile strength, to form a composite body with a PPB body/substrate interface, the location of tensile failure is moved to a location spaced apart from the interface, the failure tensile strength of the PPB body is increased, and surface recession of the material at elevated temperature is reduced. The method deposits and allows diffusion of a phenolic substance on the selected surface. The PPB body and the substrate may be heated and brought together to form the composite body. The phenolic substance is allowed to diffuse into the PPB body, to volatilize and to cure, to provide a processed body with an increased surface density.

  9. Dynamics of a vortex filament in a stratified medium

    SciTech Connect

    Popov, P. V.; Romanov, A. S.; Chukbar, K. V.

    2009-03-15

    The behavior of a vortex filament in a perfectly conducting stratified medium is analyzed. It is shown that the equation describing oscillations of a straight filament is linear, but becomes substantially non-linear with increasing inclination angle. Effects related to the finite radius of the vortex core are considered, and dispersion relations for linear oscillations of a vortex column are derived.

  10. Dynamic Defrosting on Nanostructured Superhydrophobic Surfaces

    SciTech Connect

    Boreyko, Jonathan B.; Srijanto, Bernadeta R.; Nguyen, Trung Dac; Vega, Carlos; Fuentes-Cabrera, Miguel; Collier, C. Patrick

    2013-07-03

    Water suspended on chilled superhydrophobic surfaces exhibits delayed freezing; however, the interdrop growth of frost through subcooled condensate forming on the surface seems unavoidable in humid environments. It is therefore of great practical importance to determine whether facile defrosting is possible on superhydrophobic surfaces. Here in this paper, we report that nanostructured superhydrophobic surfaces promote the growth of frost in a suspended Cassie state, enabling its dynamic removal upon partial melting at low tilt angles (<15°). The dynamic removal of the melting frost occurred in two stages: spontaneous dewetting followed by gravitational mobilization. This dynamic defrosting phenomenon is driven by the low contact angle hysteresis of the defrosted meltwater relative to frost on microstructured superhydrophobic surfaces, which forms in the impaled Wenzel state. Dynamic defrosting on nanostructured superhydrophobic surfaces minimizes the time, heat, and gravitational energy required to remove frost from the surface, and is of interest for a variety of systems in cold and humid environments.

  11. Nonlinear Wave-Packet Dynamics in a Disordered Medium

    SciTech Connect

    Schwiete, G.; Finkel'stein, A. M.

    2010-03-12

    We develop an effective theory of pulse propagation in a nonlinear and disordered medium in two dimensions. The theory is formulated in terms of a nonlinear diffusion equation. Despite its apparent simplicity this equation describes novel phenomena which we refer to as 'locked explosion' and diffusive collapse. The equation can be applied to such distinct physical systems as laser beams propagating in disordered photonic crystals or Bose-Einstein condensates expanding in a disordered environment.

  12. Determining Pore Pressures Along a Slip Surface Within a Saturated Elastic-Plastic Porous Medium

    NASA Astrophysics Data System (ADS)

    Viesca, R. C.; Rice, J. R.; Dunham, E. M.

    2008-12-01

    Here we consider shear rupture along a slip surface in a fluid-saturated elastic-plastic porous medium, like in landslide and earthquake modeling, and assume that there are different poro-elasto-plastic response properties on the two sides of the slip surface. This different response may be because the fault bordering materials are dissimilar, or just because one side is actively yielding and the other is not, or is yielding but in a different mode. In effect, we are representing a core about a slip surface that divides two similar or contrasting materials. This representation is especially relevant in earthquake rupture dynamics. Studies of mature fault zones have noted a trend of fractured host rock extending 10--100m from the fault, with an ultracataclastic core ~100mm about or to one side of the principal slip surface (e.g., Chester and Chester, Tectonophys, 1998; Chester et al., Columbia Univ Pr, 2004). Furthermore, there is likely to exist a material contrast that may come from accumulating km of slip and a bias in accumulated damage. The local pore pressure at the slip surface influences the rupture dynamics because, through the effective stress concept, it controls the local shear strength along the fault, a feature neglected as a simplification in our preliminary poro-elasto-plastic modeling of dynamic rupture (Viesca et al., JGR, 2008). To determine pore pressures at the slip surface under locally elastic-plastic response, we must consider pore pressure discontinuities about that surface that arise in an undrained treatment of off-fault material and their amelioration within resulting thin diffusive boundary layers, such that pore pressure and fluid mass flux in the normal direction are continuous at the slip surface. Our approach builds on previous work considering the effect of contrasts in poroelastic properties on rupture propagation (Rudnicki and Rice, JGR, 2006; Dunham and Rice, JGR, 2008). Here we find expressions for the undrained pore pressure

  13. Additional effective medium parameters for composite materials (excess surface currents).

    PubMed

    Vinogradov, A P; Ignatov, A I; Merzlikin, A M; Tretyakov, S A; Simovski, C R

    2011-03-28

    Modified boundary conditions for composite material are suggested. The modified RT-retrieval procedure yields bulk values of effective impedance and refractive index, which are independent of system size and boundary realization, whereas the conductivities of the excess surface currents depend on the property of the interface. Simultaneous treatment of all the possible realizations of the system removes the dependence. The accuracy of the latter procedure is the same as the usage of static effective parameters, namely k(eff)d.

  14. Dynamics of filament formation in a Kerr medium

    SciTech Connect

    Centurion, Martin; Pu Ye; Tsang, Mankei; Psaltis, Demetri

    2005-06-15

    We have studied the large-scale beam breakup and filamentation of femtosecond pulses in a Kerr medium. We have experimentally monitored the formation of stable light filaments, conical emission, and interactions between filaments. Three major stages lead to the formation of stable light filaments: First the beam breaks up into a pattern of connected lines (constellation), then filaments form on the constellations, and finally the filaments release a fraction of their energy through conical emission. We observed a phase transition to a faster filamentation rate at the onset of conical emission. We attribute this to the interaction of conical emissions with the constellation which creates additional filaments. Numerical simulations show good agreement with the experimental results.

  15. Nonuniversal surface behavior of dynamic phase transitions

    NASA Astrophysics Data System (ADS)

    Riego, Patricia; Berger, Andreas

    2015-06-01

    We have studied the dynamic phase transition (DPT) of the kinetic Ising model in systems with surfaces within the mean-field approximation. Varying the surface exchange coupling strength Js, the amplitude of the externally applied oscillating field h0, and its period P , we explore the dynamic behavior of the layer-dependent magnetization and the associated DPTs. The surface phase diagram shows several features that resemble those of the equilibrium case, with an extraordinary bulk transition and a surface transition for high Js values, independent from the value of h0. For low Js, however, h0 is found to be a crucial parameter that leads to nonuniversal surface behavior at the ordinary bulk transition point. Specifically, we observed here a bulk-supported surface DPT for high field amplitudes h0 and correspondingly short critical periods Pc, whereas this surface transition simultaneous to the bulk one is suppressed for slow critical dynamics occurring for low values of h0. The suppression of the DPT for low h0 not only occurs for the topmost surface layer, but also affects a significant number of subsurface layers. We find that the key physical quantity that explains this nonuniversal behavior is the time correlation between the dynamic surface and bulk magnetizations at the bulk critical point. This time correlation has to pass a threshold value to trigger a bulk-induced DPT in the surface layers. Otherwise, dynamic phase transitions are absent at the surface in stark contrast to the equilibrium behavior of the corresponding thermodynamic Ising model. Also, we have analyzed the penetration depth of the dynamically ordered phase for the surface DPT that occurs for large Js values. Here we find that the penetration depth depends strongly on Js and behaves identically to the corresponding equilibrium Ising model.

  16. Uncertainty and Sensitivity in Surface Dynamics Modeling

    NASA Astrophysics Data System (ADS)

    Kettner, Albert J.; Syvitski, James P. M.

    2016-05-01

    Papers for this special issue on 'Uncertainty and Sensitivity in Surface Dynamics Modeling' heralds from papers submitted after the 2014 annual meeting of the Community Surface Dynamics Modeling System or CSDMS. CSDMS facilitates a diverse community of experts (now in 68 countries) that collectively investigate the Earth's surface-the dynamic interface between lithosphere, hydrosphere, cryosphere, and atmosphere, by promoting, developing, supporting and disseminating integrated open source software modules. By organizing more than 1500 researchers, CSDMS has the privilege of identifying community strengths and weaknesses in the practice of software development. We recognize, for example, that progress has been slow on identifying and quantifying uncertainty and sensitivity in numerical modeling of earth's surface dynamics. This special issue is meant to raise awareness for these important subjects and highlight state-of-the-art progress.

  17. Crowds as an Excitable Medium for Spiral Wave Dynamics

    NASA Astrophysics Data System (ADS)

    Welsh, Andrea; Greco, Edwin; Fenton, Flavio

    Spiral wave (SW) patterns are studied in many physical, biological, and chemical excitable systems. Of particular importance are SW of electrical activity that develop in the heart and give rise to arrhythmias such as tachycardia (single SW) and fibrillation (multiple SWs). We investigate if a crowd of people given simple rules for activation and deactivation, modeled on cardiac cells, can act as a living simulation for SW dynamics. For group sizes ranging from 50 to 650 people we demonstrate, experimentally, the existence of stable spiral waves and of spiral wave breakup leading to chaotic dynamics. Numerical simulation predicts the simple rules lead to well define wave fronts. People, however, respond with various degrees of anticipation and misinformation. This human behavior can lead to smoothed fronts or even lead to spiral wave breakup and chaos. We present a new cell model that includes variations in reaction to account for the observed behavior in crowds. This model may be useful in the study of coupling and decoupling of cardiac cells that lead to arrhythmic behavior. Supported by NSF.

  18. Backscattering of linearly polarized light from turbid tissue-like scattering medium with rough surface

    NASA Astrophysics Data System (ADS)

    Doronin, Alexander; Tchvialeva, Lioudmila; Markhvida, Igor; Lee, Tim K.; Meglinski, Igor

    2016-07-01

    In the framework of further development of a unified computational tool for the needs of biomedical optics, we introduce an electric field Monte Carlo (MC) model for simulation of backscattering of coherent linearly polarized light from a turbid tissue-like scattering medium with a rough surface. We consider the laser speckle patterns formation and the role of surface roughness in the depolarization of linearly polarized light backscattered from the medium. The mutual phase shifts due to the photons' pathlength difference within the medium and due to reflection/refraction on the rough surface of the medium are taken into account. The validation of the model includes the creation of the phantoms of various roughness and optical properties, measurements of co- and cross-polarized components of the backscattered/reflected light, its analysis and extensive computer modeling accelerated by parallel computing on the NVIDIA graphics processing units using compute unified device architecture (CUDA). The analysis of the spatial intensity distribution is based on second-order statistics that shows a strong correlation with the surface roughness, both with the results of modeling and experiment. The results of modeling show a good agreement with the results of experimental measurements on phantoms mimicking human skin. The developed MC approach can be used for the direct simulation of light scattered by the turbid scattering medium with various roughness of the surface.

  19. The Dynamic Surface Tension of Water

    PubMed Central

    2017-01-01

    The surface tension of water is an important parameter for many biological or industrial processes, and roughly a factor of 3 higher than that of nonpolar liquids such as oils, which is usually attributed to hydrogen bonding and dipolar interactions. Here we show by studying the formation of water drops that the surface tension of a freshly created water surface is even higher (∼90 mN m–1) than under equilibrium conditions (∼72 mN m–1) with a relaxation process occurring on a long time scale (∼1 ms). Dynamic adsorption effects of protons or hydroxides may be at the origin of this dynamic surface tension. However, changing the pH does not significantly change the dynamic surface tension. It also seems unlikely that hydrogen bonding or dipole orientation effects play any role at the relatively long time scale probed in the experiments. PMID:28301160

  20. The Dynamic Surface Tension of Water.

    PubMed

    Hauner, Ines M; Deblais, Antoine; Beattie, James K; Kellay, Hamid; Bonn, Daniel

    2017-03-23

    The surface tension of water is an important parameter for many biological or industrial processes, and roughly a factor of 3 higher than that of nonpolar liquids such as oils, which is usually attributed to hydrogen bonding and dipolar interactions. Here we show by studying the formation of water drops that the surface tension of a freshly created water surface is even higher (∼90 mN m(-1)) than under equilibrium conditions (∼72 mN m(-1)) with a relaxation process occurring on a long time scale (∼1 ms). Dynamic adsorption effects of protons or hydroxides may be at the origin of this dynamic surface tension. However, changing the pH does not significantly change the dynamic surface tension. It also seems unlikely that hydrogen bonding or dipole orientation effects play any role at the relatively long time scale probed in the experiments.

  1. Surface waves in a magnetized ferrite slab filled with a wire medium

    NASA Astrophysics Data System (ADS)

    Nefedov, I. S.; Soloviev, A. S.; Tarot, A. C.; Abdouni, W.

    2009-06-01

    Novel metamaterial, based on wire medium embedded into magnetized ferrite, is studied. Waves in unbounded ferrites filled with wire media, surface wave at the interface of this metamaterial and the air as well as waves in a ferrite slab adjacent to a wire medium are considered. Different geometries of wires arrangement and different magnetization directions are discussed. Effective permeability was introduced for the case where both plasma and magnetic properties take place. Dispersion diagrams and applicability of the Drude model for the description of the wire medium in a host matrix, possessing high permittivity and permeability, are discussed.

  2. A study of surface and surface-volume scattering for discrete random medium in microwave remote sensing

    NASA Astrophysics Data System (ADS)

    Syahali, Syabeela Bt

    In the study of microwave remote sensing and wave propagation in a medium, it is interesting and important to model and calculate the interaction of the electromagnetic wave with the medium, as the backscattering returns from the medium will be recorded and processed to produce satellite radar images and the wave attenuation while propagating in the medium will affect the microwave and mobile communications. Traditionally, theoretical modelling of this problem assumes that the scatterers are interacting with the wave independently. However, in real nature, the coherence effect of these interactions due to the close-spacing of the scatterers cannot be ignored, especially in the case of an electrically dense medium. Traditional theoretical modelling also assumes that wave-interface effects are only due to single scattering on the surface. This is also less accurate since multiple scattering can also contribute to the effect, especially for rough surfaces. It is also assumed that the surface-volume interaction is only due to first order surface-volume scattering. However, second order surface-volume scattering is also important and should not be ignored. Therefore, a good and reliable theoretical model for wave scattering in the natural earth terrain should be developed for the use in microwave remote sensing, communications and satellite-based natural resource monitoring. In this research, the backscattering model for an electrically dense medium is developed. This model incorporates the coherent effects due to the close-spacing of the scatterers. Improvement is done by considering the multiple surface scattering effect, together with the single surface scattering effect on the surface scattering formulation based on the existing integral equation model (IEM) for both the top and the bottom surfaces of the layer of the model. The backscattering model is also improved by considering up to second order surface-volume scattering. Its effect on surface, surface

  3. Static and Dynamic Wetting Behavior of Triglycerides on Solid Surfaces.

    PubMed

    Michalski; Saramago

    2000-07-15

    Triglyceride wetting properties on solid surfaces of different hydro-phobicities were investigated using three different methods, namely, the sessile drop method for static contact angle measurements, the Wilhelmy method for dynamic contact angle measurements, and the captive bubble method to investigate thin triglyceride film stability. For solid surfaces having a surface free energy higher than the surface tension of triglycerides (tributyrin, tricaprylin, and triolein), a qualitative correlation was observed between wetting and solid/triglyceride relative hydrophobicities. On surfaces presenting extreme hydrophobic or hydrophilic properties, medium-chain triglycerides had a behavior similar to that of long-chain unsaturated ones. On a high-energy surface (glass), tricaprylin showed an autophobic effect subsequent to molecular adsorption in trident conformation on the solid, observed with the three methods. Thin triglyceride films between an air bubble and a solid surface were stable for a short time, for solids with a surface free energy larger than the triglyceride surface tension. If the solid surface had a lower surface free energy, the thin film collapsed after a time interval which increased with triglyceride viscosity. Copyright 2000 Academic Press.

  4. Dynamic contact interactions of fractal surfaces

    NASA Astrophysics Data System (ADS)

    Jana, Tamonash; Mitra, Anirban; Sahoo, Prasanta

    2017-01-01

    Roughness parameters and material properties have significant influence on the static and dynamic properties of a rough surface. In the present paper, fractal surface is generated using the modified two-variable Weierstrass-Mandelbrot function in MATLAB and the same is imported to ANSYS to construct the finite element model of the rough surface. The force-deflection relationship between the deformable rough fractal surface and a contacting rigid flat is studied by finite element analysis. For the dynamic analysis, the contacting system is represented by a single degree of freedom spring mass-damper-system. The static force-normal displacement relationship obtained from FE analysis is used to determine the dynamic characteristics of the rough surface for free, as well as for forced damped vibration using numerical methods. The influence of fractal surface parameters and the material properties on the dynamics of the rough surface is also analyzed. The system exhibits softening property for linear elastic surface and the softening nature increases with rougher topography. The softening nature of the system increases with increase in tangent modulus value. Above a certain value of yield strength the nature of the frequency response curve is observed to change its nature from softening to hardening.

  5. Formation of bubbly horizon in liquid-saturated porous medium by surface temperature oscillation.

    PubMed

    Goldobin, Denis S; Krauzin, Pavel V

    2015-12-01

    We study nonisothermal diffusion transport of a weakly soluble substance in a liquid-saturated porous medium in contact with a reservoir of this substance. The surface temperature of the porous medium half-space oscillates in time, which results in a decaying solubility wave propagating deep into the porous medium. In this system, zones of saturated solution and nondissolved phase coexist with ones of undersaturated solution. The effect is first considered for the case of annual oscillation of the surface temperature of water-saturated ground in contact with the atmosphere. We reveal the phenomenon of formation of a near-surface bubbly horizon due to temperature oscillation. An analytical theory of the phenomenon is developed. Further, the treatment is extended to the case of higher frequency oscillations and the case of weakly soluble solids and liquids.

  6. Analysis of a dense-medium separator for coarse coal separation using computational fluid dynamics

    SciTech Connect

    Peng, F.F.; Xia, Y.K.

    2007-02-15

    The raw-coal feeding system and the upward medium current flow in a dense-medium vessel (DMV) are, in addition to the residence time of particles in the separator, important factors for efficient coarse particle separation. The feed material from a raw coal screen and/or pre-wet screen merge with the major volume of circulating medium as push medium, guided by an adjustable submergence baffle plate deep fed into the separator effective separation. The remaining volume of the circulating medium enters from the purge and drain for hoppers at the bottom of the DMV. This generates a gentle upward medium current flow in the separator, which prevents dense medium stratification/settling and merges as part of the push medium. A two-dimensional, two-phase model developed using computational fluid dynamics (CFD) is used to describe the flow pattern and evaluate the function of the dip plate for understanding the mechanisms of particle separation in the separator. The particle movement in the DMV is also tracked to investigate the major operating parameters affecting the separation performance of the DMV. The simulation results of the DMV separation performance are validated by in-plant test data.

  7. Dynamic Wetting on Graphene-Coated Surface: Molecular Dynamics Investigation

    NASA Astrophysics Data System (ADS)

    Hung, Shih-Wei; Shiomi, Junichiro

    2015-11-01

    Wettability of graphene-coated surface gained significant attention recently due to discussion on the ``transparency'' (whether the wetting characteristics follow that of graphene or the underlying surface) and practical applications of graphene. In terms of static contact angle, the wettability of graphene-coated surfaces have been widely studied by experiments, simulations, and theory in recent years. However, the studies of dynamic wetting on graphene-coated surfaces are limited. In the present study, molecular dynamics simulation was performed to study the dynamic wetting of water droplet on graphene-coated surfaces from a microscopic point of view. The results show that the degree of similarity between the spreading behavior on graphene-coated surface and that on pure graphene (or that on the underlying surface) depends on time, i.e. how nonequilibrium the interface dynamics is. We also found that this feature can be altered by introducing defects into graphene. The work is partially supported by Grant-in-Aid for JSPS Fellows 26-04364 and JST CREST.

  8. Dynamics of nanoscale droplets on moving surfaces.

    PubMed

    Ritos, Konstantinos; Dongari, Nishanth; Borg, Matthew K; Zhang, Yonghao; Reese, Jason M

    2013-06-11

    We use molecular dynamics (MD) simulations to investigate the dynamic wetting of nanoscale water droplets on moving surfaces. The density and hydrogen bonding profiles along the direction normal to the surface are reported, and the width of the water depletion layer is evaluated first for droplets on three different static surfaces: silicon, graphite, and a fictitious superhydrophobic surface. The advancing and receding contact angles, and contact angle hysteresis, are then measured as a function of capillary number on smooth moving silicon and graphite surfaces. Our results for the silicon surface show that molecular displacements at the contact line are influenced greatly by interactions with the solid surface and partly by viscous dissipation effects induced through the movement of the surface. For the graphite surface, however, both the advancing and receding contact angles values are close to the static contact angle value and are independent of the capillary number; i.e., viscous dissipation effects are negligible. This finding is in contrast with the wetting dynamics of macroscale water droplets, which show significant dependence on the capillary number.

  9. Modelling Martian surface channel dynamics

    NASA Astrophysics Data System (ADS)

    Coulthard, T. J.; Skinner, C.; Kim, J.; Schumann, G.; Neal, J. C.; Bates, P. D.

    2014-12-01

    Extensive and large surface channel features found at Athabasca and Kasei have previously been attributed to the erosional power of flowing water with palaeoflood discharges being estimated from the surface channel dimensions. However, in order for these channels to be alluvial there are several basic questions to be answered. Are water flows under Martian conditions capable of eroding the amounts of sediment required to leave these channels? Are our present estimates of palaeoflood discharge of correct magnitude to carry out this erosion? And are the channels a product of one or many flood events? Here, we use a numerical model (CAESAR-Lisflood) that links a two-dimensional hydrodynamic flow scheme to a sediment transport model to simulate fluvial morphodynamics in the Athabasca and Kasei regions. CAESAR-Lisflood has been successfully applied to simulating flooding, erosion and deposition on Earth in a number of locations, and allows the development of channels, bars, braids and other fluvial features to be modelled. The numerical scheme of the model was adapted to Martian conditions by adjusting gravity, drag co-efficient, roughness and grainsize terms. Preliminary findings indicate that fluvial erosion and deposition is capable of creating mega channel features found at these sites and that existing palaeflood estimates are commensurate with channel forming discharges for these features.

  10. Dynamic Land Surface Classifcations using Microwave Frequencies

    NASA Astrophysics Data System (ADS)

    Jackson, H.; Tian, Y.; Peters-Lidard, C. D.; Harrison, K. W.

    2014-12-01

    Land surface emissivity in microwave frequencies is critical to the remote sensing of soil moisture, precipitation, and vegetation. Different land surfaces have different spectral signatures in the microwave portions of the electromagnetic spectrum. Their spatial and temporal behaviors are also highly variable. These properties are yet not well understood in microwave frequencies, despite their capability in detecting water-related variables in the atmosphere and land surface. A classification scheme was developed to stratify the Earth's land surfaces based on their seasonally dynamic microwave signatures. An unsupervised clustering approach was used identify and distinguish data groupings along two microwave based indicies. Land surface data clusters were mapped to determine their spatial relationships to known land cover groupings. Differences in land surface clusters were analyzed in their spatial consistency and their direction and magnitude of land surface change. It was found that vegetation and topography were the predominant contributors to change between seasons. Land surface extremes of sandy desert and closed canopy tropical forest displayed minimal intra-annual variability while transitional zones, such as the Sahel and North American temperate forests, exhibited the most variability. Distinct microwave signatures varied between seasons along a latittudinal gradient. Overall variability in land surface types increased at high lattitudes. This classification will help inform research studies maniputlating the microwave frequencies of the electromagnetic spectrum to better characterize land surface dynamics, and will be very useful in the validation of radiative transfer models and quantification of uncertainty in global precipitation monitoring.

  11. The Shock and Vibration Bulletin. Part 3: Structure Medium Interaction, Case Studies in Dynamics

    NASA Technical Reports Server (NTRS)

    1979-01-01

    Structure and medium interactions topics are addressed. Topics include: a failure analysis of underground concrete structures subjected to blast loadings, an optimization design procedure for concrete slabs, and a discussion of the transient response of a cylindrical shell submerged in a fluid. Case studies in dynamics are presented which include an examination of a shock isolation platform for a seasparrow launcher, a discussion of hydrofoil fatigue load environments, and an investigation of the dynamic characteristics of turbine generators and low tuned foundations.

  12. Nonadiabatic dynamics at metal surfaces: Independent-electron surface hopping

    NASA Astrophysics Data System (ADS)

    Shenvi, Neil; Roy, Sharani; Tully, John C.

    2009-05-01

    Recent experiments have shown convincing evidence for nonadiabatic energy transfer from adsorbate degrees of freedom to surface electrons during the interaction of molecules with metal surfaces. In this paper, we propose an independent-electron surface hopping algorithm for the simulation of nonadiabatic gas-surface dynamics. The transfer of energy to electron-hole pair excitations of the metal is successfully captured by hops between electronic adiabats. The algorithm is able to account for the creation of multiple electron-hole pairs in the metal due to nonadiabatic transitions. Detailed simulations of the vibrational relaxation of nitric oxide on a gold surface, employing a multistate potential energy surface fit to density functional theory calculations, confirm that our algorithm can capture the underlying physics of the inelastic scattering process.

  13. Time-domain Helmholtz-Kirchhoff integral for surface scattering in a refractive medium.

    PubMed

    Choo, Youngmin; Song, H C; Seong, Woojae

    2017-03-01

    The time-domain Helmholtz-Kirchhoff (H-K) integral for surface scattering is derived for a refractive medium, which can handle shadowing effects. The starting point is the H-K integral in the frequency domain. In the high-frequency limit, the Green's function can be calculated by ray theory, while the normal derivative of the incident pressure from a point source is formulated using the ray geometry and ray-based Green's function. For a corrugated pressure-release surface, a stationary phase approximation can be applied to the H-K integral, reducing the surface integral to a line integral. Finally, a computationally-efficient, time-domain H-K integral is derived using an inverse Fourier transform. A broadband signal scattered from a sinusoidal surface in an upwardly refracting medium is evaluated with and without geometric shadow corrections, and compared to the result from a conventional ray model.

  14. Conservative fluctuational-electromagnetic interaction of a conducting nanoparticle with a smooth surface of condensed medium

    NASA Astrophysics Data System (ADS)

    Dedkov, G. V.; Kyasov, A. A.

    2007-05-01

    General expressions for a conservative force of the fluctuational-electromagnetic interaction between a neutral spherical conducting nanoparticle and a smooth surface of condensed medium are obtained for the first time with allowance for both electric and magnetic components. The results of calculations performed for a copper particle interacting with a copper surface show that the contribution of the magnetic components is predominating for all distances from the surface exceeding the particle radius R. The contribution due to the near-surface modes, which is proportional to the temperature and inversely proportional to the cube of the distance, is predominating at distances above ˜10 R.

  15. Functional dynamics of cell surface membrane proteins

    NASA Astrophysics Data System (ADS)

    Nishida, Noritaka; Osawa, Masanori; Takeuchi, Koh; Imai, Shunsuke; Stampoulis, Pavlos; Kofuku, Yutaka; Ueda, Takumi; Shimada, Ichio

    2014-04-01

    Cell surface receptors are integral membrane proteins that receive external stimuli, and transmit signals across plasma membranes. In the conventional view of receptor activation, ligand binding to the extracellular side of the receptor induces conformational changes, which convert the structure of the receptor into an active conformation. However, recent NMR studies of cell surface membrane proteins have revealed that their structures are more dynamic than previously envisioned, and they fluctuate between multiple conformations in an equilibrium on various timescales. In addition, NMR analyses, along with biochemical and cell biological experiments indicated that such dynamical properties are critical for the proper functions of the receptors. In this review, we will describe several NMR studies that revealed direct linkage between the structural dynamics and the functions of the cell surface membrane proteins, such as G-protein coupled receptors (GPCRs), ion channels, membrane transporters, and cell adhesion molecules.

  16. Dynamical quorum-sensing in oscillators coupled through an external medium

    NASA Astrophysics Data System (ADS)

    Schwab, David J.; Baetica, Ania; Mehta, Pankaj

    2012-11-01

    Many biological and physical systems exhibit population-density-dependent transitions to synchronized oscillations in a process often termed “dynamical quorum sensing”. Synchronization frequently arises through chemical communication via signaling molecules distributed through an external medium. We study a simple theoretical model for dynamical quorum sensing: a heterogenous population of limit-cycle oscillators diffusively coupled through a common medium. We show that this model exhibits a rich phase diagram with four qualitatively distinct physical mechanisms that can lead to a loss of coherent population-level oscillations, including a novel mechanism arising from effective time-delays introduced by the external medium. We derive a single pair of analytic equations that allow us to calculate phase boundaries as a function of population density and show that the model reproduces many of the qualitative features of recent experiments on Belousov-Zhabotinsky catalytic particles as well as synthetically engineered bacteria.

  17. Cooperative dynamics in the penetration of a group of intruders in a granular medium.

    PubMed

    Pacheco-Vázquez, F; Ruiz-Suárez, J C

    2010-11-23

    An object moving in a fluid experiences a drag force that depends on its velocity, shape and the properties of the medium. From this simplest case to the motion of a flock of birds or a school of fish, the drag forces and the hydrodynamic interactions determine the full dynamics of the system. Similar drag forces appear when a single projectile impacts and moves through a granular medium, and this case is well studied in the literature. On the other hand, the case in which a group of intruders impact a granular material has never been considered. Here, we study the simultaneous penetration of several intruders in a very low-density granular medium. We find that the intruders move through it in a collective way, following a cooperative dynamics, whose complexity resembles flocking phenomena in living systems or the movement of reptiles in sand, wherein changes in drag are exploited to efficiently move or propel.

  18. Cooperative dynamics in the penetration of a group of intruders in a granular medium

    PubMed Central

    Pacheco-Vázquez, F.; Ruiz-Suárez, J.C.

    2010-01-01

    An object moving in a fluid experiences a drag force that depends on its velocity, shape and the properties of the medium. From this simplest case to the motion of a flock of birds or a school of fish, the drag forces and the hydrodynamic interactions determine the full dynamics of the system. Similar drag forces appear when a single projectile impacts and moves through a granular medium, and this case is well studied in the literature. On the other hand, the case in which a group of intruders impact a granular material has never been considered. Here, we study the simultaneous penetration of several intruders in a very low-density granular medium. We find that the intruders move through it in a collective way, following a cooperative dynamics, whose complexity resembles flocking phenomena in living systems or the movement of reptiles in sand, wherein changes in drag are exploited to efficiently move or propel. PMID:21119636

  19. Nanorod mediated surface plasmon resonance sensor based on effective medium theory

    USDA-ARS?s Scientific Manuscript database

    A novel nanorod mediated surface plasmon resonance (SPR) sensor was investigated for enhancing sensitivity of the sensor. The theoretical model containing an anisotropic layer of nanorod was investigated using four-layer Fresnel equations and effective medium theory. The properties of the nanorod me...

  20. Live Theatre: A Dynamic Medium for Engaging with Intercultural Education Research

    ERIC Educational Resources Information Center

    Nelson, Cynthia D.

    2013-01-01

    In this paper, I discuss live theatre as a highly effective and dynamic medium for facilitating meaningful engagement with research on intercultural education. I make the case that ethnographic, or research-based, theatre can productively showcase challenging social issues and the sometimes confusing, poignant and humorous complexities of…

  1. Glassy Dynamics Altered by a Free Surface

    NASA Astrophysics Data System (ADS)

    Tsui, Ophelia

    Studies of polymer dynamics in thin films showed that a highly mobile region exists at the free surface of most if not all polymers. In this talk, I shall review some of these observations, with highlights given to the recent findings that chain flexibility and connectivity may on occasions be necessary for the free surface to exercise its influence. Afterward, I shall ponder on how the influence of the free surface may penetrate as far as several polymer radii of gyration into the inner region, as found both in experiments and simulations. Near the glass transition temperature, our MD simulations showed that the dynamics consist mainly of string-like particle hopping motions, as found by others. Importantly, as the temperature decreases, the hopping motions become increasingly repetitive and back-and-forth, contributing no structural relaxations. We propose that structural relaxations are then brought about by pair-interactions between strings. Near the free surface, however, similar repetitive hopping motions are only observed sufficiently far removed from the free surface. We propose that the free surface induces a penetrating surface mobile region by breaking the memory in the particle dynamics. A possible mechanism based on string interactions will be discussed. We are grateful to the support of NSF through Project DMR-1310536 and Hong Kong GRF Grant 15301014.

  2. The Sun's Dynamic Influence on the Outer Heliosphere, the Heliosheath, and the Local Interstellar Medium

    NASA Astrophysics Data System (ADS)

    Intriligator, D. S.; Sun, W.; Detman, T.; Miller, W. D.; Intriligator, J.; Dryer, M.; Webber, W.; Deehr, C.; Gloeckler, G.

    2016-11-01

    The Sun has been observed for many years to be a dynamic influence in the heliosphere, and as the Voyager missions have continued long after achieving their original goals of observing the major planets they have provided the first in situ observations of the effects of solar activity in the heliosheath (HS), and the nearest portions of the local Interstellar Medium (LISM). Comparing these observations with models provides key insights. We employ two three-dimensional (3D) time-dependent models that simulate the propagation of shocks, other specific features, and the background solar wind throughout the heliosphere, starting with the solar background and solar event boundary conditions near the Sun at 2.5 Rs. The Hybrid Heliospheric Modeling System with Pickup Protons (HHMS-PI) is a 3D time- dependent Magnetohydrodynamic (MHD) simulation. HAFSS (HAF Solar Surface) is a 3D time-dependent kinematic simulation. Comparing our models with the observations indicates that solar effects are seen in the heliosphere, the HS, and the LISM in in-situ spacecraft measurements of plasma, magnetic field, energetic particles, cosmic rays, and plasma waves. There is quantitative agreement (at ACE, Ulysses, VI, V2) with data (e.g., solar wind, IMF, Ulysses SWICS pickup protons (PUPs)). Propagating shocks are slowed due to PUPs. The 3D locations of solar events and of various spacecraft are key to understanding the 3D propagation and timing of shocks, other specific features, and gradients throughout the heliosphere, HS, and LISM.

  3. Hydration dynamics at fluorinated protein surfaces.

    PubMed

    Kwon, Oh-Hoon; Yoo, Tae Hyeon; Othon, Christina M; Van Deventer, James A; Tirrell, David A; Zewail, Ahmed H

    2010-10-05

    Water-protein interactions dictate many processes crucial to protein function including folding, dynamics, interactions with other biomolecules, and enzymatic catalysis. Here we examine the effect of surface fluorination on water-protein interactions. Modification of designed coiled-coil proteins by incorporation of 5,5,5-trifluoroleucine or (4S)-2-amino-4-methylhexanoic acid enables systematic examination of the effects of side-chain volume and fluorination on solvation dynamics. Using ultrafast fluorescence spectroscopy, we find that fluorinated side chains exert electrostatic drag on neighboring water molecules, slowing water motion at the protein surface.

  4. Hydration dynamics at fluorinated protein surfaces

    PubMed Central

    Kwon, Oh-Hoon; Yoo, Tae Hyeon; Othon, Christina M.; Van Deventer, James A.; Tirrell, David A.; Zewail, Ahmed H.

    2010-01-01

    Water-protein interactions dictate many processes crucial to protein function including folding, dynamics, interactions with other biomolecules, and enzymatic catalysis. Here we examine the effect of surface fluorination on water-protein interactions. Modification of designed coiled-coil proteins by incorporation of 5,5,5-trifluoroleucine or (4S)-2-amino-4-methylhexanoic acid enables systematic examination of the effects of side-chain volume and fluorination on solvation dynamics. Using ultrafast fluorescence spectroscopy, we find that fluorinated side chains exert electrostatic drag on neighboring water molecules, slowing water motion at the protein surface. PMID:20855583

  5. SATELLITE DYNAMICS ON THE LAPLACE SURFACE

    SciTech Connect

    Tremaine, Scott; Touma, Jihad; Namouni, Fathi E-mail: jihad.touma@gmail.com

    2009-03-15

    The orbital dynamics of most planetary satellites is governed by the quadrupole moment from the equatorial bulge of the host planet and the tidal field from the Sun. On the Laplace surface, the long-term orbital evolution driven by the combined effects of these forces is zero, so that orbits have a fixed orientation and shape. The 'classical' Laplace surface is defined for circular orbits, and coincides with the planet's equator at small planetocentric distances and with its orbital plane at large distances. A dissipative circumplanetary disk should settle to this surface, and hence satellites formed from such a disk are likely to orbit in or near the classical Laplace surface. This paper studies the properties of Laplace surfaces. Our principal results are: (1) if the planetary obliquity exceeds 68.{sup 0}875, there is a range of semimajor axes in which the classical Laplace surface is unstable; (2) at some obliquities and planetocentric distances, there is a distinct Laplace surface consisting of nested eccentric orbits, which bifurcates from the classical Laplace surface at the point where instability sets in; (3) there is also a 'polar' Laplace surface perpendicular to the line of nodes of the planetary equator on the planetary orbit; (4) for circular orbits, the polar Laplace surface is stable at small planetocentric distances and unstable at large distances; (5) at the onset of instability, this polar Laplace surface bifurcates into two polar Laplace surfaces composed of nested eccentric orbits.

  6. Charge exchange of medium energy H and He ions emerging from solid surfaces

    NASA Astrophysics Data System (ADS)

    Kitsudo, Y.; Shibuya, K.; Nishimura, T.; Hoshino, Y.; Vickridge, I.; Kido, Y.

    2009-02-01

    Charge exchange of medium energy H and He ions emerging from clean solid surfaces is studied extensively using a toroidal electrostatic analyzer with an excellent energy resolution. The charge distributions of He ions scattered from sub-monolayers near a surface are non-equilibrated, resulting in a surface peak even for poly-crystal solids. By solving simultaneous rate equations numerically, we derive electron capture and loss cross sections for Ni and Au surfaces. Based on a free electron gas model, non-equilibrated He+ fractions dependent on emerging angle reveals uniform electronic surfaces for metals and corrugated surfaces for Si and graphite with covalent bonds. It is also found that equilibrium charge fractions of H+ are independent of surface materials (Z2) and in contrast equilibrium He+ fractions depend pronouncedly on Z2. The data obtained are compared with semi-empirical formulas.

  7. Response surface methodology for optimizing the fermentation medium of Clostridium butyricum.

    PubMed

    He, G Q; Kong, Q; Ding, L X

    2004-01-01

    Strains of Clostridium butyricum have been increasingly used as probiotics for both animals and humans. The aim of this study was to develop a growth medium for cultivating C. butyricum ZJUCB using a statistical methodology. Response surface methodology (RSM) was used to evaluate the effects of variables, namely the concentrations of the glucose, pectin, soyabean cake extract, casein, corn steep flour, ammonium sulphate, sodium bicarbonate and the medium initial pH. A fractional factorial design was applied to study the main factors that affected the growth of a probiotic strain of C. butyricum currently preserved in our lab and the central composite experimental design was adopted to derive a statistical model for optimizing the composition of the fermentation medium. The experimental results showed that the optimum fermentation medium for the growth of C. butyricum was composed of 2% glucose (w/v), 0.5% pectin (w/v), 0.2% casein (w/v), 3.98% soyabean cake extract, 0.1% (NH4)2SO4 (w/v), 0.124% NaHCO3 (w/v), 0.37% corn steep flour (w/v), 0.02% MnSO4 H2O (w/v), 0.02% MgSO4 7H2O (w/v) and 0.002% CaCl2 (w/v) at pH 7.5. After incubating 24 h in the optimum fermentation medium, the populations of the viable organisms were estimated to be 10(9) CFU ml(-1). In the present study, we report the optimization of a growth medium that produced increased yields using statistical approach. The use of bacteria as a probiotic is showing increasing potential. The development of a growth medium that has a high yield is an obvious need, and the approach to optimizing a growth medium is innovative.

  8. Nonlinear dynamics of a gas bubble in an incompressible elastic medium.

    PubMed

    Emelianov, Stanislav Y; Hamilton, Mark F; Ilinskii, Yurii A; Zabolotskaya, Evgenia A

    2004-02-01

    A nonlinear model in the form of the Rayleigh-Plesset equation is developed for a gas bubble in an essentially incompressible elastic medium such as a tissue or rubberlike medium. Two constitutive laws for the elastic medium are considered: the Mooney potential, and Landau's expansion of the strain energy density. These two constitutive laws are compared at quadratic order to obtain a relation between their respective elastic constants. Attention is devoted to the relative importance of shear stress on the bubble dynamics, allowing for the equilibrium gas pressure in the bubble to differ substantially from the pressure at infinity. The model for the bubble motion is approximated to quadratic order to assess the importance of shear stress in the surrounding medium relative to that of the gas pressure in the bubble. Relations are derived for the value of the shear wave speed at which the two contributions are comparable, which provide an assessment of when shear stress in the surrounding medium must be taken into account when modeling bubble dynamics.

  9. Sticky surface: sphere-sphere adhesion dynamics

    PubMed Central

    Sircar, Sarthok; Younger, John G.; Bortz, David M.

    2014-01-01

    We present a multi-scale model to study the attachment of spherical particles with a rigid core, coated with binding ligands and suspended in the surrounding, quiescent fluid medium. This class of fluid-immersed adhesion is widespread in many natural and engineering settings, particularly in microbial surface adhesion. Our theory highlights how the micro-scale binding kinetics of these ligands, as well as the attractive / repulsive surface potential in an ionic medium affects the eventual macro-scale size distribution of the particle aggregates (flocs). The bridge between the micro-macro model is made via an aggregation kernel. Results suggest that the presence of elastic ligands on the particle surface lead to the formation of larger floc aggregates via efficient inter-floc collisions (i.e., non-zero sticking probability, g). Strong electrolytic composition of the surrounding fluid favors large floc formation as well. The kernel for the Brownian diffusion for hard spheres is recovered in the limit of perfect binding effectiveness (g → 1) and in a neutral solution with no dissolved salts. PMID:25159830

  10. ACTIVE MEDIA: Dynamics of growth of inhomogeneities in the active medium of a liquid laser

    NASA Astrophysics Data System (ADS)

    Barikhin, B. A.; Ivanov, A. Yu; Kudryavkin, E. V.; Nedolugov, V. I.

    1991-07-01

    Fast cinematography of holograms and of shadow and interference patterns was combined with an acoustic method in a study of the dynamics of growth of inhomogeneities in the active medium of a coaxially pumped dye laser. The main mechanism of the formation of these inhomogeneities was related to acoustic waves created by the deformation of the walls of a dye cell created by electrical pulses applied to the pump flashlamp. Multipulse operation of this laser could be achieved and the off-duty factor could be reduced if the active medium was excited by the strongest possible pump pulses.

  11. Dynamic Defrosting on Scalable Superhydrophobic Surfaces

    DOE PAGES

    Murphy, Kevin R.; McClintic, William T.; Lester, Kevin C.; ...

    2017-06-27

    Recent studies have shown that frost can grow in a suspended Cassie state on nanostructured superhydrophobic surfaces. During defrosting, the melting sheet of Cassie frost spontaneously dewets into quasi-spherical slush droplets that are highly mobile. Promoting Cassie frost would therefore seem advantageous from a defrosting standpoint; however, nobody has systematically compared the efficiency of defrosting Cassie ice versus defrosting conventional surfaces. Here, we characterize the defrosting of an aluminum plate, one-half of which exhibits a superhydrophobic nanostructure while the other half is smooth and hydrophobic. For thick frost sheets (>1 mm), the superhydrophobic surface was able to dynamically shed themore » meltwater, even at very low tilt angles. In contrast, the hydrophobic surface was unable to shed any appreciable meltwater even at a 90° tilt angle. For thin frost layers (≲1 mm), not even the superhydrophobic surface could mobilize the meltwater. We attribute this to the large apparent contact angle of the meltwater, which for small amounts of frost serves to minimize coalescence events and prevent droplets from approaching the capillary length. Finally, we demonstrate a new mode of dynamic defrosting using an upside-down surface orientation, where the melting frost was able to uniformly detach from the superhydrophobic side and subsequently pull the frost from the hydrophobic side in a chain reaction. Treating surfaces to enable Cassie frost is therefore very desirable for enabling rapid and low-energy thermal defrosting, but only for frost sheets that are sufficiently thick.« less

  12. Dynamic Defrosting on Scalable Superhydrophobic Surfaces.

    PubMed

    Murphy, Kevin R; McClintic, William T; Lester, Kevin C; Collier, C Patrick; Boreyko, Jonathan B

    2017-07-19

    Recent studies have shown that frost can grow in a suspended Cassie state on nanostructured superhydrophobic surfaces. During defrosting, the melting sheet of Cassie frost spontaneously dewets into quasi-spherical slush droplets that are highly mobile. Promoting Cassie frost would therefore seem advantageous from a defrosting standpoint; however, nobody has systematically compared the efficiency of defrosting Cassie ice versus defrosting conventional surfaces. Here, we characterize the defrosting of an aluminum plate, one-half of which exhibits a superhydrophobic nanostructure while the other half is smooth and hydrophobic. For thick frost sheets (>1 mm), the superhydrophobic surface was able to dynamically shed the meltwater, even at very low tilt angles. In contrast, the hydrophobic surface was unable to shed any appreciable meltwater even at a 90° tilt angle. For thin frost layers (≲1 mm), not even the superhydrophobic surface could mobilize the meltwater. We attribute this to the large apparent contact angle of the meltwater, which for small amounts of frost serves to minimize coalescence events and prevent droplets from approaching the capillary length. Finally, we demonstrate a new mode of dynamic defrosting using an upside-down surface orientation, where the melting frost was able to uniformly detach from the superhydrophobic side and subsequently pull the frost from the hydrophobic side in a chain reaction. Treating surfaces to enable Cassie frost is therefore very desirable for enabling rapid and low-energy thermal defrosting, but only for frost sheets that are sufficiently thick.

  13. Dynamic air layer on textured superhydrophobic surfaces.

    PubMed

    Vakarelski, Ivan U; Chan, Derek Y C; Marston, Jeremy O; Thoroddsen, Sigurdur T

    2013-09-03

    We provide an experimental demonstration that a novel macroscopic, dynamic continuous air layer or plastron can be sustained indefinitely on textured superhydrophobic surfaces in air-supersaturated water by a natural gas influx mechanism. This type of plastron is an intermediate state between Leidenfrost vapor layers on superheated surfaces and the equilibrium Cassie-Baxter wetting state on textured superhydrophobic surfaces. We show that such a plastron can be sustained on the surface of a centimeter-sized superhydrophobic sphere immersed in heated water and variations of its dynamic behavior with air saturation of the water can be regulated by rapid changes of the water temperature. The simple experimental setup allows for quantification of the air flux into the plastron and identification of the air transport model of the plastron growth. Both the observed growth dynamics of such plastrons and millimeter-sized air bubbles seeded on the hydrophilic surface under identical air-supersaturated solution conditions are consistent with the predictions of a well-mixed gas transport model.

  14. Surface-peaked medium effects in the interaction of nucleons with finite nuclei

    SciTech Connect

    Aguayo, F. J.; Arellano, H. F.

    2008-07-15

    We investigate the asymptotic separation of the optical model potential for nucleon-nucleus scattering in momentum space, where the potential is split into a medium-independent term and another depending exclusively on the gradient of the density-dependent g matrix. This decomposition confines the medium sensitivity of the nucleon-nucleus coupling to the surface of the nucleus. We examine this feature in the context of proton-nucleus scattering at beam energies between 30 and 100 MeV and find that the pn coupling accounts for most of this sensitivity. Additionally, based on this general structure of the optical potential we are able to treat both, the medium dependence of the effective interaction and the full mixed density as described by single-particle shell models. The calculated scattering observables agree within 10% with those obtained by Arellano, Brieva, and Love in their momentum-space g-folding approach.

  15. Optimization of medium composition for enhancing growth of Lactobacillus rhamnosus PEN using response surface methodology.

    PubMed

    Polak-Berecka, Magdalena; Waśko, Adam; Kordowska-Wiater, Monika; Podleśny, Marcin; Targoński, Zdzisław; Kubik-Komar, Agnieszka

    2010-01-01

    Response surface methodology was used to optimize media components such as carbon and nitrogen (simple and complex) sources, mineral agents and growth factors (B vitamins, amino acids) for enhancing the biomass production of Lactobacillus rhamnosus PEN. For screening experiment the following carbon sources were selected: glucose, glucose+pyruvate, glucose+citrate, glucose+lactate, galactose, fructose, lactose, sucrose, maltose, lactulose, fructooligosaccharides, maltodextrins DP 4-7 and DP 13-17. Nitrogen sources such as yeast extract, meat extract and peptone K were used in lower concentrations than in MRS medium which served as a control. All experiments were run at 37 degrees C for 24-48 h under stationary conditions. Constituents chosen after the first screening experiments were further screened by the Plackett-Burman design. Glucose and sodium pyruvate, meat extract, potassium phosphate, sodium acetate, and ammonium citrate were chosen as promising medium components for further optimization studies. By solving the regression equation and analyzing the response surface carton, optimal concentrations of the components were determined as: glucose (13.4 g/l), sodium pyruvate (3.4 g/l), meat extract (7.2 g/l), potassium phosphate (2.0 g/I), sodium acetate (5.0 g/1) and ammonium citrate (2.0 g/l). In comparison to MRS broth the optimal medium contained fewer ingredients and in modified amounts but Lb. ihamnosus PEN showed better growth activity. Biomass concentration (as dry cell weight) of bacteria cultivated in optimal medium at bioreactor conditions was 5.5 g/l after 16 h of incubation, being higher in comparison with bacterial growth in MRS medium (1.9 g/l) under the same conditions. Moreover, the new medium was less expensive.

  16. Wear Behavior of Medium Carbon Steel with Biomimetic Surface Under Starved Lubricated Conditions

    NASA Astrophysics Data System (ADS)

    Zhang, Zhihui; Shao, Feixian; Liang, Yunhong; Lin, Pengyu; Tong, Xin; Ren, Luquan

    2017-07-01

    Friction and wear under starved lubrication condition are both key life-related factors for mechanical performance of many structural parts. In this paper, different surface morphologies on medium carbon steel were fabricated using laser, inspired by the surface coupling effect of biological system. The friction and sliding wear behaviors of biomimetic specimens (characterized by convex and concave units on the specimen surface) were studied under starved lubrication condition. The stress distribution on different sliding surfaces under sliding friction was studied using finite element method. The results showed that the tribological performance of studied surfaces under starved lubrication condition depended not only on the surface morphology but also on the structure of biomimetic units below surface (subsurface structure). The friction coefficient of biomimetic surface was effectively reduced by the concave unit depth, while the refined microstructure with higher hardness led to the much better wear resistance. In addition to lubricant reserving and wear debris trapping effect derived from the surface concave morphology, it was believed that the well-formed subsurface structure of biomimetic units could carry much heavy loads against tribopair, which enhanced the function of surface topography and resulted in complementary lubrication in the wear contact area. The uniform stress distribution on the entire biomimetic surface also played an important role in stabilizing the friction coefficient and reducing the wear cracks.

  17. Effects of Proteins from Culture Medium on Surface Property of Silanes- Functionalized Magnetic Nanoparticles

    NASA Astrophysics Data System (ADS)

    Chen, Z. P.; Xu, R. Z.; Zhang, Y.; Gu, N.

    2009-03-01

    Monodisperse magnetic nanoparticles (MNPs) were synthesized by thermal decomposition of iron-oleate and functionalized with silanes bearing various functional groups such as amino group (NH2), short-chain poly(ethylene glycol) (PEG), and carboxylic group (COOH). Then, silanes-functionalized magnetic nanoparticles (silanes-MNPs) were incubated in cell culture medium plus fetal calf serum to investigate the effects of proteins from culture medium on surface property of MNPs. Zeta potential measurements showed that although surface charges of silanes-MNPs were different, they exhibited negative charges at neutral pH and approximate isoelectric points after they were incubated in cell culture medium. The reason was that silanes-MNPs could easily adsorb proteins from culture medium via non-covalent binding, resulting in the formation of protein-silanes-MNPs conjugates. Moreover, silanes-MNPs with various functional groups had different adsorption capacity to proteins, as confirmed by Coomassie blue fast staining method. The in vitro cell experiments showed that protein-silanes-MNPs had higher cellular uptake by cancer cells than silanes-MNPs.

  18. Vortex dynamics in nonlinear free surface flows

    NASA Astrophysics Data System (ADS)

    Curtis, Christopher W.; Kalisch, Henrik

    2017-03-01

    The two-dimensional motion of point vortices in an inviscid fluid with a free surface and an impenetrable bed is investigated. The work is based on forming a closed system of equations for surface variables and vortex positions using a variant of the Ablowitz, Fokas, and Musslimani formulation [M. J. Ablowitz, A. S. Fokas, and Z. H. Musslimani, J. Fluid Mech. 562, 313-343 (2006)] of the water-wave free-surface problem. The equations are approximated with a dealiased spectral method making use of a high-order approximation of the Dirichlet-Neumann operator and a high-order time-stepping scheme. Numerical simulations reveal that the combination of vortex motion and solid bottom boundary yields interesting dynamics not seen in the case of vortex motion in an infinitely deep fluid. In particular, strong deformations of the free surface, including non-symmetric surface profiles and regions of large energy concentration, are observed. Our simulations also uncover a rich variety of vortex trajectories including orbiting and nearly parallel patterns of motion. The dynamics of the free surface and of the point vortices are strongly influenced by the initial placement and polarity of the vortices. The method put forward here is flexible enough to handle a large number of vortices and may easily be extended to include the effects of varying bathymetry, stratification, and background shear currents.

  19. A dynamic and stationary rheological study of erythrocytes incubated in a glucose medium.

    PubMed

    Riquelme, Bibiana; Foresto, Patricia; D'Arrigo, Mabel; Valverde, Juana; Rasia, Rodolfo

    2005-02-28

    A higher than normal glucose concentration in a suspending medium may produce non-enzymatic glycosylation of erythrocyte proteins. This process can modify the viscoelastic properties of erythrocytes. In this paper, we studied the possible relationship between glucose concentration in a suspending medium and erythrocyte rheological parameters. Human venous blood was obtained from the antecubital veins of 10 healthy volunteers. Blood samples were anticoagulated with EDTA and centrifuged. Red blood cells (RBCs) were washed and subsequently divided in aliquots, which were incubated in vitro with glucose solutions of different concentrations. Dynamic and stationary viscoelastic parameters of RBCs were determined by laser diffractometry in an Erythrodeformeter. Aggregate shape parameter (ASP) of the RBCs was determined by digital image processing. Significant changes were observed both in ASP and in rheological parameters when the glucose concentration in the medium was increased, demonstrating that a glucose concentration as low as 1% induces alterations in the mechanical properties of RBCs.

  20. Extraction of near-surface properties for a lossy layered medium using the propagator matrix

    USGS Publications Warehouse

    Mehta, K.; Snieder, R.; Graizer, V.

    2007-01-01

    Near-surface properties play an important role in advancing earthquake hazard assessment. Other areas where near-surface properties are crucial include civil engineering and detection and delineation of potable groundwater. From an exploration point of view, near-surface properties are needed for wavefield separation and correcting for the local near-receiver structure. It has been shown that these properties can be estimated for a lossless homogeneous medium using the propagator matrix. To estimate the near-surface properties, we apply deconvolution to passive borehole recordings of waves excited by an earthquake. Deconvolution of these incoherent waveforms recorded by the sensors at different depths in the borehole with the recording at the surface results in waves that propagate upwards and downwards along the array. These waves, obtained by deconvolution, can be used to estimate the P- and S-wave velocities near the surface. As opposed to waves obtained by cross-correlation that represent filtered version of the sum of causal and acausal Green's function between the two receivers, the waves obtained by deconvolution represent the elements of the propagator matrix. Finally, we show analytically the extension of the propagator matrix analysis to a lossy layered medium for a special case of normal incidence. ?? 2007 The Authors Journal compilation ?? 2007 RAS.

  1. Analysis of shape of porous cooled medium for an imposed surface heat flux and temperature

    NASA Technical Reports Server (NTRS)

    Siegel, R.

    1973-01-01

    The surface of a porous cooled medium is to be maintained at a specified design temperature while being subjected to uniform heating by an external source. An analytical method is given for determining the shape of the medium surface that will satisfy these boundary conditions. The analysis accounts for temperature dependent variations of fluid density and viscosity and for temperature dependent matrix thermal conductivity. The energy equation is combined with Darcy's law in such a way that a potential can be defined that satisfies Laplace's equation. All of the heat-transfer and flow quantities are expressed in terms of this potential. The determination of the shape of the porous cooled region is thereby reduced to a free-boundary problem such as in inviscid free jet theory. Two illustrative examples are carried out: a porous leading edge with coolant supplied through a slot and a porous cooled duct with a rectangular outer boundary.

  2. Dynamics of shock wave propagation and interphase process in liquid-vapor medium

    SciTech Connect

    Pokusaev, B.G.; Pribaturin, N.A.

    1995-09-01

    This paper considers the experimental results and physical effects on the pressure wave dynamics of a vapour-liquid two-phase medium of bubble and slug structure. The role of destruction and collapse of bubbles and slugs, phase transition (condensation and evaporation) on pressure wave dynamics is also studied. The general mechanisms of the wave formation, behavior and instability of a vapour-liquid structure under pressure waves, basic peculiarities of the interface heat transfer are obtained. In the experiments it has been shown that for the bubble medium the shock wave can be transformed into the powerful pressure pulse with an amplitude greater then the amplitude of the initial pressure wave. For the slug medium a characteristic structure of the amplificated wave is {open_quotes}comb{close_quotes} - like wave. It has been shown that the wave amplification caused by generation of secondary waves in a medium caused by destruction and collapse of bubbles and slugs. The obtained results can be useful at transient and emergency operational regimes of nuclear reactors, fuel tank, pipelines with two-phase flows and for development of safety models for chemical industry.

  3. Unusual spiral wave dynamics in the Kessler-Levine model of an excitable medium

    NASA Astrophysics Data System (ADS)

    Oikawa, N.; Bodenschatz, E.; Zykov, V. S.

    2015-05-01

    The Kessler-Levine model is a two-component reaction-diffusion system that describes spatiotemporal dynamics of the messenger molecules in a cell-to-cell signaling process during the aggregation of social amoeba cells. An excitation wave arising in the model has a phase wave at the wave back, which simply follows the wave front after a fixed time interval with the same propagation velocity. Generally speaking, the medium excitability and the refractoriness are two important factors which determine the spiral wave dynamics in any excitable media. The model allows us to separate these two factors relatively easily since the medium refractoriness can be changed independently of the medium excitability. For rigidly rotating waves, the universal relationship has been established by using a modified free-boundary approach, which assumes that the front and the back of a propagating wave are thin in comparison to the wave plateau. By taking a finite thickness of the domain boundary into consideration, the validity of the proposed excitability measure has been essentially improved. A novel method of numerical simulation to suppress the spiral wave instabilities is introduced. The trajectories of the spiral tip observed for a long refractory period have been investigated under a systematic variation of the medium refractoriness.

  4. [A mathematical model of heat exchange between astronaut and environmental medium on the Lunar surface].

    PubMed

    Wu, Q

    1997-12-01

    To maintain thermal balance of astronaut, and avoid injuries by heats of the solar radiation and radiation from the Moon, a detailed analysis of heat exchange between the astronaut and the environment medium was made and a mathematical model was established. It indicates that the Lunar surface temperature and the thermal current transmitted to the astronaut change with the incident angle of the solar radiation. The thermal balance of the astronaut is affected by absorption coefficient, radiation coefficient and thermal resistance.

  5. Study of multiband disordered systems using the typical medium dynamical cluster approximation

    DOE PAGES

    Zhang, Yi; Terletska, Hanna; Moore, C.; ...

    2015-11-06

    We generalize the typical medium dynamical cluster approximation to multiband disordered systems. Using our extended formalism, we perform a systematic study of the nonlocal correlation effects induced by disorder on the density of states and the mobility edge of the three-dimensional two-band Anderson model. We include interband and intraband hopping and an intraband disorder potential. Our results are consistent with those obtained by the transfer matrix and the kernel polynomial methods. We also apply the method to KxFe2-ySe2 with Fe vacancies. Despite the strong vacancy disorder and anisotropy, we find the material is not an Anderson insulator. Moreover our resultsmore » demonstrate the application of the typical medium dynamical cluster approximation method to study Anderson localization in real materials.« less

  6. Study of multiband disordered systems using the typical medium dynamical cluster approximation

    SciTech Connect

    Zhang, Yi; Terletska, Hanna; Moore, C.; Ekuma, Chinedu; Tam, Ka-Ming; Berlijn, Tom; Ku, Wei; Moreno, Juana; Jarrell, Mark

    2015-11-06

    We generalize the typical medium dynamical cluster approximation to multiband disordered systems. Using our extended formalism, we perform a systematic study of the nonlocal correlation effects induced by disorder on the density of states and the mobility edge of the three-dimensional two-band Anderson model. We include interband and intraband hopping and an intraband disorder potential. Our results are consistent with those obtained by the transfer matrix and the kernel polynomial methods. We also apply the method to KxFe2-ySe2 with Fe vacancies. Despite the strong vacancy disorder and anisotropy, we find the material is not an Anderson insulator. Moreover our results demonstrate the application of the typical medium dynamical cluster approximation method to study Anderson localization in real materials.

  7. Improvement of antibiotic activity of Xenorhabdus bovienii by medium optimization using response surface methodology

    PubMed Central

    2011-01-01

    Background The production of secondary metabolites with antibiotic properties is a common characteristic to entomopathogenic bacteria Xenorhabdus spp. These metabolites not only have diverse chemical structures but also have a wide range of bioactivities with medicinal and agricultural interests such as antibiotic, antimycotic and insecticidal, nematicidal and antiulcer, antineoplastic and antiviral. It has been known that cultivation parameters are critical to the secondary metabolites produced by microorganisms. Even small changes in the culture medium may not only impact the quantity of certain compounds but also the general metabolic profile of microorganisms. Manipulating nutritional or environmental factors can promote the biosynthesis of secondary metabolites and thus facilitate the discovery of new natural products. This work was conducted to evaluate the influence of nutrition on the antibiotic production of X. bovienii YL002 and to optimize the medium to maximize its antibiotic production. Results Nutrition has high influence on the antibiotic production of X. bovienii YL002. Glycerol and soytone were identified as the best carbon and nitrogen sources that significantly affected the antibiotic production using one-factor-at-a-time approach. Response surface methodology (RSM) was applied to optimize the medium constituents (glycerol, soytone and minerals) for the antibiotic production of X. bovienii YL002. Higher antibiotic activity (337.5 U/mL) was obtained after optimization. The optimal levels of medium components were (g/L): glycerol 6.90, soytone 25.17, MgSO4·7H2O 1.57, (NH4)2SO4 2.55, KH2PO4 0.87, K2HPO4 1.11 and Na2SO4 1.81. An overall of 37.8% increase in the antibiotic activity of X. bovienii YL002 was obtained compared with that of the original medium. Conclusions To the best of our knowledge, there are no reports on antibiotic production of X. boviebii by medium optimization using RSM. The results strongly support the use of RSM for medium

  8. Versatile, dynamically balanced low-noise optical-field manipulator using a coherently prepared atomic medium.

    PubMed

    Li, Yan; Zhu, Chengjie; Deng, L; Hagley, E W; Garrett, W R

    2015-11-15

    We propose a versatile dynamic optical-field manipulator using a coherently prepared atomic medium. We show that by locking the pump power change with the two-photon detuning, a π-phase shifting can be realized with unit probe fidelity in a broad two-photon detuning range. The two-photon-insensitive π-phase-shift mode with significantly reduced fluctuation makes this scheme an attractive system for low-noise phase-gate operations.

  9. Partial Nonlinear Reciprocity Breaking through Ultrafast Dynamics in a Random Photonic Medium

    NASA Astrophysics Data System (ADS)

    Muskens, Otto L.; Venn, Paul; van der Beek, Timmo; Wellens, Thomas

    2012-06-01

    We demonstrate that ultrafast nonlinear dynamics gives rise to reciprocity breaking in a random photonic medium. Reciprocity breaking is observed via the suppression of coherent backscattering, a manifestation of weak localization of light. The effect is observed in a pump-probe configuration where the pump induces an ultrafast step change of the refractive index during the dwell time of the probe light in the material. The dynamical suppression of coherent backscattering is reproduced well by a multiple scattering Monte Carlo simulation. Ultrafast reciprocity breaking provides a distinct mechanism in nonlinear optical media, which opens up avenues for the active manipulation of mesoscopic transport, random lasers, and photon localization.

  10. Entanglement dynamics of quantum states generated by a Kerr medium and a beam splitter

    NASA Astrophysics Data System (ADS)

    Rohith, M.; Sudheesh, C.; Rajeev, R.

    2016-01-01

    We study theoretically the dynamics of entangled states created in a beam splitter with a nonlinear Kerr medium placed into one input arm. Entanglement dynamics of initial classical and nonclassical states are studied and compared. Signatures of revival and fractional revival phenomena exhibited during the time evolution of states in the Kerr medium are captured in the entangled states produced by the beam splitter. Dynamics of entanglement shows local minima at the instants of fractional revivals. These minima correspond to the generation of two-component Schrödinger cat states or multi-component Schrödinger cat-like states if the initial state considered is a coherent state. Maximum entanglement is obtained at the instants of collapses of wave packets in the medium. Our analysis shows increase in entanglement with increase in the degree of nonclassicality of the initial states considered. We show that the states generated at the output of the beam splitter using initial nonclassical states are more robust against decoherence due to photon absorption by an environment than those formed by an initial classical state.

  11. Medium optimization for the production of recombinant nattokinase by Bacillus subtilis using response surface methodology.

    PubMed

    Chen, Po Ting; Chiang, Chung-Jen; Chao, Yun-Peng

    2007-01-01

    Nattokinase is a potent fibrinolytic enzyme with the potential for fighting cardiovascular diseases. Most recently, a new Bacillus subtilis/Escherichia coli (B. subtilis/E. coli) shuttle vector has been developed to achieve stable production of recombinant nattokinase in B. subtilis (Chen; et al. 2007, 23, 808-813). With this developed B. subtilis strain, the design of an optimum but cost-effective medium for high-level production of recombinant nattokinase was attempted by using response surface methodology. On the basis of the Plackett-Burman design, three critical medium components were selected. Subsequently, the optimum combination of selected factors was investigated by the Box-Behnken design. As a result, it gave the predicted maximum production of recombinant nattokinase with 71 500 CU/mL for shake-flask cultures when the concentrations of soybean hydrolysate, potassium phosphate, and calcium chloride in medium were at 6.100, 0.415, and 0.015%, respectively. This was further verified by a duplicated experiment. Moreover, the production scheme based on the optimum medium was scaled up in a fermenter. The batch fermentation of 3 L was carried out by controlling the condition at 37 degrees C and dissolved oxygen reaching 20% of air saturation level while the fermentation pH was initially set at 8.5. Without the need for controlling the broth pH, recombinant nattokinase production with a yield of 77 400 CU/mL (corresponding to 560 mg/L) could be obtained in the culture broth within 24 h. In particular, the recombinant B. subtilis strain was found fully stable at the end of fermentation when grown on the optimum medium. Overall, it indicates the success of this experimental design approach in formulating a simple and cost-effective medium, which provides the developed strain with sufficient nutrient supplements for stable and high-level production of recombinant nattokinase in a fermenter.

  12. Dissecting the structure of surface stabilizer on the dispersion of inorganic nanoparticles in aqueous medium

    NASA Astrophysics Data System (ADS)

    Ding, Yong; Yu, Zongzhi; Zheng, Junping

    2017-03-01

    Dispersing inorganic nanoparticles in aqueous solutions is a key requirement for a great variety of products and processes, including carriers in drug delivery or fillers in polymers. To be highly functional in the final product, inorganic particles are required to be finely dispersed in nanoscale. In this study, silica was selected as a representative inorganic particle. Surface stabilizers with different chain length and charged group were designed to reveal the influence of electrostatic and van der Waals forces between silica and stabilizer on the dispersion of silica particles in aqueous medium. Results showed surface stabilizer with longer alkyl chain and charged group exerted best ability to deaggregate silica, leading to a hydrodynamic size of 51.1 nm. Surface stabilizer designing with rational structure is a promising solution for deagglomerating and reducing process time and energy. Giving the designability and adaptability of surface stabilizer, this method is of potential for dispersion of other inorganic nanoparticles.

  13. Dynamic loads in surface dragline ropes. [ADINA

    SciTech Connect

    Alzheimer, J.M.; Bampton, M.C.C.; Griffiths, J.A.

    1980-03-01

    In order to analyze the failure of the large diameter wire ropes used in large surface mining draglines, the stresses in the ropes due to operational loadings must be known. To be meaningful, the calculation of these loads must take into account the dynamic behavior of the ropes and the dragline. Since there is a lack of data concerning the actual loads in ropes of surface draglines, an investigation was undertaken to characterize these loads. An existing finite element computer code, ADINA, capable of modeling large displacement, dynamic behavior of cable-like structures was selected to perform the analyses. However, because ADINA is a general purpose nonlinear finite element program, not specifically written for cable type problems, it was necessary to investigate its capabilities along these lines. Therefore, a series of benchmark problems was selected to establish its capabilities. These benchmark problems are discussed. This computer analysis resulted in two conclusions: first, the ability of ADINA truss elements with large displacement capabilities to model static and dynamic behavior of wire ropes has been clearly shown. The nonlinear static stiffness of catenary cables was modeled precisely. Significant dynamic phenomena such as mode shapes and frequencies, pulse propagation, and freely falling cables were also well represented by ADINA models. Second, care must be taken to ensure that sufficiently small load increments (i.e., time steps) are used to obtain convergence. The nonlinear truss element behavior is quite sensitive to load increment size.

  14. Bioinspired, dynamic, structured surfaces for biofilm prevention

    NASA Astrophysics Data System (ADS)

    Epstein, Alexander K.

    Bacteria primarily exist in robust, surface-associated communities known as biofilms, ubiquitous in both natural and anthropogenic environments. Mature biofilms resist a wide range of biocidal treatments and pose persistent pathogenic threats. Treatment of adherent biofilm is difficult, costly, and, in medical systems such as catheters, frequently impossible. Adding to the challenge, we have discovered that biofilm can be both impenetrable to vapors and extremely nonwetting, repelling even low surface tension commercial antimicrobials. Our study shows multiple contributing factors, including biochemical components and multiscale reentrant topography. Reliant on surface chemistry, conventional strategies for preventing biofilm only transiently affect attachment and/or are environmentally toxic. In this work, we look to Nature's antifouling solutions, such as the dynamic spiny skin of the echinoderm, and we develop a versatile surface nanofabrication platform. Our benchtop approach unites soft lithography, electrodeposition, mold deformation, and material selection to enable many degrees of freedom—material, geometric, mechanical, dynamic—that can be programmed starting from a single master structure. The mechanical properties of the bio-inspired nanostructures, verified by AFM, are precisely and rationally tunable. We examine how synthetic dynamic nanostructured surfaces control the attachment of pathogenic biofilms. The parameters governing long-range patterning of bacteria on high-aspect-ratio (HAR) nanoarrays are combinatorially elucidated, and we discover that sufficiently low effective stiffness of these HAR arrays mechanoselectively inhibits ˜40% of Pseudomonas aeruginosa biofilm attachment. Inspired by the active echinoderm skin, we design and fabricate externally actuated dynamic elastomer surfaces with active surface microtopography. We extract from a large parameter space the critical topographic length scales and actuation time scales for achieving

  15. Dynamic bioactive stimuli-responsive polymeric surfaces

    NASA Astrophysics Data System (ADS)

    Pearson, Heather Marie

    This dissertation focuses on the design, synthesis, and development of antimicrobial and anticoagulant surfaces of polyethylene (PE), polypropylene (PP), and poly(tetrafluoroethylene) (PTFE) polymers. Aliphatic polymeric surfaces of PE and PP polymers functionalized using click chemistry reactions by the attachment of --COOH groups via microwave plasma reactions followed by functionalization with alkyne moieties. Azide containing ampicillin (AMP) was synthesized and subsequently clicked into the alkyne prepared PE and PP surfaces. Compared to non-functionalized PP and PE surfaces, the AMP clicked surfaces exhibited substantially enhanced antimicrobial activity against Staphylococcus aureus bacteria. To expand the biocompatibility of polymeric surface anticoagulant attributes, PE and PTFE surfaces were functionalized with pH-responsive poly(2-vinyl pyridine) (P2VP) and poly(acrylic acid) (PAA) polyelectrolyte tethers terminated with NH2 and COOH groups. The goal of these studies was to develop switchable stimuli-responsive polymeric surfaces that interact with biological environments and display simultaneous antimicrobial and anticoagulant properties. Antimicrobial AMP was covalently attached to --COOH terminal ends of protected PAA, while anticoagulant heparin (HEP) was attached to terminal --NH2 groups of P2VP. When pH < 2.3, the P2VP segments are protonated and extend, but for pH > 5.5, they collapse while the PAA segments extend. Such surfaces, when exposed to Staphylococcus aureus, inhibit bacterial growth due to the presence of AMP, as well as are effective anticoagulants due to the presence of covalently attached HEP. Comparison of these "dynamic" pH responsive surfaces with "static" surfaces terminated with AMP entities show significant enhancement of longevity and surface activity against microbial film formation. The last portion of this dissertation focuses on the covalent attachment of living T1 and Φ11 bacteriophages (phages) on PE and PTFE surface

  16. Dynamic contact angle cycling homogenizes heterogeneous surfaces.

    PubMed

    Belibel, R; Barbaud, C; Mora, L

    2016-12-01

    In order to reduce restenosis, the necessity to develop the appropriate coating material of metallic stent is a challenge for biomedicine and scientific research over the past decade. Therefore, biodegradable copolymers of poly((R,S)-3,3 dimethylmalic acid) (PDMMLA) were prepared in order to develop a new coating exhibiting different custom groups in its side chain and being able to carry a drug. This material will be in direct contact with cells and blood. It consists of carboxylic acid and hexylic groups used for hydrophilic and hydrophobic character, respectively. The study of this material wettability and dynamic surface properties is of importance due to the influence of the chemistry and the potential motility of these chemical groups on cell adhesion and polymer kinetic hydrolysis. Cassie theory was used for the theoretical correction of contact angles of these chemical heterogeneous surfaces coatings. Dynamic Surface Analysis was used as practical homogenizer of chemical heterogeneous surfaces by cycling during many cycles in water. In this work, we confirmed that, unlike receding contact angle, advancing contact angle is influenced by the difference of only 10% of acidic groups (%A) in side-chain of polymers. It linearly decreases with increasing acidity percentage. Hysteresis (H) is also a sensitive parameter which is discussed in this paper. Finally, we conclude that cycling provides real information, thus avoiding theoretical Cassie correction. H(10)is the most sensible parameter to %A.

  17. Influence of loading pulse duration on dynamic load transfer in a simulated granular medium

    NASA Astrophysics Data System (ADS)

    Shukla, A.; Sadd, M. H.; Xu, Y.; Tai, Q. M.

    1993-11-01

    AN EXPERIMENTAL and numerical investigation was conducted to study the dynamic response of granular media when subjected to impact loadings with different periods or wavelengths. The granular medium was simulated by a one-dimensional assembly of circular disks arranged in a straight single chain. In the experimental study, the dynamic loading was produced using projectile impact from a gas gun onto one end of the granular assembly, and the measured wave signal was collected using strain gages. The numerical simulations were conducted using the distinct element method. It was found from the experiments and numerical simulations that input waves with a short period (τ ≈ 90 μs) will propagate in this granular medium with little waveform change under steady amplitude attenuation ; whereas longer waves (τ $̆200 μs) will propagate with significant waveform dispersion. For these longer wavelength signals, the smooth waveform will undergo separation into a series of short oscillatory signals, and this rearrangement of energy allows a portion of the transmitted signal to increase in amplitude during the initial phases of propagation. Thus the granular medium acts as a nonlinear wave guide, and local microstructure and contact nonlinearity will allow input signals of sufficiently long wavelength to excite resonant sub-units of the medium to produce this observed ringing separation. Following a modeling scheme originally proposed by NESTERENKO[J. Appl. Mech. Tech. Phys. 5,733 (1983)], a nonlinear wave equation model was developed which is related to soliton dynamics and leads to travelling wave solutions of specific wavelength found in our experimental and numerical studies.

  18. Surface Dynamics and Roughening in Metal Nanowires

    NASA Astrophysics Data System (ADS)

    Zhang, C. H.; Stafford, C. A.; Goldstein, R. E.; Kassubek, F.

    2002-03-01

    Surface phonons and surface self-diffusion of atoms in metal nanowires are investigated in a continuum approach (jellium model). Electron-shell effects in such a system lead to islands of stability: regions in the (R_0,T) plane where arbitrarily long wires are stable with respect to small perturbations, R0 being the mean radius of the wire and T the temperature. We find that inertial dynamics always dominate over diffusion as one approaches the stability boundary. On the stability boundary, the surface of the nanowire becomes rough at any finite temperature, but remains smooth at T=0. The critical exponents describing this roughening transition are different than those for two-dimensional surfaces, due to the different dispersion relation for surface waves. We also find a novel reentrant roughening transition: for certain ranges of R_0, nanowires are stable within a temperature interval T_c1surfaces roughen exponentially, dominated by the maximum instability mode q_m, and finally will be trapped into a state with a permanent deformation if qm R_0>1. Research supported in part by NSF grant DMR0072703 and by an award from Research Corporation.

  19. Surface Dynamics at Low Weber Numbers

    NASA Astrophysics Data System (ADS)

    Bacon, John Bartlett

    A quantitative surface-slope measurement tool is developed for liquids, using the schlieren optical testing technique. Clean free-surface deformations are studied in low Weber number interactions with isolated, symmetric, ellipsoidal vortices impinging vertically from below. Four linearly independent dynamic equations are deduced from the data, to completely characterize the time-dependent parameters of the problem. The surface deformations are modelled at all stages of the interaction as being symmetric Gaussian curves, with good agreement of the first moment of such curves with the observed slope profile data. The derived equations show strong evidence of the existence of a trapped volume of fluid, between the vortex and the surface, which mechanically couples the two entities. The same equipment is used to observe surface slope profiles of grid-generated turbulence in an open channel. The qualitative results are compared to general tendencies predicted by the isolated vortex equations, with good general agreement. A special case of liquid lithium at power-reactor temperatures is examined. It is determined that the random angular fluctuations of the surface due to turbulence are so large that channel-like liquid metal mirrors cannot be used for laser-fusion reactor applications.

  20. Frontier induced semi-infinite-medium (FISIM) states at semiconductor surfaces and interfaces

    NASA Astrophysics Data System (ADS)

    Olguın, D.; Rodrıguez, J. A.; Baquero, R.

    2003-02-01

    In a previous work we have discussed the valence band electronic structure of a (001) oriented surface (semi-infinite medium) of some II-VI wide band gap zinc-blende semiconductor compounds. For these systems, we have found three characteristic surface resonances, besides the known bulk bands (hh, lh and spin-orbit bands). Two of these resonances correspond to the anion terminated surface and the third one to the cation terminated one. We have shown, specifically, that three non dispersive (001)-surface-induced bulk states, in the Γ - X direction of the 2D Brillouin zone, do exist and are characteristic of these systems. The existence of these states has been confirmed, independently, by two experimental groups and further evidence of our predictions has been more recently found. In order to continue with the description of these states, in this work, we briefly review the main characteristics of the electronic structure of the (001)-surfaces to up-date their analysis and we present new results concerning the existence of the same kind of states in Cu-based calcopyrites and at interfaces. This shows that, in general, the non-dispersive states occur in several, if not all, crystal surfaces, and, on general grounds, as the consequence of introducing to an infinite medium a frontier of any kind (not only with the vacuum). For that reason we propose here, to name them, more appropriately as Frontier Induced Semi-Infinite Medium (FISIM) states. We present in this paper two new interesting cases where the non-dispersive states appear. First, the (112)-oriented CuInSe2 calcopyrite surface and, secondly, the interface CdTe/CdSexTe1-x (x = 0.15) which, essentially, does not introduce the additional effects due to lattice mismatch so that the FISIM states are clearly seen. We have calculated them for a broader range of x and for other II-VI and III-V semiconductor compounds to check that the result is general. The surface and the interface that we present here, allow us to

  1. Optical tracking of contrast medium bolus to optimize bolus shape and timing in dynamic computed tomography

    NASA Astrophysics Data System (ADS)

    Eisa, Fabian; Brauweiler, Robert; Peetz, Alexander; Hupfer, Martin; Nowak, Tristan; Kalender, Willi A.

    2012-05-01

    One of the biggest challenges in dynamic contrast-enhanced CT is the optimal synchronization of scan start and duration with contrast medium administration in order to optimize image contrast and to reduce the amount of contrast medium. We present a new optically based approach, which was developed to investigate and optimize bolus timing and shape. The time-concentration curve of an intravenously injected test bolus of a dye is measured in peripheral vessels with an optical sensor prior to the diagnostic CT scan. The curves can be used to assess bolus shapes as a function of injection protocols and to determine contrast medium arrival times. Preliminary results for phantom and animal experiments showed the expected linear behavior between dye concentration and absorption. The kinetics of the dye was compared to iodinated contrast medium and was found to be in good agreement. The contrast enhancement curves were reliably detected in three mice with individual bolus shapes and delay times of 2.1, 3.5 and 6.1 s, respectively. The optical sensor appears to be a promising approach to optimize injection protocols and contrast enhancement timing and is applicable to all modalities without implying any additional radiation dose. Clinical tests are still necessary.

  2. Surface profile acquisition using dynamic speckles

    NASA Astrophysics Data System (ADS)

    Semenov, Dmitry V.; Nippolainen, Ervin; Raita, Erik; Kamshilin, Alexei A.

    2006-01-01

    In this work we present the novel technique for z-distance measurement to an optically rough surface using dynamic speckles. The technique is based on the continuous frequency measurements of the power modulation of the spatially filtered scattered light. The dynamic speckle pattern is created when the laser beam scans the surface under study. The complete optical-electronic system was designed and fabricated for fast measurement of the speckles velocity, its recalculation into the distance, and further data acquisition into computer. The measured surface profile is displayed in a PC monitor in real time. Main advantage of the proposed technique is high scanning speed providing an extremely short response time below 1 μs. Important parameters of the system such as accuracy, range of measurements, and spatial resolution are analyzed. Limits of the spatial filtering technique used for continuous tracking of the speckle-pattern velocity are shown. Possible ways of further improvement of the measurements accuracy are demonstrated. Due to its extremely fast operation the proposed technique could find applications in such areas as online quality control of materials (paper thickness, rolled metal roughness, etc.) moving on production lines with high velocities (up to 20 m/s) or online control of the 3D-shape of complex objects (e.g., electronic circuits) during their assembling.

  3. Liquid film condensation along a vertical surface in a thin porous medium with large anisotropic permeability.

    PubMed

    Sanya, Arthur S O; Akowanou, Christian; Sanya, Emile A; Degan, Gerard

    2014-01-01

    The problems of steady film condensation on a vertical surface embedded in a thin porous medium with anisotropic permeability filled with pure saturated vapour are studied analytically by using the Brinkman-Darcy flow model. The principal axes of anisotropic permeability are oriented in a direction that non-coincident with the gravity force. On the basis of the flow permeability tensor due to the anisotropic properties and the Brinkman-Darcy flow model adopted by considering negligible macroscopic and microscopic inertial terms, boundary-layer approximations in the porous liquid film momentum equation is solved analytically. Scale analysis is applied to predict the order-of-magnitudes involved in the boundary layer regime. The first novel contribution in the mathematics consists in the use of the anisotropic permeability tensor inside the expression of the mathematical formulation of the film condensation problem along a vertical surface embedded in a porous medium. The present analytical study reveals that the anisotropic permeability properties have a strong influence on the liquid film thickness, condensate mass flow rate and surface heat transfer rate. The comparison between thin and thick porous media is also presented.

  4. Evaluation of a numerical simulation model for a system coupling atmospheric gas, surface water and unsaturated or saturated porous medium.

    PubMed

    Hibi, Yoshihiko; Tomigashi, Akira; Hirose, Masafumi

    2015-12-01

    Numerical simulations that couple flow in a surface fluid with that in a porous medium are useful for examining problems of pollution that involve interactions among the atmosphere, surface water and groundwater, including, for example, saltwater intrusion along coasts. We previously developed a numerical simulation method for simulating a coupled atmospheric gas, surface water, and groundwater system (called the ASG method) that employs a saturation equation for flow in a porous medium; this equation allows both the void fraction of water in the surface system and water saturation in the porous medium to be solved simultaneously. It remained necessary, however, to evaluate how global pressure, including gas pressure, water pressure, and capillary pressure, should be specified at the boundary between the surface and the porous medium. Therefore, in this study, we derived a new equation for global pressure and integrated it into the ASG method. We then simulated water saturation in a porous medium and the void fraction of water in a surface system by the ASG method and reproduced fairly well the results of two column experiments. Next, we simulated water saturation in a porous medium (sand) with a bank, by using both the ASG method and a modified Picard (MP) method. We found only a slight difference in water saturation between the ASG and MP simulations. This result confirmed that the derived equation for global pressure was valid for a porous medium, and that the global pressure value could thus be used with the saturation equation for porous media. Finally, we used the ASG method to simulate a system coupling atmosphere, surface water, and a porous medium (110m wide and 50m high) with a trapezoidal bank. The ASG method was able to simulate the complex flow of fluids in this system and the interaction between the porous medium and the surface water or the atmosphere.

  5. Auger Intensity from Si(001)2×2-Al Surface Excited by Wave-Field in Medium-Energy Electron Diffraction

    NASA Astrophysics Data System (ADS)

    Horio, Yoshimi; Sakai, Daisuke

    2009-06-01

    From dynamical analysis of rocking curves from both reflection high-energy electron diffraction (RHEED) and medium-energy electron diffraction (MEED), the surface of Si(001)2×2-Al was confirmed to have a parallel-dimer structure. Furthermore, dynamical calculation, usually used to determine RHEED intensity, was confirmed to also be effective for the calculation of MEED intensity. The incident electron density distribution, or “wave-field”, was calculated for MEED conditions on the basis of the surface structure model. The wave-field at the surface is very sensitive to changes in diffraction conditions, such as the incident glancing angle. The Al(LMM) Auger electron intensity emitted from the Si(001)2×2-Al surface during MEED correlated to the wave-field intensity on the Al atomic rows relatively well.

  6. Interactions between nonlinear spur gear dynamics and surface wear

    NASA Astrophysics Data System (ADS)

    Ding, Huali; Kahraman, Ahmet

    2007-11-01

    In this study, two different dynamic models, a finite elements-based deformable-body model and a simplified discrete model, and a surface wear model are combined to study the interaction between gear surface wear and gear dynamic response. The proposed dynamic gear wear model includes the influence of worn surface profiles on dynamic tooth forces and transmission error as well as the influence of dynamic tooth forces on wear profiles. This paper first introduces the nonlinear dynamic models that include gear backlash and time-varying gear mesh stiffness, and a wear model separately. It presents a comparison to experiments for validation of the dynamic models. The dynamic models are combined with the wear model to study the interaction of surface wear and dynamic behavior in both linear and nonlinear response regimes. At the end, several sets of simulation results are used to demonstrate the two-way relationship between nonlinear gear dynamics and surface wear.

  7. Nonlinear Dynamics of Biofilm Growth on Sediment Surfaces

    NASA Astrophysics Data System (ADS)

    Molz, F. J.; Murdoch, L. C.; Faybishenko, B.

    2013-12-01

    Bioclogging often begins with the establishment of small colonies (microcolonies), which then form biofilms on the surfaces of a porous medium. These biofilm-porous media surfaces are not simple coatings of single microbes, but complex assemblages of cooperative and competing microbes, interacting with their chemical environment. This leads one to ask: what are the underlying dynamics involved with biofilm growth? To begin answering this question, we have extended the work of Kot et al. (1992, Bull. Mathematical Bio.) from a fully mixed chemostat to an idealized, one-dimensional, biofilm environment, taking into account a simple predator-prey microbial competition, with the prey feeding on a specified food source. With a variable (periodic) food source, Kot et al. (1992) were able to demonstrate chaotic dynamics in the coupled substrate-prey-predator system. Initially, deterministic chaos was thought by many to be mainly a mathematical phenomenon. However, several recent publications (e.g., Becks et al, 2005, Nature Letters; Graham et al. 2007, Int. Soc Microb. Eco. J.; Beninca et al., 2008, Nature Letters; Saleh, 2011, IJBAS) have brought together, using experimental studies and relevant mathematics, a breakthrough discovery that deterministic chaos is present in relatively simple biochemical systems. Two of us (Faybishenko and Molz, 2013, Procedia Environ. Sci)) have numerically analyzed a mathematical model of rhizosphere dynamics (Kravchenko et al., 2004, Microbiology) and detected patterns of nonlinear dynamical interactions supporting evidence of synchronized synergetic oscillations of microbial populations, carbon and oxygen concentrations driven by root exudation into a fully mixed system. In this study, we have extended the application of the Kot et al. model to investigate a spatially-dependent biofilm system. We will present the results of numerical simulations obtained using COMSOL Multi-Physics software, which we used to determine the nature of the

  8. Optimization of Medium Using Response Surface Methodology for Lipid Production by Scenedesmus sp.

    PubMed Central

    Yang, Fangfang; Long, Lijuan; Sun, Xiumei; Wu, Hualian; Li, Tao; Xiang, Wenzhou

    2014-01-01

    Lipid production is an important indicator for assessing microalgal species for biodiesel production. In this work, the effects of medium composition on lipid production by Scenedesmus sp. were investigated using the response surface methodology. The results of a Plackett–Burman design experiment revealed that NaHCO3, NaH2PO4·2H2O and NaNO3 were three factors significantly influencing lipid production, which were further optimized by a Box–Behnken design. The optimal medium was found to contain 3.07 g L−1 NaHCO3, 15.49 mg L−1 NaH2PO4·2H2O and 803.21 mg L−1 NaNO3. Using the optimal conditions previously determined, the lipid production (304.02 mg·L−1) increased 54.64% more than that using the initial medium, which agreed well with the predicted value 309.50 mg L−1. Additionally, lipid analysis found that palmitic acid (C16:0) and oleic acid (C18:1) dominantly constituted the algal fatty acids (about 60% of the total fatty acids) and a much higher content of neutral lipid accounted for 82.32% of total lipids, which strongly proved that Scenedesmus sp. is a very promising feedstock for biodiesel production. PMID:24663113

  9. Effective medium intrasubband surface plasmon-polaritons on semi-infinite GaAs/AlAs superlattices

    NASA Astrophysics Data System (ADS)

    Constantinou, N. C.; Elmzughi, F. G.

    1996-03-01

    The effective medium theory of the long wavelength surface electromagnetic excitations of a multi-layered medium is employed to describe the surface plasmon-polaritons of a semi-infinite array of strictly two-dimensional charge sheets. A virtual p-polarised surface plasmon polariton is predicted and its associated attenuated total reflection (ATR) reflectivity calculated for typical parameters. The existence criteria for this surface polariton are less restrictive than for the Giuliani and Quinn surface mode. A radiative Brewster mode is also found and this mode may be observed via oblique incidence reflectivity.

  10. Aquatic flower-inspired cell culture platform with simplified medium exchange process for facilitating cell-surface interaction studies.

    PubMed

    Hong, Hyeonjun; Park, Sung Jea; Han, Seon Jin; Lim, Jiwon; Kim, Dong Sung

    2016-02-01

    Establishing fundamentals for regulating cell behavior with engineered physical environments, such as topography and stiffness, requires a large number of cell culture experiments. However, cell culture experiments in cell-surface interaction studies are generally labor-intensive and time-consuming due to many experimental tasks, such as multiple fabrication processes in sample preparation and repetitive medium exchange in cell culture. In this work, a novel aquatic flower-inspired cell culture platform (AFIP) is presented. AFIP aims to facilitate the experiments on the cell-surface interaction studies, especially the medium exchange process. AFIP was devised to capture and dispense cell culture medium based on interactions between an elastic polymer substrate and a liquid medium. Thus, the medium exchange can be performed easily and without the need of other instruments, such as a vacuum suction and pipette. An appropriate design window of AFIP, based on scaling analysis, was identified to provide a criterion for achieving stability in medium exchange as well as various surface characteristics of the petal substrates. The developed AFIP, with physically engineered petal substrates, was also verified to exchange medium reliably and repeatedly. A closed structure capturing the medium was sustained stably during cell culture experiments. NIH3T3 proliferation results also demonstrated that AFIP can be applied to the cell-surface interaction studies as an alternative to the conventional method.

  11. Optimization of a cryoprotective medium to increase the viability of freeze-dried Streptococcus thermophilus by response surface methodology

    USDA-ARS?s Scientific Manuscript database

    Streptococcus thermophilus normally exhibits different survival rates in different bacteria medium during freeze-drying. In this study, response surface methodology (RSM) was applied on the design of experiments for optimizing the cryoprotective medium. Results showed that the most significant facto...

  12. Molecular dynamics simulations of soliton-like structures in a dusty plasma medium

    SciTech Connect

    Tiwari, Sanat Kumar Das, Amita; Sen, Abhijit; Kaw, Predhiman

    2015-03-15

    The existence and evolution of soliton-like structures in a dusty plasma medium are investigated in a first principles approach using molecular dynamic (MD) simulations of particles interacting via a Yukawa potential. These localized structures are found to exist in both weakly and strongly coupled regimes with their structures becoming sharper as the correlation effects between the dust particles get stronger. A surprising result, compared to fluid simulations, is the existence of rarefactive soliton-like structures in our non-dissipative system, a feature that arises from the charge conjugation symmetry property of the Yukawa fluid. Our simulation findings closely resemble many diverse experimental results reported in the past.

  13. Typical medium dynamical cluster approximation for the study of Anderson localization in three dimensions

    NASA Astrophysics Data System (ADS)

    Ekuma, C. E.; Terletska, H.; Tam, K.-M.; Meng, Z.-Y.; Moreno, J.; Jarrell, M.

    2014-02-01

    We develop a systematic typical medium dynamical cluster approximation that provides a proper description of the Anderson localization transition in three dimensions (3D). Our method successfully captures the localization phenomenon both in the low and large disorder regimes, and allows us to study the localization in different momenta cells, which renders the discovery that the Anderson localization transition occurs in a cell-selective fashion. As a function of cluster size, our method systematically recovers the reentrance behavior of the mobility edge and obtains the correct critical disorder strength for Anderson localization in 3D.

  14. Response surface optimization of culture medium for enhanced docosahexaenoic acid production by a Malaysian thraustochytrid

    PubMed Central

    Manikan, Vidyah; Kalil, Mohd Sahaid; Hamid, Aidil Abdul

    2015-01-01

    Docosahexaenoic acid (DHA, C22:6n-3) plays a vital role in the enhancement of human health, particularly for cognitive, neurological, and visual functions. Marine microalgae, such as members of the genus Aurantiochytrium, are rich in DHA and represent a promising source of omega-3 fatty acids. In this study, levels of glucose, yeast extract, sodium glutamate and sea salt were optimized for enhanced lipid and DHA production by a Malaysian isolate of thraustochytrid, Aurantiochytrium sp. SW1, using response surface methodology (RSM). The optimized medium contained 60 g/L glucose, 2 g/L yeast extract, 24 g/L sodium glutamate and 6 g/L sea salt. This combination produced 17.8 g/L biomass containing 53.9% lipid (9.6 g/L) which contained 44.07% DHA (4.23 g/L). The optimized medium was used in a scale-up run, where a 5 L bench-top bioreactor was employed to verify the applicability of the medium at larger scale. This produced 24.46 g/L biomass containing 38.43% lipid (9.4 g/L), of which 47.87% was DHA (4.5 g/L). The total amount of DHA produced was 25% higher than that produced in the original medium prior to optimization. This result suggests that Aurantiochytrium sp. SW1 could be developed for industrial application as a commercial DHA-producing microorganism. PMID:25721623

  15. Study of the Surface Heterogeneity of icy dwarf?planets and other medium size Kuiper Belt objects

    NASA Astrophysics Data System (ADS)

    Pinilla-Alonso, Noemi; Emery, Josh P.

    2015-10-01

    We propose a comprehensive analysis of the surface heterogeneity of a selected sample of dwarf-planets and candidates to be considered as dwarf-planets. The sample has been carefully selected to reach the scientific goals with a relative low cost in observing time. The research proposed here will be based on the analysis of the light-curve of these objects obtained using IRAC/Spitzer photometry. KBOs likely retain some of the most primitive material in the Solar System. Models of the retention of volatiles by small-bodies in the Solar System show that dwarf-planets can retain most of the original inventory of volatiles. A good example is Pluto. The surface of this body is formed by patches of CH4, N2 and CO and exhibits a large degree of surface heterogeneity. Our preliminary results of the IRAC/Spitzer light curves of Pluto, obtained by this group in 2004 and 2014, show the potential of these data to map the surface distribution of the different species of ices on the surface of KBOs. For this project we have selected six objects (out of a list of 15) that are ideal for this study using Spitzer photometry. Our sample covers two classes of bodies: Eris, Makemake and Haumea, all large enough to retain volatiles and so how signs of sublimation and condensation cycles on their surfaces; and Quaoar, Varuna and Ixion (D<1000 km) that may not have retained volatiles. If signs of heterogeneity are detected on IRAC data from these medium bodies (as suggested by previous studies) this could be due to a combination of collisions and irradiation. By addressing the compositional heterogeneity of this sample of KBOs the proposed work will address gaps in the scientific knowledge of the chemical and dynamical history of the outer Solar System as well as other planetary systems.}

  16. Surface complexation reaction for phase transfer of hydrophobic quantum dot from nonpolar to polar medium.

    PubMed

    Bhandari, Satyapriya; Roy, Shilaj; Pramanik, Sabyasachi; Chattopadhyay, Arun

    2014-09-09

    Chemical reaction between oleate-capped Zn(x)Cd(1-x)S quantum dots (Qdots) and 8-hydroxyquinoline (HQ) led to formation of a surface complex, which was accompanied by transfer of hydrophobic Qdots from nonpolar (hexane) to polar (water) medium with high efficiency. The stability of the complex on the surface was achieved via involvement of dangling sulfide bonds. Moreover, the transferred hydrophilic Qdots--herein called as quantum dot complex (QDC)--exhibited new and superior optical properties in comparison to bare inorganic complexes with retention of the dimension and core structure of the Qdots. Finally, the new and superior optical properties of water-soluble QDC make them potentially useful for biological--in addition to light emitting device (LED)--applications.

  17. Ethanol oxidation on Pt single-crystal electrodes: surface-structure effects in alkaline medium.

    PubMed

    Busó-Rogero, Carlos; Herrero, Enrique; Feliu, Juan M

    2014-07-21

    Ethanol oxidation in 0.1 M NaOH on single-crystal electrodes has been studied using electrochemical and FTIR techniques. The results show that the activity order is the opposite of that found in acidic solutions. The Pt(111) electrode displays the highest currents and also the highest onset potential of all the electrodes. The onset potential for the oxidation of ethanol is linked to the adsorption of OH on the electrode surface. However, small (or even negligible) amounts of CO(ads) and carbonate are detected by FTIR, which implies that cleavage of the C-C bond is not favored in this medium. The activity of the electrodes diminishes quickly upon cycling. The diminution of the activity is proportional to the measured currents and is linked to the formation and polymerization of acetaldehyde, which adsorbs onto the electrode surface and prevents further oxidation.

  18. Enhancement of the visibility of objects located below the surface of a scattering medium

    DOEpatents

    Demos, Stavros

    2013-11-19

    Techniques are provided for enhancing the visibility of objects located below the surface of a scattering medium such as tissue, water and smoke. Examples of such an object include a vein located below the skin, a mine located below the surface of the sea and a human in a location covered by smoke. The enhancement of the image contrast of a subsurface structure is based on the utilization of structured illumination. In the specific application of this invention to image the veins in the arm or other part of the body, the issue of how to control the intensity of the image of a metal object (such as a needle) that must be inserted into the vein is also addressed.

  19. Dynamic wormholes, antitrapped surfaces, and energy conditions

    SciTech Connect

    Hochberg, D.; Visser, M.

    1998-08-01

    It is by now apparent that topology is too crude a tool to accurately characterize a generic traversable wormhole. In two earlier papers we developed a complete characterization of generic but static traversable wormholes, and in the present paper extend the discussion to arbitrary time-dependent (dynamical) wormholes. A local definition of a wormhole throat, free from assumptions about asymptotic flatness, symmetries, future and past null infinities, embedding diagrams, topology, and even time dependence is developed that accurately captures the essence of what a wormhole throat is, and where it is located. Adapting and extending a suggestion due to Page, we define a wormhole throat to be a marginally anti-trapped surface, that is, a closed two-dimensional spatial hypersurface such that one of the two future-directed null geodesic congruences orthogonal to it is just beginning to diverge. Typically a dynamic wormhole will possess {ital two} such throats, corresponding to the two orthogonal null geodesic congruences, and these two throats will not coincide (though they do coalesce into a single throat in the static limit). The divergence property of the null geodesics at the marginally anti-trapped surface generalizes the {open_quotes}flare-out{close_quotes} condition for an arbitrary wormhole. We derive theorems regarding violations of the null energy condition (NEC) at and near these throats and find that, even for wormholes with arbitrary time dependence, the violation of the NEC is a generic property of wormhole throats. We also discuss wormhole throats in the presence of fully antisymmetric torsion and find that the energy condition violations {ital cannot} be dumped into the torsion degrees of freedom. Finally by means of a concrete example we demonstrate that even temporary suspension of energy-condition violations is incompatible with the flare-out property of dynamic throats. {copyright} {ital 1998} {ital The American Physical Society}

  20. Dynamic wormholes, antitrapped surfaces, and energy conditions

    NASA Astrophysics Data System (ADS)

    Hochberg, David; Visser, Matt

    1998-08-01

    It is by now apparent that topology is too crude a tool to accurately characterize a generic traversable wormhole. In two earlier papers we developed a complete characterization of generic but static traversable wormholes, and in the present paper extend the discussion to arbitrary time-dependent (dynamical) wormholes. A local definition of a wormhole throat, free from assumptions about asymptotic flatness, symmetries, future and past null infinities, embedding diagrams, topology, and even time dependence is developed that accurately captures the essence of what a wormhole throat is, and where it is located. Adapting and extending a suggestion due to Page, we define a wormhole throat to be a marginally anti-trapped surface, that is, a closed two-dimensional spatial hypersurface such that one of the two future-directed null geodesic congruences orthogonal to it is just beginning to diverge. Typically a dynamic wormhole will possess two such throats, corresponding to the two orthogonal null geodesic congruences, and these two throats will not coincide (though they do coalesce into a single throat in the static limit). The divergence property of the null geodesics at the marginally anti-trapped surface generalizes the ``flare-out'' condition for an arbitrary wormhole. We derive theorems regarding violations of the null energy condition (NEC) at and near these throats and find that, even for wormholes with arbitrary time dependence, the violation of the NEC is a generic property of wormhole throats. We also discuss wormhole throats in the presence of fully antisymmetric torsion and find that the energy condition violations cannot be dumped into the torsion degrees of freedom. Finally by means of a concrete example we demonstrate that even temporary suspension of energy-condition violations is incompatible with the flare-out property of dynamic throats.

  1. Optimizing the medium components in bioemulsifiers production by Candida lipolytica with response surface method.

    PubMed

    Albuquerque, C D C; Filetti, A M F; Campos-Takaki, G M

    2006-06-01

    A response surface methodology was used to study bioemulsifier production by Candida lipolytica. A 2(4) full experimental design was previously carried out to investigate the effects and interactions of the concentrations of corn oil, urea, ammonium sulfate, and potassium dihydrogen orthophosphate on the emulsification activity (EA) of the bioemulsifier produced by C. lipolytica. The best EA value (3.727 units of emulsification activity (UEA)) was obtained with a medium composed of 0.4 g of urea, 1.1 g of ammonium sulfate, 2.04 g of potassium dihydrogen orthophosphate, 5 mL of corn oil, 50 mL of distilled water, and 50 mL of seawater. A curvature check was performed and revealed a lack of fit of the linear approximation. The proximity of the optimum point was evident, as was the need for quadratic model and second-order designs that incorporate the effect of the curvature. Medium constituents were then optimized for the EA using a three-factor central composite design and response surface methodology. The second-order model showed statistical significance and predictive ability. It was found that the maximum EA produced was 4.415 UEA, and the optimum levels of urea, ammonium sulfate, and potassium dihydrogen orthophosphate were, respectively, 0.544% (m/v), 2.131% (m/v), and 2.628% (m/v).

  2. Free surface dynamics of nematic liquid crystal

    NASA Astrophysics Data System (ADS)

    Cummings, Linda; Kondic, Lou; Lam, Michael; Lin, Te-Sheng

    2014-11-01

    Spreading thin films of nematic liquid crystal (NLC) are known to behave very differently to those of isotropic fluids. The polar interactions of the rod-like molecules with each other, and the interactions with the underlying substrate, can lead to intricate patterns and instabilities that are not yet fully understood. The physics of a system even as simple as a film of NLC spreading slowly over a surface (inclined or horizontal) are remarkably complex: the outcome depends strongly on the details of the NLC's behavior at both the substrate and the free surface (so-called ``anchoring'' effects). We will present a dynamic flow model that takes careful account of such nematic-substrate and nematic-free surface interactions. We will present model simulations for several different flow scenarios that indicate the variety of behavior that can emerge. Spreading over a horizontal substrate may exhibit a range of unstable behavior. Flow down an incline also exhibits intriguing instabilities: in addition to the usual transverse fingering, instabilities can be manifested behind the flowing front in a manner reminiscent of Newtonian flow down an inverted substrate. NSF DMS-1211713.

  3. Water dynamics near solutes and surfaces

    NASA Astrophysics Data System (ADS)

    Moilanen, David Emil

    The hydrogen bonding structure and dynamics of water are fundamentally important in a wide range of chemical, biological, geological, and industrial systems. Infrared spectroscopy of the OD stretch of dilute HOD in H2 O provides a sensitive probe of the hydrogen bonding network of water. Water forms a nominally tetrahedral hydrogen bonding network as a liquid but rapid hydrogen bond switching events lead to fast water reorientation. A mechanism for water reorientation that involves large amplitude angular jumps has recently been proposed to describe the long time orientational dynamics. At short times, water molecules quickly sample a restricted range of angular space within an intact hydrogen bonding configuration. The amplitude of this inertial reorientation depends on the strength of the local hydrogen bonding network. When hydrogen bonds are stronger, the water is restricted to a smaller angular range about the hydrogen bond axis. Weaker hydrogen bonds allow larger angular excursions. A simple model for the angular hydrogen bond potential energy surface is presented based on the experimental data. Water is rarely found as a pure liquid in real systems. Often it is in contact with a surface and its dynamics are modified near the surface. Reverse micelles formed using the surfactant Aerosol-OT (AOT), water, and isooctane, as well as AOT lamellar structures provide well-defined, tunable model systems to study the dynamics of water interacting with an interface. Reverse micelles are spherical water pools with radii that can be varied from less than one nanometer up to tens of nanometers. Lamellar structures are surfactant bilayers separated by thin sheets of water ranging in thickness from approximately one nanometer up to four nanometers. In large reverse micelles and lamellar structures, the confined water can be separated into two components, a core of bulk-like water and a shell of interfacial water. Polarization selective pump-probe spectroscopy of the OD

  4. Analysis of Tropical Forest Structure Dynamics Using Medium-footprint Lidar and Landsat Time Series Stacks

    NASA Astrophysics Data System (ADS)

    Tang, H.; Huang, C.; Dubayah, R.

    2011-12-01

    Forest often recovers after a disturbance event until it reaches an equilibrium stage. This process can be observed through examining several geophysical parameters (e.g. biomass, canopy height and LAI). Quantifying these parameters at fine scale is important for understanding carbon stocks and fluxes. The La Selva Biological Station in Costa Rica is a good example for studying secondary forest regrowth from disturbance. Since Lidar can provide the most accurate estimate of biomass compared to other remote sensing methods and Landsat has produced the longest imagery record of forest, we will explore the dynamics of tropical forest with both medium footprint lidar and landsat images. LVIS, a medium footprint airborne scanning lidar, has surveyed this area in March of 1998 and 2005. A highly automated algorithm, vegetation change tracker (VCT) has been developed for reconstructing recent forest disturbance history starting from 1984 using Landsat time series stacks (LTSS).Need to discuss what you will do, what are the expected results and their significances. We will try to establish empirical relationship between Lidar and landsat images to analysis tropical forest dynamics from 1984 to 2005.

  5. Rhamnolipids elicit the same cytotoxic sensitivity between cancer cell and normal cell by reducing surface tension of culture medium.

    PubMed

    Jiang, Lifang; Shen, Chong; Long, Xuwei; Zhang, Guoliang; Meng, Qin

    2014-12-01

    Biosurfactant rhamnolipids have been claimed to show biological activities of inhibiting the proliferation of cancer cells. In this study, the cytotoxicity of rhamnolipids was examined on four cancer cells (HepG2, Caco-2, Hela, MCF-7 cells) and two normal cells (HK-2 cell, primary hepatocyte). Interestingly, both cancer cells and normal cells exhibited similar sensitivities to the addition of rhamnolipids in culture medium, and the cytotoxicity was largely attenuated by the presence of fetal bovine serum (FBS) in culture medium. In correlation of the mono-/di-rhamnolipid cytotoxicity with the surface tension of culture medium, it was found that rhamnolipids triggered cytotoxicity whenever the surface tension of culture medium decreased below 41 mN/m irrespective of the FBS content in culture medium, cell line, or rhamnolipid congener. Similarly, each chemical surfactant (Tween-80, sodium dodecyl sulfate, and sodium dodecyl benzene sulfonate) could cause cytotoxicity on HepG2 cells whenever its addition made the surface tension under 41 mN/m in culture medium with or without the presence of FBS. It seems that rhamnolipids, like chemical surfactants, exhibited cytotoxicity by reducing the surface tension of culture medium rather than by changing its specific molecular structure, which had no selection on tumor cells. This study could offer helps to correct the misleading biological activity of rhamnolipids and to avoid the possible large wastes of time and expenses on developing the applications in antitumor drugs.

  6. Multi-parameter Full-waveform Inversion for Acoustic VTI Medium with Surface Seismic Data

    NASA Astrophysics Data System (ADS)

    Cheng, X.; Jiao, K.; Sun, D.; Huang, W.; Vigh, D.

    2013-12-01

    Full-waveform Inversion (FWI) attracts wide attention recently in oil and gas industry as a new promising tool for high resolution subsurface velocity model building. While the traditional common image point gather based tomography method aims to focus post-migrated data in depth domain, FWI aims to directly fit the observed seismic waveform in either time or frequency domain. The inversion is performed iteratively by updating the velocity fields to reduce the difference between the observed and the simulated data. It has been shown the inversion is very sensitive to the starting velocity fields, and data with long offsets and low frequencies is crucial for the success of FWI to overcome this sensitivity. Considering the importance of data with long offsets and low frequencies, in most geologic environment, anisotropy is an unavoidable topic for FWI especially at long offsets, since anisotropy tends to have more pronounced effects on waves traveled for a great distance. In VTI medium, this means more horizontal velocity will be registered in middle-to-long offset data, while more vertical velocity will be registered in near-to-middle offset data. Up to date, most of real world applications of FWI still remain in isotropic medium, and only a few studies have been shown to account for anisotropy. And most of those studies only account for anisotropy in waveform simulation, but not invert for those anisotropy fields. Multi-parameter inversion for anisotropy fields, even in VTI medium, remains as a hot topic in the field. In this study, we develop a strategy for multi-parameter FWI for acoustic VTI medium with surface seismic data. Because surface seismic data is insensitivity to the delta fields, we decide to hold the delta fields unchanged during our inversion, and invert only for vertical velocity and epsilon fields. Through parameterization analysis and synthetic tests, we find that it is more feasible to invert for the parameterization as vertical and horizontal

  7. Stratified spectral mixture analysis of medium resolution imagery for impervious surface mapping

    NASA Astrophysics Data System (ADS)

    Sun, Genyun; Chen, Xiaolin; Ren, Jinchang; Zhang, Aizhu; Jia, Xiuping

    2017-08-01

    Linear spectral mixture analysis (LSMA) is widely employed in impervious surface estimation, especially for estimating impervious surface abundance in medium spatial resolution images. However, it suffers from a difficulty in endmember selection due to within-class spectral variability and the variation in the number and the type of endmember classes contained from pixel to pixel, which may lead to over or under estimation of impervious surface. Stratification is considered as a promising process to address the problem. This paper presents a stratified spectral mixture analysis in spectral domain (Sp_SSMA) for impervious surface mapping. It categorizes the entire data into three groups based on the Combinational Build-up Index (CBI), the intensity component in the color space and the Normalized Difference Vegetation Index (NDVI) values. A suitable endmember model is developed for each group to accommodate the spectral variation from group to group. The unmixing into the associated subset (or full set) of endmembers in each group can make the unmixing adaptive to the types of endmember classes that each pixel actually contains. Results indicate that the Sp_SSMA method achieves a better performance than full-set-endmember SMA and prior-knowledge-based spectral mixture analysis (PKSMA) in terms of R, RMSE and SE.

  8. Laser ablation of liquid surface in air induced by laser irradiation through liquid medium

    NASA Astrophysics Data System (ADS)

    Utsunomiya, Yuji; Kajiwara, Takashi; Nishiyama, Takashi; Nagayama, Kunihito; Kubota, Shiro; Nakahara, Motonao

    2010-10-01

    The pulse laser ablation of a liquid surface in air when induced by laser irradiation through a liquid medium has been experimentally investigated. A supersonic liquid jet is observed at the liquid-air interface. The liquid surface layer is driven by a plasma plume that is produced by laser ablation at the layer, resulting in a liquid jet. This phenomenon occurs only when an Nd:YAG laser pulse (wavelength: 1064 nm) is focused from the liquid onto air at a low fluence of 20 J/cm2. In this case, as Fresnel’s law shows, the incident and reflected electric fields near the liquid surface layer are superposed constructively. In contrast, when the incident laser is focused from air onto the liquid, a liquid jet is produced only at an extremely high fluence, several times larger than that in the former case. The similarities and differences in the liquid jets and atomization processes are studied for several liquid samples, including water, ethanol, and vacuum oil. The laser ablation of the liquid surface is found to depend on the incident laser energy and laser fluence. A pulse laser light source and high-resolution film are required to observe the detailed structure of a liquid jet.

  9. Effect of laser pulse propagation on ultrafast magnetization dynamics in a birefringent medium

    NASA Astrophysics Data System (ADS)

    de Jong, J. A.; Kalashnikova, A. M.; Pisarev, R. V.; Balbashov, A. M.; Kimel, A. V.; Kirilyuk, A.; Rasing, Th

    2017-04-01

    Light propagation effects can strongly influence the excitation and the detection of laser-induced magnetization dynamics. We investigated experimentally and analytically the effects of crystallographic linear birefringence on the excitation and detection of ultrafast magnetization dynamics in the rare-earth orthoferrites (Sm0.5Pr0.5)FeO3 and (Sm0.55Tb0.45)FeO3, which possess weak and strong linear birefringence, respectively. Our finding is that the effect of linear birefringence on the result of a magneto-optical pump-probe experiment strongly depends on the mechanism of excitation. When magnetization dynamics, probed by means of the Faraday effect, is excited via a rapid, heat-induced phase transition, the measured rotation of the probe pulse polarization is strongly suppressed due to the birefringence. This contrasts with the situation for magnetization dynamics induced by the ultrafast inverse Faraday effect, where the corresponding probe polarization rotation values were larger in the orthoferrite with strong linear birefringence. We show that this striking difference results from an interplay between the polarization transformations experienced by pump and probe pulses in the birefringent medium.

  10. Static and dynamic friction of hierarchical surfaces

    NASA Astrophysics Data System (ADS)

    Costagliola, Gianluca; Bosia, Federico; Pugno, Nicola M.

    2016-12-01

    Hierarchical structures are very common in nature, but only recently have they been systematically studied in materials science, in order to understand the specific effects they can have on the mechanical properties of various systems. Structural hierarchy provides a way to tune and optimize macroscopic mechanical properties starting from simple base constituents and new materials are nowadays designed exploiting this possibility. This can be true also in the field of tribology. In this paper we study the effect of hierarchical patterned surfaces on the static and dynamic friction coefficients of an elastic material. Our results are obtained by means of numerical simulations using a one-dimensional spring-block model, which has previously been used to investigate various aspects of friction. Despite the simplicity of the model, we highlight some possible mechanisms that explain how hierarchical structures can significantly modify the friction coefficients of a material, providing a means to achieve tunability.

  11. Static and dynamic friction of hierarchical surfaces.

    PubMed

    Costagliola, Gianluca; Bosia, Federico; Pugno, Nicola M

    2016-12-01

    Hierarchical structures are very common in nature, but only recently have they been systematically studied in materials science, in order to understand the specific effects they can have on the mechanical properties of various systems. Structural hierarchy provides a way to tune and optimize macroscopic mechanical properties starting from simple base constituents and new materials are nowadays designed exploiting this possibility. This can be true also in the field of tribology. In this paper we study the effect of hierarchical patterned surfaces on the static and dynamic friction coefficients of an elastic material. Our results are obtained by means of numerical simulations using a one-dimensional spring-block model, which has previously been used to investigate various aspects of friction. Despite the simplicity of the model, we highlight some possible mechanisms that explain how hierarchical structures can significantly modify the friction coefficients of a material, providing a means to achieve tunability.

  12. Microchannel anechoic corner for size-selective separation and medium exchange via traveling surface acoustic waves.

    PubMed

    Destgeer, Ghulam; Ha, Byung Hang; Park, Jinsoo; Jung, Jin Ho; Alazzam, Anas; Sung, Hyung Jin

    2015-05-05

    We demonstrate a miniaturized acoustofluidic device composed of a pair of slanted interdigitated transducers (SIDTs) and a polydimethylsiloxane microchannel for achieving size-selective separation and exchange of medium around polystyrene particles in a continuous, label-free, and contactless fashion. The SIDTs, deposited parallel to each other, produce tunable traveling surface acoustic waves (TSAWs) at desired locations, which, in turn, yield an anechoic corner inside the microchannel that is used to selectively deflect particles of choice from their streamlines. The TSAWs with frequency fR originating from the right SIDT and propagating left toward the microchannel normal to the fluid flow direction, laterally deflect larger particles with diameter d1 from the hydrodynamically focused sample fluid that carries other particles as well with diameters d2 and d3, such that d1 > d2 > d3. The deflected particles (d1) are pushed into the top-left corner of the microchannel. Downstream, the TSAWs with frequency fL, such that fL > fR, disseminating from the left SIDT, deflect the medium-sized particles (d2) rightward, leaving behind the larger particles (d1) unaffected in the top-left anechoic corner and the smaller particles (d3) in the middle of the microchannel, thereby achieving particle separation. A particle not present in the anechoic corner could be deflected rightward to realize twice the medium exchange. In this work, the three-way separation of polystyrene particles with diameters of 3, 4.2, and 5 μm and 3, 5, and 7 μm is achieved using two separate devices. Moreover, these devices are used to demonstrate multimedium exchange around polystyrene particles ∼5 μm and 7 μm in diameter.

  13. Response surface method optimization of ectoine fermentation medium with moderate halophilic bacteria Halomonas sp. H02

    NASA Astrophysics Data System (ADS)

    Li, T. T.; Qu, A.; Yuan, X. N.; Tan, F. X.; Li, X. W.; Wang, T.; Zhang, L. H.

    2017-07-01

    Moderate halophilic bacteria are of halophilic bacteria whose suitable growth of NaCl is 5-10%. When the moderate halophilic bacteria response to high osmotic stress, the intracellular will synthesize small organic molecule compatible solutes. Ectoine, which is the major synthetic osmotic compatible solutes for moderate halophilic bacteria, can help microbial enzymes, nucleic acids and the whole cell resist to hypertonic, high temperature, freezing and other inverse environment. In order to increase the Ectoine production of Moderate halophilic bacteria Halomonas sp. H02, the Ectoine fermentation medium component was optimized by Plackett-Burman (PB) and Response Surface Methodology (RSM) based on the principle of non-complete equilibrium The results of PB experiments showed that the three main influencing factors of Moderate halophilic bacteria Halomonas sp. H02 synthesis Ectoine culture medium were C5H8NNaO4 concentration, NaCl concentration and initial pH. According to the center point of the steepest climbing experiment, the central combination design experiment was used to show that the model is consistent with the actual situation. The optimum combination of three influencing factors were C5H8NNaO4 41 g/L, NaCl 87.2 g/L and initial pH 5.9, and the predicted amount of Ectoine was 1835.8 mg/L, increased by 41.6%.

  14. Splitting culture medium by air-jet and rewetting for the assessment of the wettability of cultured epithelial cell surfaces.

    PubMed

    Tanaka, Nobuyuki; Kondo, Makoto; Uchida, Ryohei; Kaneko, Makoto; Sugiyama, Hiroaki; Yamato, Masayuki; Okano, Teruo

    2013-12-01

    This study found that the phenomenon of rewetting after squeezing culture medium varied in different culture conditions for rat oral mucosal epithelial cells. When culture medium covering over cultured cells was squeezed by an air-jet application, the motion of squeezed culture medium was able to be observed by using a commercially available movie camera. Squeezed width on cells cultured in keratinocyte culture medium (KCM), which contained with fetal bovine serum, was one-sixth of that in FBS-free KCM. This result corresponded to the mucous layer staining statuses of cultured cells in both cases; positive in KCM and negative in FBS-free medium. Furthermore, the gene expression of mucous glycoprotein MUC4 in KCM was 100 times higher than that in FBS-free medium, and the expression of MUC4 protein only showed on the apical surface of cells cultured in KCM. The relative gene expression levels of MUC1, 13, 15, and 16 in both the normal and FBS-free medium were found to be no more than one-thirtieth of that of MUC4 in KCM. The main factor of the wettability difference between KCM and FBS-free medium was speculated to be the difference of MUC4 expression between both media. This method can be a simple technique for testing not only the surface wettability but also the mucous formation of cultured cells.

  15. An effective medium study of surface plasmon polaritons in nanostructured gratings using attenuated total reflection

    SciTech Connect

    Tyboroski, M. H.; Anderson, N. R.; Camley, R. E.

    2014-01-07

    Recent work studied surface plasmon resonances in structured materials by the method of attenuated total reflection using a prism on top of a metallic grating. That calculation considered Transverse Magnetic polarized radiation, involved an expansion in 121 Fourier modes, and found a number of interesting features. Many of these features were attributed to localized plasmons or other factors, which arise from a discrete structure. We use a simple effective medium theory to address the same problem, and find many of the same reflection features observed in the more complex calculation, indicating that localization is not an important factor. We also evaluate the possibility of using some of the new features in the reflection spectrum for bio-sensing and find that the sensitivity of the system to small changes in relative permittivity is increased compared to some standard methods.

  16. Surface Selective Oxide Reduction During the Intercritical Annealing of Medium Mn Steel

    NASA Astrophysics Data System (ADS)

    Jo, Kyoung Rae; Cho, Lawrence; Oh, Jong Han; Kim, Myoung Soo; Kang, Ki Cheol; De Cooman, Bruno C.

    2017-08-01

    Third generation advanced high-strength steels achieve an excellent strength-ductility balance using a cost-effective alloy composition. During the continuous annealing of medium Mn steel, the formation of an external selective oxide layer of MnO has a negative impact on the coating quality after galvanizing. A procedure to reduce the selective oxide was therefore developed. It involves annealing in the temperature range of 1073 K to 1323 K (800 °C to 1050 °C) in a HNx gas atmosphere. Annealing at higher temperatures and the use of larger H2 volume fractions are shown to make the gas atmosphere reducing with respect to MnO. The reduction of the surface MnO layer was observed by SEM, GDOES, and cross-sectional TEM analysis.

  17. Hot Deformation Behavior and Dynamic Recrystallization of Medium Carbon LZ50 Steel

    NASA Astrophysics Data System (ADS)

    Du, Shiwen; Chen, Shuangmei; Song, Jianjun; Li, Yongtang

    2017-01-01

    Hot deformation and dynamic recrystallization behaviors of a medium carbon steel LZ50 were systematically investigated in the temperature range from 1143 K to 1443 K (870 °C to 1170 °C) at strain rates from 0.05 to 3s-1 using a Gleeble-3500 thermo-simulation machine. The flow stress constitutive equation for hot deformation of this steel was developed with the two-stage Laasraoui equation. The activation energy of the tested steel was 304.27 KJ/mol, which was in reasonable agreement with those reported previously. The flow stress of this steel in hot deformation was mainly controlled by dislocation climb during their intragranular motion. The effect of Zener-Hollomon parameter on the characteristic points of the flow curves was studied, and the dependence of critical strain on peak strain obeyed a linear equation. Dynamic recrystallization was the most important softening mechanism for the tested steel during hot deformation. Kinetic equation of this steel was also established based on the flow stress. The austenite grain size of complete dynamic recrystallization was a power law function of Zener-Hollomon parameter with an exponent of -0.2956. Moreover, the microstructures induced under different deformation conditions were analyzed.

  18. Insights into Medium-chain Acyl-CoA Dehydrogenase Structure by Molecular Dynamics Simulations.

    PubMed

    Bonito, Cátia A; Leandro, Paula; Ventura, Fátima V; Guedes, Rita C

    2016-08-01

    The medium-chain acyl-CoA dehydrogenase (MCAD) is a mitochondrial enzyme that catalyzes the first step of mitochondrial fatty acid β-oxidation (mFAO) pathway. Its deficiency is the most common genetic disorder of mFAO. Many of the MCAD disease-causing variants, including the most common p.K304E variant, show loss of function due to protein misfolding. Herein, we used molecular dynamics simulations to provide insights into the structural stability and dynamic behavior of MCAD wild-type (MCADwt) and validate a structure that would allow reliable new studies on its variants. Our results revealed that in both proteins the flavin adenine dinucleotide (FAD) has an important structural role on the tetramer stability and also in maintaining the volume of the enzyme catalytic pockets. We confirmed that the presence of substrate changes the dynamics of the catalytic pockets and increases FAD affinity. A comparison between the porcine MCADwt (pMCADwt) and human MCADwt (hMCADwt) structures revealed that both proteins are essentially similar and that the reversion of the double mutant E376G/T255E of hMCAD enzyme does not affect the structure of the protein neither its behavior in simulation. Our validated hMCADwt structure is crucial for complementing and accelerating the experimental studies aiming for the discovery and development of potential stabilizers of MCAD variants as candidates for the treatment of MCAD deficiency (MCADD).

  19. Hot Deformation Behavior and Dynamic Recrystallization of Medium Carbon LZ50 Steel

    NASA Astrophysics Data System (ADS)

    Du, Shiwen; Chen, Shuangmei; Song, Jianjun; Li, Yongtang

    2017-03-01

    Hot deformation and dynamic recrystallization behaviors of a medium carbon steel LZ50 were systematically investigated in the temperature range from 1143 K to 1443 K (870 °C to 1170 °C) at strain rates from 0.05 to 3s-1 using a Gleeble-3500 thermo-simulation machine. The flow stress constitutive equation for hot deformation of this steel was developed with the two-stage Laasraoui equation. The activation energy of the tested steel was 304.27 KJ/mol, which was in reasonable agreement with those reported previously. The flow stress of this steel in hot deformation was mainly controlled by dislocation climb during their intragranular motion. The effect of Zener-Hollomon parameter on the characteristic points of the flow curves was studied, and the dependence of critical strain on peak strain obeyed a linear equation. Dynamic recrystallization was the most important softening mechanism for the tested steel during hot deformation. Kinetic equation of this steel was also established based on the flow stress. The austenite grain size of complete dynamic recrystallization was a power law function of Zener-Hollomon parameter with an exponent of -0.2956. Moreover, the microstructures induced under different deformation conditions were analyzed.

  20. Quantum surface and intertwiner dynamics in loop quantum gravity

    NASA Astrophysics Data System (ADS)

    Feller, Alexandre; Livine, Etera R.

    2017-06-01

    We introduce simple generic models of surface dynamics in loop quantum gravity (LQG). A quantum surface is defined as a set of elementary patches of area glued together. We provide it with an extra structure of locality (nearest neighbors), thought of as induced by the whole spin network state defining the 3d bulk geometry around the quantum surface. Here, we focus on classical surface dynamics, using a spinorial description of surface degrees of freedom. We introduce two classes of dynamics, to be thought as templates for future investigation of LQG dynamics with the dynamics of quantum black holes in mind. The first defines global dynamics of the closure defect of the surface, with two basic toy models, either a dissipative dynamics relaxing towards the closure constraint or a Hamiltonian dynamics precessing the closure defect. The second class of dynamics describes the isolated regime, when both area and closure defect are conserved throughout the evolution. The surface dynamics is implemented through U (N ) transformations and generalizes to a Bose-Hubbard Hamiltonian with a local quadratic potential interaction. We briefly discuss the implications of modeling the quantum black hole dynamics by a surface Bose-Hubbard model.

  1. Surface NMR measurement of proton relaxation times in medium to coarse-grained sand aquifer.

    PubMed

    Shushakov, O A

    1996-01-01

    A surface NMR investigation of groundwater in the geomagnetic field is under study. To detect the surface NMR a wire loop with a diameter of about 100 m, being an antenna for both an exciting field source and the NMR signal receiver, is laid out on the ground. A sinusoidal current pulse with a rectangular envelope is passed through the loop to excite the NMR signal. The carrier frequency of the oscillating current in this pulse is equal to the Larmor frequency of protons in the Earth's magnetic field. The current amplitude is changed up to 200 amps and the pulse duration is fixed and is equal to 40 ms. The exciting pulse is followed by an induction emf signal caused by the Larmor nuclear precession in geomagnetic field. The relaxation times T1, T2, and T2* were measured by the surface NMR for both groundwater in medium to coarse-grained sand at borehole and for bulk water under the ice surface of frozen lake. To determine T1, a longitudinal interference in experiments with repeated pulses was measured. A sequence with equal period between equal excitation pulses was used. The relaxation times T1, T2, measured for bulk water under the ice of the Ob reservoir were 1.0 s and 0.7 s, respectively. To estimate an influence of dissolved oxygen T1 of the same water at the same temperature was measured by lab NMR with and without pumping of oxygen. The relaxation time T1 measured for water in the medium to coarse-grained sand is 0.65 s. The relaxation time T2 estimated by spin echo sequence is found to be equal to 0.15 s. The relaxation time T2* is found to be about 80 ms. This result contradicts published earlier phenomenological correlation between relaxation time T2* and grain size of water-bearing rock. This could be as a result of unsound approach based on grain size or influence of paramagnetic impurities.

  2. Dynamics of Gas-Surface Interactions.

    DTIC Science & Technology

    1993-01-26

    inelastic scattering, metallic alloys, surface oxidation, S...surface phonon spectroscopy, gas-surface energy transfer. 19. ABSTRACT (Continue on...surface oxidation, the technological need to characterize the physical properties of thin films and surfaces, and the desire to understand how energy ... energy and momentum are exchanged at the surface of a material when it is subjected to gas- surface collisions, electron-surface collisions, optical

  3. Impact of momentum space anisotropy on heavy quark dynamics in a QGP medium

    NASA Astrophysics Data System (ADS)

    Chandra, Vinod; Das, Santosh K.

    2016-05-01

    Momentum space anisotropy present in the quark and gluon distribution functions in relativistic heavy ion collisions induces Chromo-Weibel instability in the hot QCD medium created therein. The impact of the Chromo-Weibel instability on the dynamics of a heavy quark (HQ) traversing in the QGP medium is investigated within the framework of kinetic theory by studying the momentum and temperature behavior of HQ drag and diffusion coefficients. The physics of anisotropy is captured in an effective Vlasov term in the transport equation. The effects of the instability are handled by making a relation with the phenomenologically known jet-quenching parameter in RHIC and LHC. Interestingly, the presence of instability significantly affects the temperature and momentum dependences of the HQ drag and diffusion coefficients. These results may have appreciable impact on the experimental observables such as the nuclear suppression factor, RA A(pT) , and the elliptic flow, v2(pT), of heavy mesons in heavy ion collisions at RHIC and LHC energies which is a matter of future investigation.

  4. Phase Transition Dynamics of The Interstellar Medium: Theory, Methodology, and Implications

    NASA Astrophysics Data System (ADS)

    Inutsuka, S.-i.; Inoue, T.; Iwasaki, K.; Stone, J. M.; Suzuki, T. K.; Tsukamoto, Y.; Takamoto, M.

    2015-10-01

    The magnetohydrodynamics (MHD) of the interstellar medium are remarkably different from those of simple barotropic gas owing to the phase transitions between cold and warm phases (and hot phase) that trigger a variety of instabilities. Identification of distinct instabilities at various stages provide us important clues for understanding the saturation levels of turbulent energies and the rates of formation and destruction of cold clouds such as HI clouds and molecular clouds. Recent progress in this line of theoretical research based on numerical simulations is outlined. Numerical simulation of the phase transition dynamics of the interstellar medium requires the description of very different length scales, from sub-pc “Field length” to the Galactic scale, using shock-capturing high-resolution schemes for MHD. Various techniques to improve the accuracy of numerical schemes based on the method of characteristics are outlined, including an approximate nonlinear Riemann Solver for MHD and a piece-wise exact solution method for multi-timescale physics.

  5. Analysis of Tropical Forest Structural Dynamics Using Medium-footprint Lidar

    NASA Astrophysics Data System (ADS)

    Sheldon, S. L.; Dubayah, R. O.; Clark, D. B.; Hofton, M. A.; Blair, J. B.

    2007-12-01

    As a forest canopy recovers from a disturbance event, the vertical structure passes through various stages of biomass distribution until reaching an age at which it approximates the vertical structure of old-growth forest. Quantifying and mapping rates of biomass accumulation and distribution in the forest canopy has important implications for understanding carbon stocks and fluxes.The La Selva Biological Station in Costa Rica contains numerous sections of secondary forest at different stages of recovery from disturbance. We explore the vertical canopy structure of these forests at two different years and the progression of biomass distribution in the canopy over time using canopy information collected by the Laser Vegetation Imaging Sensor (LVIS). LVIS, a medium- footprint airborne scanning lidar, collected vegetation data over La Selva in March of 1998 and March of 2005. Waveforms and waveform-derived metrics are used to obtain canopy heights and vertical biomass distribution patterns and dynamics. We assess the potential of using medium-footprint lidar to determine successional status. The ability to remotely detect and map successional status can greatly improve carbon modeling and management.

  6. Pump and amplification dynamics of gamma rays in a nuclear medium with the hidden population inversion

    SciTech Connect

    Rivlin, Lev A

    2009-12-31

    The features of the pump dynamics of isomeric nuclei excited by X-rays of a repetitively pulsed relativistic electron beam followed by the production of a medium with the negative absorption of gamma quanta are analysed. In the extended nuclear medium, the pump excites a travelling hidden-population-inversion wave with the anisotropic gamma amplification, which becomes positive in the case of the excess over the critical pump parameter equal to the product of the peak spectral power density of the X-ray source and the relative duration of an ultrashort relativistic electron bunch. In the alternative scheme with orthogonal directions of pumping X-rays and a flux of amplified gamma quanta, the absence of the amplification anisotropy opens up the possibility for constructing a standard two-mirror resonator with Bragg single-crystal reflectors. The critical peak value of the spectral pump power density is compared with the known characteristics of relativistic-electron X-ray sources by examples of some nuclides. (active media)

  7. Dynamics of fluid-triggered fracturing in the models of a geological medium

    NASA Astrophysics Data System (ADS)

    Sobolev, G. A.; Ponomarev, A. V.

    2011-10-01

    Implications of infusion of small (compared to the pore space) amounts of water for the dynamics of fracturing are studied in the laboratory experiments on the models of a heterogeneous geological medium. Variations in the acoustic emission that precede macrofracture are analyzed, including as candidate precursors. In all experiments, the macrofracture had occurred not immediately after the mechanical loading or water infusion but with a time-delay after a period of acoustic quiescence and subsequent activation. The enhancement in acoustic activity preceding macrofracture is well reproduced by the exponential law; the correlation between the actual number of events (or the released energy) and the exponential approximation exceeds the 95% confidence level. The power law is slightly worse although also a confident approximation of the acoustic emission process. The facts of subsequent occurrence of quiescence and activation suggest that, in principle, this phenomenon can be used as a precursory signature in the prediction of macrofracturing.

  8. Calculation of two-particle quantities in the typical medium dynamical cluster approximation

    NASA Astrophysics Data System (ADS)

    Zhang, Y.; Zhang, Y. F.; Yang, S. X.; Tam, K.-M.; Vidhyadhiraja, N. S.; Jarrell, M.

    2017-04-01

    The mean-field theory for disordered electron systems without interaction is widely and successfully used to describe equilibrium properties of materials over the whole range of disorder strengths. However, it fails to take into account the effects of quantum coherence and information of localization. Vertex corrections due to multiple backscatterings may drive the electrical conductivity to zero and make expansions around the mean field in strong disorder problematic. Here, we present a method for the calculation of two-particle quantities which enables us to characterize the metal-insulator transitions in disordered electron systems by using the typical medium dynamical cluster approximation. We show how to include vertex corrections and information about the mobility edge in the typical mean-field theory. We successfully demonstrate the application of the developed method by showing that the conductivity formulated in this way properly characterizes the metal-insulator transition in disordered systems.

  9. Simulated dynamic response of a multi-stage compressor with variable molecular weight flow medium

    NASA Technical Reports Server (NTRS)

    Babcock, Dale A.

    1995-01-01

    A mathematical model of a multi-stage compressor with variable molecular weight flow medium is derived. The modeled system consists of a five stage, six cylinder, double acting, piston type compressor. Each stage is followed by a water cooled heat exchanger which serves to transfer the heat of compression from the gas. A high molecular weight gas (CFC-12) mixed with air in varying proportions is introduced to the suction of the compressor. Condensation of the heavy gas may occur in the upper stage heat exchangers. The state equations for the system are integrated using the Advanced Continuous Simulation Language (ACSL) for determining the system's dynamic and steady state characteristics under varying operating conditions.

  10. Dynamics of the Streptococcus gordonii Transcriptome in Response to Medium, Salivary α-Amylase, and Starch

    PubMed Central

    Haase, Elaine M.; Feng, Xianghui; Pan, Jiachuan; Miecznikowski, Jeffrey C.

    2015-01-01

    Streptococcus gordonii, a primary colonizer of the tooth surface, interacts with salivary α-amylase via amylase-binding protein A (AbpA). This enzyme hydrolyzes starch to glucose, maltose, and maltodextrins that can be utilized by various oral bacteria for nutrition. Microarray studies demonstrated that AbpA modulates gene expression in response to amylase, suggesting that the amylase-streptococcal interaction may function in ways other than nutrition. The goal of this study was to explore the role of AbpA in gene regulation through comparative transcriptional profiling of wild-type KS1 and AbpA− mutant KS1ΩabpA under various environmental conditions. A portion of the total RNA isolated from mid-log-phase cells grown in 5% CO2 in (i) complex medium with or without amylase, (ii) defined medium (DM) containing 0.8% glucose with/without amylase, and (iii) DM containing 0.2% glucose and amylase with or without starch was reverse transcribed to cDNA and the rest used for RNA sequencing. Changes in the expression of selected genes were validated by quantitative reverse transcription-PCR. Maltodextrin-associated genes, fatty acid synthesis genes and competence genes were differentially expressed in a medium-dependent manner. Genes in another cluster containing a putative histidine kinase/response regulator, peptide methionine sulfoxide reductase, thioredoxin protein, lipoprotein, and cytochrome c-type protein were downregulated in KS1ΩabpA under all of the environmental conditions tested. Thus, AbpA appears to modulate genes associated with maltodextrin utilization/transport and fatty acid synthesis. Importantly, in all growth conditions AbpA was associated with increased expression of a potential two-component signaling system associated with genes involved in reducing oxidative stress, suggesting a role in signal transduction and stress tolerance. PMID:26025889

  11. Porous medium convection at large Rayleigh number: Studies of coherent structure, transport, and reduced dynamics

    NASA Astrophysics Data System (ADS)

    Wen, Baole

    Buoyancy-driven convection in fluid-saturated porous media is a key environmental and technological process, with applications ranging from carbon dioxide storage in terrestrial aquifers to the design of compact heat exchangers. Porous medium convection is also a paradigm for forced-dissipative infinite-dimensional dynamical systems, exhibiting spatiotemporally chaotic dynamics if not "true" turbulence. The objective of this dissertation research is to quantitatively characterize the dynamics and heat transport in two-dimensional horizontal and inclined porous medium convection between isothermal plane parallel boundaries at asymptotically large values of the Rayleigh number Ra by investigating the emergent, quasi-coherent flow. This investigation employs a complement of direct numerical simulations (DNS), secondary stability and dynamical systems theory, and variational analysis. The DNS confirm the remarkable tendency for the interior flow to self-organize into closely-spaced columnar plumes at sufficiently large Ra (up to Ra ≃ 105), with more complex spatiotemporal features being confined to boundary layers near the heated and cooled walls. The relatively simple form of the interior flow motivates investigation of unstable steady and time-periodic convective states at large Ra as a function of the domain aspect ratio L. To gain insight into the development of spatiotemporally chaotic convection, the (secondary) stability of these fully nonlinear states to small-amplitude disturbances is investigated using a spatial Floquet analysis. The results indicate that there exist two distinct modes of instability at large Ra: a bulk instability mode and a wall instability mode. The former usually is excited by long-wavelength disturbances and is generally much weaker than the latter. DNS, strategically initialized to investigate the fully nonlinear evolution of the most dangerous secondary instability modes, suggest that the (long time) mean inter-plume spacing in

  12. Liquid dynamics and surface wettability in splashing

    NASA Astrophysics Data System (ADS)

    Latka, Andrzej; Boelens, Arnout; de Pablo, Juan; Nagel, Sidney

    2016-11-01

    The impact of a drop results in a beautiful splash that depends on the properties of the liquid, the substrate, and the surrounding air. The interactions of the three phases, particularly those of the ambient gas, have proven difficult to understand. Here, we focus on two aspects of splashing that make it exceptionally challenging: the surprising role of substrate wetting and the complicated hydrodynamics of drop impact. Splashing theories, by analogy to forced wetting, have predicted a strong dependence on wetting properties. By using high-speed interference imaging and simulations, we find that the dynamics of the air-liquid interface at the contact line are independent of substrate wetting properties. We also investigate the effect of the drop's evolving shape. When the drop first contacts the surface, it initially exhibits a region of high negative curvature that later disappears after the drop has spread sufficiently. We find that the effect of air on splashing is significantly stronger in the initial regime and demonstrate that this difference leads to a high and low impact velocity regime.

  13. A molecular dynamic study of layered hydroxide induced depletion of mobile anions within the extracellular medium

    NASA Astrophysics Data System (ADS)

    Tsukanov, Alexey A.; Psakhie, Sergey G.

    2015-10-01

    The strong surface electric charge density of clay mineral host nanolayers enables their use as host-guest nanohybrids in many different areas of application. In particular, layered double hydroxides (LDH) of metals have found applications in medicine. Drug-LDH or gene-LDH nanohybrids are used for targeted delivery of biomedical agents to diseased cells or cancer cells. Fragments of the LDH host nanolayers may remain both within the cell and in the extracellular medium after drug delivery. How these charged nanosheets affect the cell electrostatics is still poorly understood. In the present paper, the idealized case of a single pure Mg2/Al-LDH nanolayer interacting with the extracellular anion environment was investigated to estimate the order of magnitude of a possible shift of the cell membrane equilibrium potential. An approximate dependence of the change in the chloride equilibrium membrane potential on the concentration of pure Mg2/Al-LDH nanosheets was determined.

  14. Improving the forming capability of laser dynamic forming by using rubber as a forming medium

    NASA Astrophysics Data System (ADS)

    Shen, Zongbao; Liu, Huixia; Wang, Xiao; Wang, Cuntang

    2016-04-01

    Laser dynamic forming (LDF) is a novel high velocity forming technique, which employs laser-generated shock wave to load the sample. The forming velocity induced by the high energy laser pulse may exceed the critical forming velocity, resulting in the occurrence of premature fracture. To avoid the above premature fracture, rubber is introduced in LDF as a forming medium to prolong the loading duration in this paper. Laser induced shock wave energy is transferred to the sample in different forming stages, so the forming velocity can be kept below the critical forming velocity when the initial laser energy is high for fracture. Bulge forming experiments with and without rubber were performed to study the effect of rubber on loading duration. The experimental results show that, the shock wave energy attenuates during the propagation through the rubber layer, the rubber can avoid the premature fracture. So the plastic deformation can continue, the forming capability of LDF is improved. Due to the severe plastic deformation under rubber compression, adiabatic shear bands (ASB) occur in LDF with rubber. The material softening in ASB leads to the irregular fracture, which is different from the premature fracture pattern (regular fracture) in LDF without rubber. To better understand this deformation behavior, Johnson-Cook model is used to simulate the dynamic response and the evolution of ASB of copper sample. The simulation results also indicate the rubber can prolong the loading duration.

  15. MHD SIMULATIONS OF ACTIVE GALACTIC NUCLEUS JETS IN A DYNAMIC GALAXY CLUSTER MEDIUM

    SciTech Connect

    Mendygral, P. J.; Jones, T. W.; Dolag, K.

    2012-05-10

    We present a pair of three-dimensional magnetohydrodynamical simulations of intermittent jets from a central active galactic nucleus (AGN) in a galaxy cluster extracted from a high-resolution cosmological simulation. The selected cluster was chosen as an apparently relatively relaxed system, not having undergone a major merger in almost 7 Gyr. Despite this characterization and history, the intracluster medium (ICM) contains quite active 'weather'. We explore the effects of this ICM weather on the morphological evolution of the AGN jets and lobes. The orientation of the jets is different in the two simulations so that they probe different aspects of the ICM structure and dynamics. We find that even for this cluster, which can be characterized as relaxed by an observational standard, the large-scale, bulk ICM motions can significantly distort the jets and lobes. Synthetic X-ray observations of the simulations show that the jets produce complex cavity systems, while synthetic radio observations reveal bending of the jets and lobes similar to wide-angle tail radio sources. The jets are cycled on and off with a 26 Myr period using a 50% duty cycle. This leads to morphological features similar to those in 'double-double' radio galaxies. While the jet and ICM magnetic fields are generally too weak in the simulations to play a major role in the dynamics, Maxwell stresses can still become locally significant.

  16. Global dynamics of the Escherichia coli proteome and phosphoproteome during growth in minimal medium.

    PubMed

    Soares, Nelson C; Spät, Philipp; Krug, Karsten; Macek, Boris

    2013-06-07

    Recent phosphoproteomics studies have generated relatively large data sets of bacterial proteins phosphorylated on serine, threonine, and tyrosine, implicating this type of phosphorylation in the regulation of vital processes of a bacterial cell; however, most phosphoproteomics studies in bacteria were so far qualitative. Here we applied stable isotope labeling by amino acids in cell culture (SILAC) to perform a quantitative analysis of proteome and phosphoproteome dynamics of Escherichia coli during five distinct phases of growth in the minimal medium. Combining two triple-SILAC experiments, we detected a total of 2118 proteins and quantified relative dynamics of 1984 proteins in all measured phases of growth, including 570 proteins associated with cell wall and membrane. In the phosphoproteomic experiment, we detected 150 Ser/Thr/Tyr phosphorylation events, of which 108 were localized to a specific amino acid residue and 76 were quantified in all phases of growth. Clustering analysis of SILAC ratios revealed distinct sets of coregulated proteins for each analyzed phase of growth and overrepresentation of membrane proteins in transition between exponential and stationary phases. The proteomics data indicated that proteins related to stress response typically associated with the stationary phase, including RpoS-dependent proteins, had increasing levels already during earlier phases of growth. Application of SILAC enabled us to measure median occupancies of phosphorylation sites, which were generally low (<12%). Interestingly, the phosphoproteome analysis showed a global increase of protein phosphorylation levels in the late stationary phase, pointing to a likely role of this modification in later phases of growth.

  17. Synthesis of Formamide and Related Organic Species in the Interstellar Medium via Chemical Dynamics Simulations

    NASA Astrophysics Data System (ADS)

    Spezia, Riccardo; Jeanvoine, Yannick; Hase, William L.; Song, Kihyung; Largo, Antonio

    2016-08-01

    We show, by means of direct dynamics simulations, how it is possible to define possible reactants and mechanisms leading to the formation of formamide in the interstellar medium. In particular, different ion-molecule reactions in the gas phase were considered: NH3OH+, NH2OH{}2+, H2COH+, and NH4 + for the ions and NH2OH, H2CO, and NH3 for the partner neutrals. These calculations were combined with high level ab initio calculations to investigate possible further evolution of the products observed. In particular, for formamide, we propose that the NH2OH{}2+ + H2CO reaction can produce an isomer, NH2OCH{}2+, that, after dissociative recombination, can produce neutral formamide, which was observed in space. The direct dynamics do not pre-impose any reaction pathways and in other reactions, we did not observe the formation of formamide or any possible precursor. On the other hand, we obtained other interesting reactions, like the formation of NH2CH{}2+. Finally, some radiative association processes are proposed. All of the results obtained are discussed in light of the species observed in radioastronomy.

  18. The dynamic Virtual Fields Method on rubbers at medium and high strain rates

    NASA Astrophysics Data System (ADS)

    Yoon, Sung-Ho; Siviour, Clive R.

    2015-09-01

    Elastomeric materials are widely used for energy absorption applications, often experiencing high strain rate deformations. The mechanical characterization of rubbers at high strain rates presents several experimental difficulties, especially associated with achieving adequate signal to noise ratio and static stress equilibrium, when using a conventional technique such as the split Hopkinson pressure bar. In the present study, these problems are avoided by using the dynamic Virtual Fields Method (VFM) in which acceleration fields, clearly generated by the non-equilibrium state, are utilized as a force measurement with in the frame work of the principle of virtual work equation. In this paper, two dynamic VFM based techniques are used to characterise an EPDM rubber. These are denoted as the linear and nonlinear VFM and are developed for (respectively) medium (drop-weight) and high (gas-gun) strain-rate experiments. The use of the two VFMs combined with high-speed imaging analysed by digital imaging correlation allows the identification of the parameters of a given rubber mechanical model; in this case the Ogden model is used.

  19. Porous medium coffee ring effect and other factors affecting the first crystallisation time of sodium chloride at the surface of a drying porous medium

    NASA Astrophysics Data System (ADS)

    Hidri, F.; Sghaier, N.; Eloukabi, H.; Prat, M.; Nasrallah, S. Ben

    2013-12-01

    We study the distribution of ions in a drying porous medium up to the formation of first crystals at the surface. The study is based on comparisons between numerical simulations and experiments with packings of glass beads. The experimental configuration, which is representative of many previous drying experiments, is characterized by the formation of an efflorescence fairy ring at the surface of the porous medium. The preferential formation of crystals at the periphery is explained by the combined effect of higher evaporation fluxes at the surface periphery, as in the classical coffee ring problem, and variations in the porosity near the wall bordering the packing. It is shown that both effects have a great impact on the time marking the occurrence of first crystals, which is referred to as the first crystallization time. The experiments indicate that the first crystallization time increases with a decreasing bead size for a given initial ion concentration. This is explained by the variation with bead size of the characteristic size of the near wall region where a preferential desaturation of the sample occurs as a result of the porosity increase near the wall. The study also reveals a significant salt supersaturation effect. This represents a noticeable fact in relation with salt weathering issues.

  20. Acidity-Facilitated Mobilization of Surface Clay Colloid from Natural Sand Medium

    NASA Astrophysics Data System (ADS)

    Huang, Y.; Wang, C.; Mohanty, B. P.

    2010-12-01

    Colloid mobilization and migration in a soil system has attracted increasing scrutiny for its role in facilitating colloid-borne transport of contaminants in the environments. In many previous studies, pH was evoked as a major factor in mobilizing surface colloids through inducing favorable surface charge and electrostatic conditions. The possible direct role of acidity with H+ as a chemical agent has remained largely obscured behind the indirect role of pH. In this study, we demonstrated through column flow-through tests that cyclical elution of natural sand media with weak acid and base solutions can greatly facilitate detachment and transport of surface clay colloids. We found that while elevating pH to an alkaline condition helped release the loosely-attached surface clays, a pretreatment with H+ could facilitate the mobilization of chemically-bonded clay colloids through lysing of labile Ca and Mg ions. A quantitative relation was observed that 1 mmol H+ could lyse about 0.5 mmol Ca2+ and Mg2+ and subsequently resulted in a release of about 1,200 mg clay during base elution when repulsive force between particles dominated. Natural organic acids such as citric acid and acetic acid in environment-relevant low concentrations (<1mM and pH>5.0) were as effective as HCl with a stronger acidic condition. The small mass ratio of Ca and Mg over colloid released and the nature of weak acid used suggest that the mobilization was less likely due to dissolution of cement casing than lysing of labile interstitial Ca and Mg by H+, which severed Ca and Mg bridging bonds between particles. Natural acidity is generated in abundance from various bio- and geochemical processes; e.g., many plants produce citric acid through citric acid cycle metabolism; biodegradation of dead organic matter forms humic acids. We postulate that natural proton dynamics in tendon with pH oscillation accompanied with various soil biogeochemical processes could play a major role in subsurface clay

  1. Hydration dynamics near a model protein surface

    SciTech Connect

    Russo, Daniela; Hura, Greg; Head-Gordon, Teresa

    2003-09-01

    The evolution of water dynamics from dilute to very high concentration solutions of a prototypical hydrophobic amino acid with its polar backbone, N-acetyl-leucine-methylamide (NALMA), is studied by quasi-elastic neutron scattering and molecular dynamics simulation for both the completely deuterated and completely hydrogenated leucine monomer. We observe several unexpected features in the dynamics of these biological solutions under ambient conditions. The NALMA dynamics shows evidence of de Gennes narrowing, an indication of coherent long timescale structural relaxation dynamics. The translational water dynamics are analyzed in a first approximation with a jump diffusion model. At the highest solute concentrations, the hydration water dynamics is significantly suppressed and characterized by a long residential time and a slow diffusion coefficient. The analysis of the more dilute concentration solutions takes into account the results of the 2.0M solution as a model of the first hydration shell. Subtracting the first hydration layer based on the 2.0M spectra, the translational diffusion dynamics is still suppressed, although the rotational relaxation time and residential time are converged to bulk-water values. Molecular dynamics analysis shows spatially heterogeneous dynamics at high concentration that becomes homogeneous at more dilute concentrations. We discuss the hydration dynamics results of this model protein system in the context of glassy systems, protein function, and protein-protein interfaces.

  2. Europan Ocean Dynamics Inferred from Surface Geology

    NASA Astrophysics Data System (ADS)

    Schmidt, B. E.; Soderlund, K. M.; Blankenship, D. D.; Wicht, J.

    2012-12-01

    Europa possesses a global liquid water ocean that mediates heat exchange from the silicate interior to the outer icy shell. Since no direct observations of ocean dynamics are presently available, possible oceanographic processes must be inferred remotely through their implications for surface geology. For example, regions of disrupted ice known as chaos terrain are thought to represent locations of high heat flow from the ocean into the ice shell and tend to be concentrated at low latitudes. Since ocean currents can reorganize the flow of heat from the interior and potentially deliver regionally-varying basal heat to the ice shell, we hypothesize that oceanic heat transfer may peak near the equator. We also suggest that Europan ocean convection may be strongly turbulent with three-dimensional plumes, behavior that is fundamentally different from the prevailing assumption in the literature that Europa's ocean is organized into coherent, columnar structures that are aligned with the rotation axis. Towards testing these hypotheses, we simulate turbulent thermal convection in a thin, rotating spherical shell with Europa-relevant conditions. The small-scale, poorly-organized convective motions in our simulation homogenize the system's absolute angular momentum at low latitudes. Zonal flows develop with retrograde (westward) flow near the equator and prograde (eastward) flow near the rotation axis in order to conserve angular momentum. This angular momentum transport is achieved through Hadley-like cells with upwelling flow near the equator, poleward flow near the outer boundary, downwelling at mid-latitudes, and equatorward return flow near the inner boundary. These circulation cells, which control the mean ocean temperature and the mean flux of heat from the ocean into the ice shell, cause heat to be preferentially emitted in a low latitude. Mean ocean temperatures also have implications for vertical gradients in salinity since seawater is able to maintain more

  3. On the analysis of the medium term planform dynamics of meandering rivers

    NASA Astrophysics Data System (ADS)

    Gutierrez, Ronald R.; Abad, Jorge D.

    2014-05-01

    The continuous wavelet transform is applied to the analysis of curvature signals from both synthetic meanders and 52 realizations from 16 natural meanders ranging from class B to class G (Brice classification), thus providing information on the spatial distribution of their arc-wavelength spectrum, and therefore, representing an objective characterization of meanders. Past research has studied the meander dynamics by using the centerline (short-term frame) and the valley centerline (long-term frame). The present study introduces a medium term frame, termed the mean center (MC), which is defined as the medium term coherent wave being present in the meander planimetry for a period that is strongly governed by the occurrence of cutoff events; although in the absence of them, it is present for ˜10 to ˜30 years. The MC is obtained by using a methodology that combines the capabilities of the principal component analysis and the discrete wavelet transforms. The application of wavelet cross correlation shows that peaks in the centerline curvature are strongly correlated with those of the MC suggesting that (1) a linear relationship between them may be associated to bank processes and, (2) in all other cases, a higher nonlinear relationship may be induced by autogenic hydrodynamic processes. In freely meandering rivers, compound bends, multiple loops, and cutoff events are associated to peaks in the MC local curvature. We define the planform amplitudes as the orthogonal distance of the centerline from mean center. Planform amplitudes (orthogonal distance of the centerline from mean center) are normally distributed and ranges from 2 to 20 river mean widths.

  4. Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurements

    DTIC Science & Technology

    2015-03-31

    Final March 2013 -- February 2015 Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurements N00014-13-1-0352 Yue, Dick K.P... Dick K.P. and Yuming Liu 617-253-6823; 617-252-1647 1 Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurements Dick K.P

  5. Acceleration of electrons by a laser pulse at its output onto an optical surface of the vacuum - transparent medium interface. Laser synchrotron

    NASA Astrophysics Data System (ADS)

    Romanovskiy, M. Yu

    2016-05-01

    We consider the electron dynamics in the field of an electromagnetic wave produced at the vacuum - transparent medium interface upon reflection from the boundary, close to total internal reflection. The propagation velocity of a constant phase of the electromagnetic wave along the interface can vary from c/n to infinity (c is the speed of light in vacuum, and n is the refractive index of the medium at the interface). In this case, there emerge regions of positive and negative phases of the field with wavelengths, approximately equal to half the wavelength of the original laser beam, which can propagate at a speed close to that of light in vacuum. If a beam of relativistic electrons propagates along the surface, they can gain energy and accelerate, as well as radiate. With closed trajectories of electron motion, a laser synchrotron will be implemented as a result of many acceleration cycles.

  6. Characterizing and Mapping Ice Sheet Surface Topography Using a Medium-Footprint, Multi- Beam, Waveform-Recording Lidar

    NASA Astrophysics Data System (ADS)

    Hofton, M. A.; Blair, J. B.; Rabine, D. L.; Luthcke, S. B.

    2007-12-01

    Lidar surveys of the Greenland ice sheet have been used to study mass-balance changes since the early 1990's. Sensors include NASA's ATM system (e.g., Krabill et al., 2000), and the ICESat (Schutz et al., 2002), a large- footprint, spaceborne system launched in 2003 for monitoring long-term trends in ice mass balance. To complement these data sets and prepare for the next-generation of spaceborne measurements, the Laser Vegetation Imaging Sensor (LVIS) was flown onboard the NASA P-3 aircraft over Greenland in September 2007. LVIS is an airborne, medium- footprint (25m diameter), full waveform-recording, airborne, scanning lidar system that has been used extensively for mapping forest structure, habitat, carbon and natural hazards. The system digitally records the shape of the returning laser echo, or waveform, after its interaction with the various reflecting surfaces of the earth, providing a true 3-dimensional record of the surface structure. Data collected included ground elevation and vertical extent measurements for each laser footprint, as well as the vertical distribution of intercepted surfaces (the return waveform) from which surface slope, roughness and other metrics can be extracted. During the mission, data were collected along ICESat repeat ground-track "corridors" that encompass a variety of terrain types (e.g., inland ice, crevasses, ponds, sastrugi, ice/rock margins, and bare earth), over sea- ice in northern Greenland, and at Jakobshavn Isbrae, a fast-flowing outlet glacier where discharge rates have increased in recent years. Data from this mission will be used to assess the ability of 25m-footprint, waveform lidar to precisely and accurately characterize and monitor the surface of the Greenland ice sheet and its margins. The data will also be used to assess the effects of across-track slope corrections currently being used on the ICESat data. The study will highlight the complimentary measurement science that can be achieved using a multi

  7. Production of medium-chain triacylglycerols from corn oil: optimization by response surface methodology.

    PubMed

    Oztürk, Tarik; Ustun, Guldem; Aksoy, H Ayse

    2010-10-01

    Structured lipids (SLs) having long-chain fatty acids at sn-2 and medium-chain caprylic acid (CA, 8:0) at their sn-1,3-positions from corn oil (CO) were obtained and optimized by response surface methodology (RSM) with a three-level, three-factor face-centered cube design. Compositions of triacylglycerol species (TAGs) in SLs were also investigated by reverse-phase high performance liquid chromatography. Lipozyme TL IM from Thermomyces lanuginosa was used for the acidolysis of CO with CA in n-hexane. The effects of substrate molar ratio, enzyme amount, and reaction time on CA incorporation into CO were optimized. The optimum conditions were 13.2% (wt.) enzyme, 3.9:1 caprylic acid/corn oil molar ratio, and 3.1 h reaction time. At optimum conditions, 21.5 +/- 0.8 mol.% caprylic acid containing SLs was obtained. This product was characterized by 50% of triacylglycerol species with equivalent carbon number (ECN) C30, C32, C36, and C38, and 50% of triacylglycerol species with ECN C42, C44, and C46.

  8. Hydrodynamic boundary conditions and dynamic forces between bubbles and surfaces.

    PubMed

    Manor, Ofer; Vakarelski, Ivan U; Tang, Xiaosong; O'Shea, Sean J; Stevens, Geoffrey W; Grieser, Franz; Dagastine, Raymond R; Chan, Derek Y C

    2008-07-11

    Dynamic forces between a 50 microm radius bubble driven towards and from a mica plate using an atomic force microscope in electrolyte and in surfactant exhibit different hydrodynamic boundary conditions at the bubble surface. In added surfactant, the forces are consistent with the no-slip boundary condition at the mica and bubble surfaces. With no surfactant, a new boundary condition that accounts for the transport of trace surface impurities explains variations of dynamic forces at different speeds and provides a direct connection between dynamic forces and surface transport effects at the air-water interface.

  9. Hydrodynamic Boundary Conditions and Dynamic Forces between Bubbles and Surfaces

    NASA Astrophysics Data System (ADS)

    Manor, Ofer; Vakarelski, Ivan U.; Tang, Xiaosong; O'Shea, Sean J.; Stevens, Geoffrey W.; Grieser, Franz; Dagastine, Raymond R.; Chan, Derek Y. C.

    2008-07-01

    Dynamic forces between a 50μm radius bubble driven towards and from a mica plate using an atomic force microscope in electrolyte and in surfactant exhibit different hydrodynamic boundary conditions at the bubble surface. In added surfactant, the forces are consistent with the no-slip boundary condition at the mica and bubble surfaces. With no surfactant, a new boundary condition that accounts for the transport of trace surface impurities explains variations of dynamic forces at different speeds and provides a direct connection between dynamic forces and surface transport effects at the air-water interface.

  10. Dynamic recrystallization in friction surfaced austenitic stainless steel coatings

    SciTech Connect

    Puli, Ramesh Janaki Ram, G.D.

    2012-12-15

    Friction surfacing involves complex thermo-mechanical phenomena. In this study, the nature of dynamic recrystallization in friction surfaced austenitic stainless steel AISI 316L coatings was investigated using electron backscattered diffraction and transmission electron microscopy. The results show that the alloy 316L undergoes discontinuous dynamic recrystallization under conditions of moderate Zener-Hollomon parameter during friction surfacing. - Highlights: Black-Right-Pointing-Pointer Dynamic recrystallization in alloy 316L friction surfaced coatings is examined. Black-Right-Pointing-Pointer Friction surfacing leads to discontinuous dynamic recrystallization in alloy 316L. Black-Right-Pointing-Pointer Strain rates in friction surfacing exceed 400 s{sup -1}. Black-Right-Pointing-Pointer Estimated grain size matches well with experimental observations in 316L coatings.

  11. Boundary layer flow past a stretching surface in a porous medium saturated by a nanofluid: Brinkman-Forchheimer model.

    PubMed

    Khan, Waqar A; Pop, Ioan M

    2012-01-01

    In this study, the steady forced convection flow and heat transfer due to an impermeable stretching surface in a porous medium saturated with a nanofluid are investigated numerically. The Brinkman-Forchheimer model is used for the momentum equations (porous medium), whereas, Bongiorno's model is used for the nanofluid. Uniform temperature and nanofluid volume fraction are assumed at the surface. The boundary layer equations are transformed to ordinary differential equations in terms of the governing parameters including Prandtl and Lewis numbers, viscosity ratio, porous medium, Brownian motion and thermophoresis parameters. Numerical results for the velocity, temperature and concentration profiles, as well as for the reduced Nusselt and Sherwood numbers are obtained and presented graphically.

  12. Boundary Layer Flow Past a Stretching Surface in a Porous Medium Saturated by a Nanofluid: Brinkman-Forchheimer Model

    PubMed Central

    Khan, Waqar A.; Pop, Ioan M.

    2012-01-01

    In this study, the steady forced convection flow and heat transfer due to an impermeable stretching surface in a porous medium saturated with a nanofluid are investigated numerically. The Brinkman-Forchheimer model is used for the momentum equations (porous medium), whereas, Bongiorno’s model is used for the nanofluid. Uniform temperature and nanofluid volume fraction are assumed at the surface. The boundary layer equations are transformed to ordinary differential equations in terms of the governing parameters including Prandtl and Lewis numbers, viscosity ratio, porous medium, Brownian motion and thermophoresis parameters. Numerical results for the velocity, temperature and concentration profiles, as well as for the reduced Nusselt and Sherwood numbers are obtained and presented graphically. PMID:23077541

  13. Dynamics of inelastic and reactive gas-surface collisions

    SciTech Connect

    Smoliar, Laura Ann

    1995-04-01

    The dynamics of inelastic and reactive collisions in atomic beam-surface scattering are presented. The inelastic scattering of hyperthermal rare gaseous atoms from three alkali halide surfaces (LiF, NaCl, GI)was studied to understand mechanical energy transfer in unreactive systems. The dynamics of the chemical reaction in the scattering of H(D) atoms from the surfaces of LIF(001) and the basal plane of graphite were also studied.

  14. Surface waves on the boundary of a conducting medium and their excitation by a relativistic electron beam

    NASA Astrophysics Data System (ADS)

    Kukushkin, A. V.; Rukhadze, A. A.

    2017-09-01

    Excitation of surface waves by a relativistic electron beam propagating over a conducting cylindrical medium (metal or highly ionized plasma) is investigated theoretically. Dispersion relations describing the linear interaction of surface electromagnetic waves with a monoenergetic electron beam are derived, and the growth rates and spatial amplification factors of excited waves are determined. Condition for the nonlinear trapping of the beam electrons by a surface wave is used to determine the maximum amplitude of the excited wave and the optimal radiator length. The electric field of a surface wave excited by an electron beam is estimated for a particular case.

  15. Studying the flow dynamics of a karst aquifer system with an equivalent porous medium model.

    PubMed

    Abusaada, Muath; Sauter, Martin

    2013-01-01

    The modeling of groundwater flow in karst aquifers is a challenge due to the extreme heterogeneity of its hydraulic parameters and the duality in their discharge behavior, that is, rapid response of highly conductive karst conduits and delayed drainage of the low-permeability fractured matrix after recharge events. There are a number of different modeling approaches for the simulation of the karst groundwater dynamics, applicable to different aquifer as well as modeling problem types, ranging from continuum models to double continuum models to discrete and hybrid models. This study presents the application of an equivalent porous model approach (EPM, single continuum model) to construct a steady-state numerical flow model for an important karst aquifer, that is, the Western Mountain Aquifer Basin (WMAB), shared by Israel and the West-Bank, using MODFLOW2000. The WMAB was used as a catchment since it is a well-constrained catchment with well-defined recharge and discharge components and therefore allows a control on the modeling approach, a very rare opportunity for karst aquifer modeling. The model demonstrates the applicability of equivalent porous medium models for the simulation of karst systems, despite their large contrast in hydraulic conductivities. As long as the simulated saturated volume is large enough to average out the local influence of karst conduits and as long as transport velocities are not an issue, EPM models excellently simulate the observed head distribution. The model serves as a starting basis that will be used as a reference for developing a long-term dynamic model for the WMAB, starting from the pre-development period (i.e., 1940s) up to date. © 2012, The Author(s). GroundWater © 2012, National Ground Water Association.

  16. Optical reflection spectra of the structures with surface plasmons excited at the metal-amplifying heterogeneous medium boundary

    NASA Astrophysics Data System (ADS)

    Andreev, A.; Nazvanov, V.

    2017-04-01

    In this paper the results of computer simulations of the optical reflection spectra of the structures with surface plasmons excited at the interface between metal and dielectric with optical amplification are presented. To calculate the reflectance the method of scattering matrices was used. It is shown that the enhanced reflectance from an amplifying heterogeneous metal-dielectric medium with simultaneous surface plasmon excitation is possible.

  17. [Growth peculiarities and properties of Bacillus subtilis IMV B-7023 cell surface in the medium with glycerophosphate].

    PubMed

    Roĭ, A A; Gordienko, A S; Kurdish, I K

    2009-01-01

    It is established that, depending on the amount of the basic elements of carbon and phosphorus nutrition in the cultivation medium, Bacillus subtilis IMV B-7023 can use glycerophosphate as a source of carbon, carbon and phosphorus, or phosphorus. The found differences in bacterium physiology correlate with the change of cell surface properties.

  18. Effects of post heat-treatment on surface characteristics and adhesive bonding performance of medium density fiberboard

    Treesearch

    Nadir Ayrilimis; Jerrold E. Winandy

    2009-01-01

    A series of commercially manufactured medium density fiberboard (MDF) panels were exposed to a post-manufacture heat-treatment at various temperatures and durations using a hot press and just enough pressure to ensure firm contact between the panel and the press platens. Post-manufacture heat-treatment improved surface roughness of the exterior MDF panels. Panels...

  19. The scaling and dynamics of a projectile obliquely impacting a granular medium.

    PubMed

    Wang, Dengming; Ye, Xiaoyan; Zheng, Xiaojing

    2012-01-01

    In this paper, the dynamics of a spherical projectile obliquely impacting into a two-dimensional granular bed is numerically investigated using the discrete element method. The influences of projectile's initial velocities and impacting angles are mainly considered. Numerical results show that the relationship between the final penetration depth and the initial impact velocity is very similar to that in the vertical-impact case. However, the dependence of the stopping time on the impact velocity of the projectile exhibits critical characteristics at different impact angles: the stopping time approximately increases linearly with the impact velocity for small impact angles but decreases in an exponential form for larger impact angles, which demonstrates the existence of two different regimes at low and high impact angles. When the impact angle is regarded as a parametric variable, a phenomenological force model at large impact angles is eventually proposed based on the simulation results, which can accurately describe the nature of the resistance force exerted on the projectile by the granular medium at different impact angels during the whole oblique-impact process. The degenerate model agrees well with the existing experimental results in the vertical-impact cases.

  20. Localization of phonons in mass-disordered alloys: A typical medium dynamical cluster approach

    NASA Astrophysics Data System (ADS)

    Mondal, Wasim Raja; Vidhyadhiraja, N. S.; Berlijn, T.; Moreno, Juana; Jarrell, M.

    2017-07-01

    The effect of disorder on lattice vibrational modes has been a topic of interest for several decades. In this work, we employ a Green's function based approach, namely, the dynamical cluster approximation (DCA), to investigate phonons in mass-disordered systems. Detailed benchmarks with previous exact calculations are used to validate the method in a wide parameter space. An extension of the method, namely, the typical medium DCA (TMDCA), is used to study Anderson localization of phonons in three dimensions. We show that, for binary isotopic disorder, lighter impurities induce localized modes beyond the bandwidth of the host system, while heavier impurities lead to a partial localization of the low-frequency acoustic modes. For a uniform (box) distribution of masses, the physical spectrum is shown to develop long tails comprising mostly localized modes. The mobility edge separating extended and localized modes, obtained through the TMDCA, agrees well with results from the transfer matrix method. A reentrance behavior of the mobility edge with increasing disorder is found that is similar to, but somewhat more pronounced than, the behavior in disordered electronic systems. Our work establishes a computational approach, which recovers the thermodynamic limit, is versatile and computationally inexpensive, to investigate lattice vibrations in disordered lattice systems.

  1. Active site dynamics in the zinc-dependent medium chain alcohol dehydrogenase superfamily

    PubMed Central

    Baker, Patrick J.; Britton, K. Linda; Fisher, Martin; Esclapez, Julia; Pire, Carmen; Bonete, Maria Jose; Ferrer, Juan; Rice, David W.

    2009-01-01

    Despite being the subject of intensive investigations, many aspects of the mechanism of the zinc-dependent medium chain alcohol dehydrogenase (MDR) superfamily remain contentious. We have determined the high-resolution structures of a series of binary and ternary complexes of glucose dehydrogenase, an MDR enzyme from Haloferax mediterranei. In stark contrast to the textbook MDR mechanism in which the zinc ion is proposed to remain stationary and attached to a common set of protein ligands, analysis of these structures reveals that in each complex, there are dramatic differences in the nature of the zinc ligation. These changes arise as a direct consequence of linked movements of the zinc ion, a zinc-bound bound water molecule, and the substrate during progression through the reaction. These results provide evidence for the molecular basis of proton traffic during catalysis, a structural explanation for pentacoordinate zinc ion intermediates, a unifying view for the observed patterns of metal ligation in the MDR family, and highlight the importance of dynamic fluctuations at the metal center in changing the electrostatic potential in the active site, thereby influencing the proton traffic and hydride transfer events. PMID:19131516

  2. Active site dynamics in the zinc-dependent medium chain alcohol dehydrogenase superfamily.

    PubMed

    Baker, Patrick J; Britton, K Linda; Fisher, Martin; Esclapez, Julia; Pire, Carmen; Bonete, Maria Jose; Ferrer, Juan; Rice, David W

    2009-01-20

    Despite being the subject of intensive investigations, many aspects of the mechanism of the zinc-dependent medium chain alcohol dehydrogenase (MDR) superfamily remain contentious. We have determined the high-resolution structures of a series of binary and ternary complexes of glucose dehydrogenase, an MDR enzyme from Haloferax mediterranei. In stark contrast to the textbook MDR mechanism in which the zinc ion is proposed to remain stationary and attached to a common set of protein ligands, analysis of these structures reveals that in each complex, there are dramatic differences in the nature of the zinc ligation. These changes arise as a direct consequence of linked movements of the zinc ion, a zinc-bound bound water molecule, and the substrate during progression through the reaction. These results provide evidence for the molecular basis of proton traffic during catalysis, a structural explanation for pentacoordinate zinc ion intermediates, a unifying view for the observed patterns of metal ligation in the MDR family, and highlight the importance of dynamic fluctuations at the metal center in changing the electrostatic potential in the active site, thereby influencing the proton traffic and hydride transfer events.

  3. Life-space foam: A medium for motivational and cognitive dynamics

    NASA Astrophysics Data System (ADS)

    Ivancevic, Vladimir; Aidman, Eugene

    2007-08-01

    General stochastic dynamics, developed in a framework of Feynman path integrals, have been applied to Lewinian field-theoretic psychodynamics [K. Lewin, Field Theory in Social Science, University of Chicago Press, Chicago, 1951; K. Lewin, Resolving Social Conflicts, and, Field Theory in Social Science, American Psychological Association, Washington, 1997; M. Gold, A Kurt Lewin Reader, the Complete Social Scientist, American Psychological Association, Washington, 1999], resulting in the development of a new concept of life-space foam (LSF) as a natural medium for motivational and cognitive psychodynamics. According to LSF formalisms, the classic Lewinian life space can be macroscopically represented as a smooth manifold with steady force fields and behavioral paths, while at the microscopic level it is more realistically represented as a collection of wildly fluctuating force fields, (loco)motion paths and local geometries (and topologies with holes). A set of least-action principles is used to model the smoothness of global, macro-level LSF paths, fields and geometry. To model the corresponding local, micro-level LSF structures, an adaptive path integral is used, defining a multi-phase and multi-path (multi-field and multi-geometry) transition process from intention to goal-driven action. Application examples of this new approach include (but are not limited to) information processing, motivational fatigue, learning, memory and decision making.

  4. Dynamics of oblique impact in a 2D photoelastic granular medium

    NASA Astrophysics Data System (ADS)

    Cox, Noah; Wu, Xinyu; Stevens Bester, Cacey; Behringer, Robert

    2016-11-01

    Penetration of a solid projectile into dry granular matter is studied via two-dimensional impact experiments with bidisperse photoelastic grains. The drag force acting on the projectile is determined by high-speed imaging of the projectile's dynamics combined with the local granular response of the photoelastic grains. This force was previously shown using vertical impact to be the sum of a static, depth-dependent drag and a velocity-dependent inertial drag. Here the impact occurs obliquely, invoking a significant horizontal drag force that has not been fully explored. Accordingly we study the drag force model for oblique impact. We consider the influence of the projectile's impact speed and initial impact angle on its resultant trajectory. The path of the projectile changes drastically with impact angle. We therefore connect the effect of the impact angle to the nature of the drag force exerted on the projectile by the granular medium. supported by Duke University Provost's Postdoctoral Program, NASA Grant NNX15AD38G, and NSF-DMR-1206351.

  5. Generalized multiband typical medium dynamical cluster approximation: Application to (Ga,Mn)N

    DOE PAGES

    Zhang, Yi; Nelson, R.; Siddiqui, Elisha; ...

    2016-12-29

    Here, we generalize the multiband typical medium dynamical cluster approximation and the formalism introduced by Blackman, Esterling, and Berk so that it can deal with localization in multiband disordered systems with both diagonal and off-diagonal disorder with complicated potentials. We also introduce an ansatz for the momentum-resolved typical density of states that greatly improves the numerical stability of the method while preserving the independence of scattering events at different frequencies. Starting from the first-principles effective Hamiltonian, we also apply this method to the diluted magnetic semiconductor Ga 1 - x Mn x N , and find the impurity band ismore » completely localized for Mn concentrations x < 0.03 , while for 0.03 < x < 0.10 the impurity band has delocalized states but the chemical potential resides at or above the mobility edge. So, the system is always insulating within the experimental compositional limit ( x ≈ 0.10 ) due to Anderson localization. But, for 0.03 < x < 0.10 hole doping could make the system metallic, allowing double-exchange mediated, or enhanced, ferromagnetism. The developed method is expected to have a large impact on first-principles studies of Anderson localization.« less

  6. Generalized multiband typical medium dynamical cluster approximation: Application to (Ga,Mn)N

    SciTech Connect

    Zhang, Yi; Nelson, R.; Siddiqui, Elisha; Tam, K. -M.; Yu, U.; Berlijn, T.; Ku, W.; Vidhyadhiraja, N. S.; Moreno, J.; Jarrell, M.

    2016-12-29

    Here, we generalize the multiband typical medium dynamical cluster approximation and the formalism introduced by Blackman, Esterling, and Berk so that it can deal with localization in multiband disordered systems with both diagonal and off-diagonal disorder with complicated potentials. We also introduce an ansatz for the momentum-resolved typical density of states that greatly improves the numerical stability of the method while preserving the independence of scattering events at different frequencies. Starting from the first-principles effective Hamiltonian, we also apply this method to the diluted magnetic semiconductor Ga 1 - x Mn x N , and find the impurity band is completely localized for Mn concentrations x < 0.03 , while for 0.03 < x < 0.10 the impurity band has delocalized states but the chemical potential resides at or above the mobility edge. So, the system is always insulating within the experimental compositional limit ( x ≈ 0.10 ) due to Anderson localization. But, for 0.03 < x < 0.10 hole doping could make the system metallic, allowing double-exchange mediated, or enhanced, ferromagnetism. The developed method is expected to have a large impact on first-principles studies of Anderson localization.

  7. Generalized multiband typical medium dynamical cluster approximation: Application to (Ga,Mn)N

    DOE PAGES

    Zhang, Yi; Nelson, R.; Siddiqui, Elisha; ...

    2016-12-29

    We generalize the multiband typical medium dynamical cluster approximation and the formalism introduced by Blackman, Esterling, and Berk so that it can deal with localization in multiband disordered systems with both diagonal and off-diagonal disorder with complicated potentials. We also introduce an ansatz for the momentum-resolved typical density of states that greatly improves the numerical stability of the method while preserving the independence of scattering events at different frequencies. Starting from the first-principles effective Hamiltonian, we apply this method to the diluted magnetic semiconductor Ga 1 - x Mn x N , and find the impurity band is completely localizedmore » for Mn concentrations x < 0.03 , while for 0.03 < x < 0.10 the impurity band has delocalized states but the chemical potential resides at or above the mobility edge. So, the system is always insulating within the experimental compositional limit ( x ≈ 0.10 ) due to Anderson localization. But, for 0.03 < x < 0.10 hole doping could make the system metallic, allowing double-exchange mediated, or enhanced, ferromagnetism. Finally, this developed method is expected to have a large impact on first-principles studies of Anderson localization.« less

  8. Generalized multiband typical medium dynamical cluster approximation: Application to (Ga,Mn)N

    NASA Astrophysics Data System (ADS)

    Zhang, Yi; Nelson, R.; Siddiqui, Elisha; Tam, K.-M.; Yu, U.; Berlijn, T.; Ku, W.; Vidhyadhiraja, N. S.; Moreno, J.; Jarrell, M.

    2016-12-01

    We generalize the multiband typical medium dynamical cluster approximation and the formalism introduced by Blackman, Esterling, and Berk so that it can deal with localization in multiband disordered systems with both diagonal and off-diagonal disorder with complicated potentials. We also introduce an ansatz for the momentum-resolved typical density of states that greatly improves the numerical stability of the method while preserving the independence of scattering events at different frequencies. Starting from the first-principles effective Hamiltonian, we apply this method to the diluted magnetic semiconductor Ga1 -xMnxN , and find the impurity band is completely localized for Mn concentrations x <0.03 , while for 0.03

  9. Generalized multiband typical medium dynamical cluster approximation: Application to (Ga,Mn)N

    SciTech Connect

    Zhang, Yi; Nelson, R.; Siddiqui, Elisha; Tam, K. -M.; Yu, U.; Berlijn, T.; Ku, W.; Vidhyadhiraja, N. S.; Moreno, J.; Jarrell, M.

    2016-12-29

    We generalize the multiband typical medium dynamical cluster approximation and the formalism introduced by Blackman, Esterling, and Berk so that it can deal with localization in multiband disordered systems with both diagonal and off-diagonal disorder with complicated potentials. We also introduce an ansatz for the momentum-resolved typical density of states that greatly improves the numerical stability of the method while preserving the independence of scattering events at different frequencies. Starting from the first-principles effective Hamiltonian, we apply this method to the diluted magnetic semiconductor Ga 1 - x Mn x N , and find the impurity band is completely localized for Mn concentrations x < 0.03 , while for 0.03 < x < 0.10 the impurity band has delocalized states but the chemical potential resides at or above the mobility edge. So, the system is always insulating within the experimental compositional limit ( x ≈ 0.10 ) due to Anderson localization. But, for 0.03 < x < 0.10 hole doping could make the system metallic, allowing double-exchange mediated, or enhanced, ferromagnetism. Finally, this developed method is expected to have a large impact on first-principles studies of Anderson localization.

  10. Emergent dynamics of spatio-temporal chaos in a heterogeneous excitable medium

    NASA Astrophysics Data System (ADS)

    Bittihn, Philip; Berg, Sebastian; Parlitz, Ulrich; Luther, Stefan

    2017-09-01

    Self-organized activation patterns in excitable media such as spiral waves and spatio-temporal chaos underlie dangerous cardiac arrhythmias. While the interaction of single spiral waves with different types of heterogeneity has been studied extensively, the effect of heterogeneity on fully developed spatio-temporal chaos remains poorly understood. We investigate how the complexity and stability properties of spatio-temporal chaos in the Bär-Eiswirth model of excitable media depend on the heterogeneity of the underlying medium. We employ different measures characterizing the chaoticity of the system and find that the spatial arrangement of multiple discrete lower excitability regions has a strong impact on the complexity of the dynamics. Varying the number, shape, and spatial arrangement of the heterogeneities, we observe strong emergent effects ranging from increases in chaoticity to the complete cessation of chaos, contrasting the expectation from the homogeneous behavior. The implications of our findings for the development and treatment of arrhythmias in the heterogeneous cardiac muscle are discussed.

  11. Localization of phonons in mass-disordered alloys: A typical medium dynamical cluster approach

    DOE PAGES

    Mondal, Wasim Raja; Vidhyadhiraja, N. S.; Berlijn, Tom; ...

    2017-07-20

    The effect of disorder on lattice vibrational modes has been a topic of interest for several decades. In this work, we employ a Green's function based approach, namely, the dynamical cluster approximation (DCA), to investigate phonons in mass-disordered systems. Detailed benchmarks with previous exact calculations are used to validate the method in a wide parameter space. An extension of the method, namely, the typical medium DCA (TMDCA), is used to study Anderson localization of phonons in three dimensions. We show that, for binary isotopic disorder, lighter impurities induce localized modes beyond the bandwidth of the host system, while heavier impuritiesmore » lead to a partial localization of the low-frequency acoustic modes. For a uniform (box) distribution of masses, the physical spectrum is shown to develop long tails comprising mostly localized modes. The mobility edge separating extended and localized modes, obtained through the TMDCA, agrees well with results from the transfer matrix method. A reentrance behavior of the mobility edge with increasing disorder is found that is similar to, but somewhat more pronounced than, the behavior in disordered electronic systems. As a result, our work establishes a computational approach, which recovers the thermodynamic limit, is versatile and computationally inexpensive, to investigate lattice vibrations in disordered lattice systems.« less

  12. Dynamic stability of functionally graded nanobeam based on nonlocal Timoshenko theory considering surface effects

    NASA Astrophysics Data System (ADS)

    Saffari, Shahab; Hashemian, Mohammad; Toghraie, Davood

    2017-09-01

    Based on nonlocal Timoshenko beam theory, dynamic stability of functionally graded (FG) nanobeam under axial and thermal loading was investigated. Surface stress effects were implemented according to Gurtin-Murdoch continuum theory. Using power law distribution for FGM and von Karman geometric nonlinearity, governing equations were derived based on Hamilton's principle. The developed nonlocal models have the capability of interpreting small scale effects. Pasternak elastic medium was employed to represent the interaction of the FG nanobeam and the surrounding elastic medium. A parametric study was conducted to focus influences of the static load factor, temperature change, gradient index, nonlocal parameter, slenderness ratio, surface effect and springs constants of the elastic medium on the dynamic instability region (DIR) of the FG beam with simply-supported boundary conditions. It was found that differences between DIRs predicted by local and nonlocal beam theories are significant for beams with lower aspect ratio. Moreover, it was observed that in contrast to high temperature environments, at low temperatures, increasing the temperature change moves the origin of the DIR to higher excitation frequency zone and leads to further stability. Considering surface stress effects shifts the DIR of FG beam to higher frequency zone, also increasing the gradient index enhances the frequency of DIR.

  13. Temperature dependent droplet impact dynamics on flat and textured surfaces

    SciTech Connect

    Azar Alizadeh; Vaibhav Bahadur; Sheng Zhong; Wen Shang; Ri Li; James Ruud; Masako Yamada; Liehi Ge; Ali Dhinojwala; Manohar S Sohal

    2012-03-01

    Droplet impact dynamics determines the performance of surfaces used in many applications such as anti-icing, condensation, boiling and heat transfer. We study impact dynamics of water droplets on surfaces with chemistry/texture ranging from hydrophilic to superhydrophobic and across a temperature range spanning below freezing to near boiling conditions. Droplet retraction shows very strong temperature dependence especially for hydrophilic surfaces; it is seen that lower substrate temperatures lead to lesser retraction. Physics-based analyses show that the increased viscosity associated with lower temperatures can explain the decreased retraction. The present findings serve to guide further studies of dynamic fluid-structure interaction at various temperatures.

  14. Fluid dynamics at the interface between contacting elastic solids with randomly rough surfaces.

    PubMed

    Persson, B N J

    2010-07-07

    We study fluid dynamics at the interface between elastic solids with randomly rough surfaces. The contact mechanics model of Persson is used to take into account the elastic interaction between the solid walls, and the Bruggeman effective medium theory to account for the influence of the disorder on the fluid flow. We calculated the flow tensor which determines the pressure flow factor and, for example, the leak rate of static seals. It is shown how the perturbation treatment of Tripp can be extended to arbitrary order in the ratio between the root-mean-square roughness amplitude and the average interfacial surface separation. We introduce a matrix D(ζ), determined by the surface roughness power spectrum, which can be used to describe the anisotropy of the surface at any magnification ζ. Results are presented for the asymmetry factor γ(ζ) (generalized Peklenik number) for grinded steel and sandblasted PMMA surfaces. © 2010 IOP Publishing Ltd

  15. Electrostatic cloaking of surface structure for dynamic wetting

    PubMed Central

    Nita, Satoshi; Do-Quang, Minh; Wang, Jiayu; Chen, Yu-Chung; Suzuki, Yuji; Amberg, Gustav; Shiomi, Junichiro

    2017-01-01

    Dynamic wetting problems are fundamental to understanding the interaction between liquids and solids. Even in a superficially simple experimental situation, such as a droplet spreading over a dry surface, the result may depend not only on the liquid properties but also strongly on the substrate-surface properties; even for macroscopically smooth surfaces, the microscopic geometrical roughness can be important. In addition, because surfaces may often be naturally charged or electric fields are used to manipulate fluids, electric effects are crucial components that influence wetting phenomena. We investigate the interplay between electric forces and surface structures in dynamic wetting. Although surface microstructures can significantly hinder spreading, we find that electrostatics can “cloak” the microstructures, that is, deactivate the hindering. We identify the physics in terms of reduction in contact-line friction, which makes the dynamic wetting inertial force dominant and insensitive to the substrate properties. PMID:28275725

  16. Electrostatic cloaking of surface structure for dynamic wetting.

    PubMed

    Nita, Satoshi; Do-Quang, Minh; Wang, Jiayu; Chen, Yu-Chung; Suzuki, Yuji; Amberg, Gustav; Shiomi, Junichiro

    2017-02-01

    Dynamic wetting problems are fundamental to understanding the interaction between liquids and solids. Even in a superficially simple experimental situation, such as a droplet spreading over a dry surface, the result may depend not only on the liquid properties but also strongly on the substrate-surface properties; even for macroscopically smooth surfaces, the microscopic geometrical roughness can be important. In addition, because surfaces may often be naturally charged or electric fields are used to manipulate fluids, electric effects are crucial components that influence wetting phenomena. We investigate the interplay between electric forces and surface structures in dynamic wetting. Although surface microstructures can significantly hinder spreading, we find that electrostatics can "cloak" the microstructures, that is, deactivate the hindering. We identify the physics in terms of reduction in contact-line friction, which makes the dynamic wetting inertial force dominant and insensitive to the substrate properties.

  17. Dynamics of surface catalyzed reactions; the roles of surface defects, surface diffusion, and hot electrons.

    PubMed

    Somorjai, Gabor A; Bratlie, Kaitlin M; Montano, Max O; Park, Jeong Y

    2006-10-12

    The mechanism that controls bond breaking at transition metal surfaces has been studied with sum frequency generation (SFG), scanning tunneling microscopy (STM), and catalytic nanodiodes operating under the high-pressure conditions. The combination of these techniques permits us to understand the role of surface defects, surface diffusion, and hot electrons in dynamics of surface catalyzed reactions. Sum frequency generation vibrational spectroscopy and kinetic measurements were performed under 1.5 Torr of cyclohexene hydrogenation/dehydrogenation in the presence and absence of H(2) and over the temperature range 300-500 K on the Pt(100) and Pt(111) surfaces. The structure specificity of the Pt(100) and Pt(111) surfaces is exhibited by the surface species present during reaction. On Pt(100), pi-allyl c-C6H9, cyclohexyl (C6H11), and 1,4-cyclohexadiene are identified adsorbates, while on the Pt(111) surface, pi-allyl c-C6H9, 1,4-cyclohexadiene, and 1,3-cyclohexadiene are present. A scanning tunneling microscope that can be operated at high pressures and temperatures was used to study the Pt(111) surface during the catalytic hydrogenation/dehydrogenation of cyclohexene and its poisoning with CO. It was found that catalytically active surfaces were always disordered, while ordered surface were always catalytically deactivated. Only in the case of the CO poisoning at 350 K was a surface with a mobile adsorbed monolayer not catalytically active. From these results, a CO-dominated mobile overlayer that prevents reactant adsorption was proposed. By using the catalytic nanodiode, we detected the continuous flow of hot electron currents that is induced by the exothermic catalytic reaction. During the platinum-catalyzed oxidation of carbon monoxide, we monitored the flow of hot electrons over several hours using a metal-semiconductor Schottky diode composed of Pt and TiO2. The thickness of the Pt film used as the catalyst was 5 nm, less than the electron mean free path

  18. Laser activation of a nutrient medium and antibiotic solutions and its estimation by of bacteria growth dynamics

    NASA Astrophysics Data System (ADS)

    Malov, Alexander N.; Neupokoeva, Anna V.; Kokorina, Lubov A.; Simonova, Elena V.

    2016-11-01

    A laser photomodifacation of nutrient mediums and antibiotics results at the microbiological supervision of bacteria colonies growth are discussed. It is experimentally shown, that on the irradiated media there is a delay of bacterial colonies growth number. Influence of laser radiation on activity of an antibiotic also is experimentally studied. It is revealed, that laser photomodifacation increases antimicrobic activity of a preparation. The mechanism of biological solutions activation is connected with the phenomenon laser nanoclusterization. Parameters of bacteria growth bacteria growth dynamics allow to numerically estimate degree of laser activation of nutrient mediums and pharmaceutical preparations.

  19. Dynamics of inhomogeneous condensates in contact with a surface

    SciTech Connect

    Bludov, Yu. V.; Yan Zhenya; Konotop, V. V.

    2010-06-15

    We show that interplay of linear attractive (repulsive) boundary with inhomogeneous repulsive (attractive) interatomic interactions results in nonlinear localized surface modes (surface solitons), some of which are stable. We consider several example systems describing interaction of inhomogeneous Bose-Einstein condensates with rigid surfaces and allowing for exact solutions. The stability of the obtained modes is analyzed analytically and numerically. Stable localized surface modes are found and dynamics of the unstable modes is described.

  20. Fast Surface Dynamics of Metallic Glass Enable Superlatticelike Nanostructure Growth.

    PubMed

    Chen, L; Cao, C R; Shi, J A; Lu, Z; Sun, Y T; Luo, P; Gu, L; Bai, H Y; Pan, M X; Wang, W H

    2017-01-06

    Contrary to the formation of complicated polycrystals induced by general crystallization, a modulated superlatticelike nanostructure, which grows layer by layer from the surface to the interior of a Pd_{40}Ni_{10}Cu_{30}P_{20} metallic glass, is observed via isothermal annealing below the glass transition temperature. The generation of the modulated nanostructure can be solely controlled by the annealing temperature, and it can be understood based on the fast dynamic and liquidlike behavior of the glass surface. The observations have implications for understanding the glassy surface dynamics and pave a way for the controllable fabrication of a unique and sophisticated nanostructure on a glass surface to realize the properties' modification.

  1. Fast Surface Dynamics of Metallic Glass Enable Superlatticelike Nanostructure Growth

    NASA Astrophysics Data System (ADS)

    Chen, L.; Cao, C. R.; Shi, J. A.; Lu, Z.; Sun, Y. T.; Luo, P.; Gu, L.; Bai, H. Y.; Pan, M. X.; Wang, W. H.

    2017-01-01

    Contrary to the formation of complicated polycrystals induced by general crystallization, a modulated superlatticelike nanostructure, which grows layer by layer from the surface to the interior of a Pd40Ni10Cu30P20 metallic glass, is observed via isothermal annealing below the glass transition temperature. The generation of the modulated nanostructure can be solely controlled by the annealing temperature, and it can be understood based on the fast dynamic and liquidlike behavior of the glass surface. The observations have implications for understanding the glassy surface dynamics and pave a way for the controllable fabrication of a unique and sophisticated nanostructure on a glass surface to realize the properties' modification.

  2. Capturing medium scale heterogeneity in surface water-groundwater interactions: challenges and advantages of high resolution temperature data

    NASA Astrophysics Data System (ADS)

    Shanafield, M.; Cook, P. G.; McCallum, J.; Noorduijn, S.

    2013-12-01

    Although heat is now a commonly-used tracer for quantifying the movement of water between streams and streambed sediments, the measurements are commonly collected as vertical profiles. This results in point measurements that are often difficult to scale up. However, for understanding contaminant transport, nutrient cycling, and ecosystem use, it is important to capture streambed dynamics at a larger scale. In this study, over 1000 meters of fiber optic cable was installed at three depths in five parallel, longitudinal transects within the shallow subsurface of a large, intermittent channel in southeastern Australia. A fiber optic distributed temperature system was then used to collected time variable temperature measurements at each meter along the cable, giving high spatial resolution within the 20 meter by 20 meter by 0.5 meter deep study plot. At this resolution, the raw temperature data itself was useful for examining preferential flow pathways beneath the subsurface. While some areas responded to daily fluctuations in water temperature from the surface, other areas retained the initial temperature, allowing the observation of regions of increased and decreased flux, respectively. Complementing the temperature data, Guelph permeameter measurements for a range of depths at the study site also revealed a highly heterogeneous subsurface, with measured field saturation hydraulic conductivity values ranging from less than 0.006 to 3.1 meters per day. Given a limited amount of head information to parameterize the boundary conditions, the objective was to see how well the patterns observed in the raw data could be quantified using numerical models. Using inverse methods, we therefore used the temperature data to parameterize both one-dimensional and a three-dimensional heat and temperature transport models to quantify differences in flux rates within the study plot. Comparison of the advantages and limitations of these models provides insight into the challenges of

  3. Hydrology: The dynamics of Earth's surface water

    NASA Astrophysics Data System (ADS)

    Yamazaki, Dai; Trigg, Mark A.

    2016-12-01

    High-resolution satellite mapping of Earth's surface water during the past 32 years reveals changes in the planet's water systems, including the influence of natural cycles and human activities. See Letter p.418

  4. The ising model on the dynamical triangulated random surface

    SciTech Connect

    Aleinov, I.D.; Migelal, A.A.; Zmushkow, U.V. )

    1990-04-20

    The critical properties of Ising model on the dynamical triangulated random surface embedded in D-dimensional Euclidean space are investigated. The strong coupling expansion method is used. The transition to thermodynamical limit is performed by means of continuous fractions.

  5. Localization and Dynamics Determinations Over Spherical Surfaces

    DTIC Science & Technology

    1975-06-01

    where the variable SIs equal to unity, equations (4-1) and (4-2) become simply, ds .D/ r -2 (4-6) d" and, oYU - Y/12 (4-7) Thus, at the particular...miles was cho ,,n and source ranges in the near to intermediate tield are prvriumed rhe resulting -. indard deviation for the dynamic variables 84

  6. Influence of prestress and periodic corrugated boundary surfaces on Rayleigh waves in an orthotropic medium over a transversely isotropic dissipative semi-infinite substrate

    NASA Astrophysics Data System (ADS)

    Gupta, Shishir; Ahmed, Mostaid

    2017-01-01

    The paper environs the study of Rayleigh-type surface waves in an orthotropic crustal layer over a transversely isotropic dissipative semi-infinite medium under the effect of prestress and corrugated boundary surfaces. Separate displacement components for both media have been derived in order to characterize the dynamics of individual materials. Suitable boundary conditions have been employed upon the surface wave solutions of the elasto-dynamical equations that are taken into consideration in the light of corrugated boundary surfaces. From the real part of the sixth-order complex determinantal expression, we obtain the frequency equation for Rayleigh waves concerning the proposed earth model. Possible special cases have been envisaged and they fairly comply with the corresponding results for classical cases. Numerical computations have been performed in order to graphically demonstrate the role of the thickness of layer, prestress, corrugation parameters and dissipation on Rayleigh wave velocity. The study may be regarded as important due to its possible applications in delay line services and investigating deformation characteristics of solids as well as typical rock formations.

  7. Molecular dynamics simulation of wetting on modified amorphous silica surface

    NASA Astrophysics Data System (ADS)

    Chai, Jingchun; Liu, Shuyan; Yang, Xiaoning

    2009-08-01

    The microscopic wetting of water on amorphous silica surfaces has been investigated by molecular dynamics simulation. Different degrees of surface hydroxylation/silanization were considered. It was observed that the hydrophobicity becomes enhanced with an increase in the degree of surface silanization. A continuous transformation from hydrophilicity to hydrophobicity can be attained for the amorphous silica surfaces through surface modification. From the simulation result, the contact angle can exceed 90° when surface silanization percentage is above 50%, showing a hydrophobic character. It is also found that when the percentage of surface silanization is above 70% on the amorphous silica surface, the water contact angle almost remains unchanged (110-120°). This phenomenon is a little different from the wetting behavior on smooth quartz plates in previous experimental report. This change in the wettability on modified amorphous silica surfaces can be interpreted in terms of the interaction between water molecules and the silica surfaces.

  8. Effects of storage medium and UV photofunctionalization on time-related changes of titanium surface characteristics and biocompatibility.

    PubMed

    Shen, Jian-Wei; Chen, Yun; Yang, Guo-Li; Wang, Xiao-Xiang; He, Fu-Ming; Wang, Hui-Ming

    2016-07-01

    Storage in aqueous solution and ultraviolet (UV) photofunctionalization are two applicable methods to overcome the biological aging and increase the bioactivity of titanium. As information regarding the combined effects of storage medium and UV photofunctionalization has never been found in published literatures, this study focused on whether appropriate storage methods and UV photofunctionalization have synergistic effects on the biological properties of aged titanium surfaces. Titanium plates and discs were sandblasted and acid etched and then further prepared in five different modes as using different storage mediums (air or dH2 O) for 4 weeks and then with or without UV treatment. The surface characteristics were evaluated with scanning electron microscopy, contact angle measurements, and X-ray photoelectron spectroscopy. MC3T3-E1 cells were cultured on the surfaces, and cellular morphology, proliferation, alkaline phosphatase activity, and osteocalcin release were evaluated. The results showed that nanostructures were observed on water-stored titanium surfaces with a size of about 15 × 20 nm(2) . UV treatment was effective to remove the hydrocarbon contamination on titanium surfaces stored in either air or water. UV photofunctionalization further enhanced the already increased bioactivity of modSLA on initial cell attachment, proliferation, alkaline phosphatase activity, and osteocalcin release. Overall, UV photofunctionalization was effective in further enhancing the already increased bioactivity by using dH2 O as storage medium, and the effect of UV treatment was much more overwhelming than that of the storage medium. © 2015 Wiley Periodicals, Inc. J Biomed Mater Res Part B: Appl Biomater, 104B: 932-940, 2016.

  9. Dynamic rearrangement of surface proteins is essential for cytokinesis.

    PubMed

    Bauer, Tobias; Motosugi, Nami; Miura, Koichi; Sabe, Hisataka; Hiiragi, Takashi

    2008-03-01

    Cytokinesis is a complex process that involves dynamic cortical rearrangement. Our recent time-lapse recordings of the mouse egg unexpectedly revealed a high motility of the second polar body (2pb). Experiments to address its underlying mechanism show that neither mechanical compression by the zona pellucida nor the connection via the mid-body is required for the 2pb movement. Time-lapse recordings establish that the 2pb moves together with the cell membrane. These recordings, in which cell surface proteins are labeled with fluorescent latex-microbeads or monovalent antibodies against whole mouse proteins, indicate that the majority of the surface proteins dynamically accumulate in the cleavage furrow at every cell division. Comparable dynamics of the cell surface proteins, and specifically of E-cadherin, are also observed in cultured epithelial cells. The surface protein dynamics are closely correlated with, and dependent on, those of the underlying cortical actin. The cortical actin network may form a scaffold for membrane proteins and thereby transfer them during contractile ring formation toward the cleavage furrow. Immobilization of surface proteins by tetravalent lectin-mediated crosslinking results in the failure of cleavage, demonstrating that the observed protein dynamics are essential for cytokinesis. We propose that dynamic rearrangement of the cell surface proteins is a common feature of cytokinesis, playing a key role in modifying the mechanical properties of the cell membrane during cortical ingression. (c) 2008 Wiley-Liss, Inc.

  10. Optimization of medium composition for erythritol production from glycerol by Yarrowia lipolytica using response surface methodology.

    PubMed

    Rywińska, Anita; Marcinkiewicz, Marta; Cibis, Edmund; Rymowicz, Waldemar

    2015-08-18

    Several factors affecting erythritol production from glycerol by Yarrowia lipolytica Wratislavia K1 strain were examined in batch fermentations. Ammonium sulfate, monopotassium phosphate, and sodium chloride were identified as critical medium components that determine the ratio of polyols produced. The central composite rotatable experimental design was used to optimize medium composition for erythritol production. The concentrations of ammonium sulfate, monopotassium phosphate, and sodium chloride in the optimized medium were 2.25, 0.22, and 26.4 g L(-1), respectively. The C:N ratio was found as 81:1. In the optimized medium with 100 g L(-1) of glycerol the Wratislavia K1 strain produced 46.9 g L(-1) of erythritol, which corresponded to a 0.47 g g(-1) yield and a productivity of 0.85 g L(-1) hr(-1). In the fed-batch mode and medium with the total concentration of glycerol at 300 g L(-1) and C:N ratio at 81:1, 132 g L(-1) of erythritol was produced with 0.44 g g(-1) yield and a productivity of 1.01 g L(-1) hr(-1.)

  11. Monitoring Earth Surface Dynamics With Optical Imagery

    NASA Astrophysics Data System (ADS)

    Leprince, Sébastien; Berthier, Etienne; Ayoub, François; Delacourt, Christophe; Avouac, Jean-Philippe

    2008-01-01

    The increasing availability of high-quality optical satellite images should allow, in principle, continuous monitoring of Earth's surface changes due to geologic processes, climate change, or anthropic activity. For instance, sequential optical images have been used to measure displacements at Earth's surface due to coseismic ground deformation [e.g., Van Puymbroeck et al., 2000], ice flow [Scambos et al., 1992; Berthier et al., 2005], sand dune migration [Crippen, 1992], and landslides [Kääb, 2002; Delacourt et al., 2004]. Surface changes related to agriculture, deforestation, urbanization, and erosion-which do not involve ground displacement-might also be monitored, provided that the images can be registered with sufficient accuracy. Although the approach is simple in principle, its use is still limited, mainly because of geometric distortion of the images induced by the imaging system, biased correlation techniques, and implementation difficulties.

  12. Optical characterization of randomly microrough surfaces covered with very thin overlayers using effective medium approximation and Rayleigh-Rice theory

    NASA Astrophysics Data System (ADS)

    Ohlídal, Ivan; Vohánka, Jiří; Čermák, Martin; Franta, Daniel

    2017-10-01

    The modification of the effective medium approximation for randomly microrough surfaces covered by very thin overlayers based on inhomogeneous fictitious layers is formulated. The numerical analysis of this modification is performed using simulated ellipsometric data calculated using the Rayleigh-Rice theory. The system used to perform this numerical analysis consists of a randomly microrough silicon single crystal surface covered with a SiO2 overlayer. A comparison to the effective medium approximation based on homogeneous fictitious layers is carried out within this numerical analysis. For ellipsometry of the system mentioned above the possibilities and limitations of both the effective medium approximation approaches are discussed. The results obtained by means of the numerical analysis are confirmed by the ellipsometric characterization of two randomly microrough silicon single crystal substrates covered with native oxide overlayers. It is shown that the effective medium approximation approaches for this system exhibit strong deficiencies compared to the Rayleigh-Rice theory. The practical consequences implied by these results are presented. The results concerning the random microroughness are verified by means of measurements performed using atomic force microscopy.

  13. Bulk water freezing dynamics on superhydrophobic surfaces

    NASA Astrophysics Data System (ADS)

    Chavan, S.; Carpenter, J.; Nallapaneni, M.; Chen, J. Y.; Miljkovic, N.

    2017-01-01

    In this study, we elucidate the mechanisms governing the heat-transfer mediated, non-thermodynamic limited, freezing delay on non-wetting surfaces for a variety of characteristic length scales, Lc (volume/surface area, 3 mm < Lc < 6 mm) using carefully designed freezing experiments in a temperature-controlled, zero-humidity environment on thin water slabs. To probe the effect of surface wettability, we investigated the total time for room temperature water to completely freeze into ice on superhydrophilic ( θaapp→ 0°), hydrophilic (0° < θa < 90°), hydrophobic (90° < θa < 125°), and superhydrophobic ( θaapp→ 180°) surfaces. Our results show that at macroscopic length scales, heat conduction through the bulk water/ice layer dominates the freezing process when compared to heat conduction through the functional coatings or nanoscale gaps at the superhydrophobic substrate-water/ice interface. In order to verify our findings, and to determine when the surface structure thermal resistance approaches the water/ice resistance, we fabricated and tested the additional substrates coated with commercial superhydrophobic spray coatings, showing a monotonic increase in freezing time with coating thickness. The added thermal resistance of thicker coatings was much larger than that of the nanoscale superhydrophobic features, which reduced the droplet heat transfer and increased the total freezing time. Transient finite element method heat transfer simulations of the water slab freezing process were performed to calculate the overall heat transfer coefficient at the substrate-water/ice interface during freezing, and shown to be in the range of 1-2.5 kW/m2K for these experiments. The results shown here suggest that in order to exploit the heat-transfer mediated freezing delay, thicker superhydrophobic coatings must be deposited on the surface, where the coating resistance is comparable to the bulk water/ice conduction resistance.

  14. Dynamics of photoinduced reactions at oxide surfaces

    NASA Astrophysics Data System (ADS)

    Al-Shamery, K.

    1996-11-01

    This report summarizes our work on UV-laser induced desorption of small molecules and atoms from transition metal oxides. The systems presented serve as examples for a simple photochemical reaction, the fission of the molecule surface bond. State resolved detection methods were used to record the final state distributions of the desorbing neutral molecules. Detailed results on the systems NO/NiO(1 1 1) and CO/Cr2O3(0 0 0 1) are presented. The experiments include investigations on stereodynamic aspects like the angular distributions of the desorbing molecules and, in the case of CO desorption, the rotational alignment with respect to the surface normal. Large desorption cross sections of (6±1) ṡ 10-17 cm2 for NO and (3.5±1) ṡ 10-17 cm2 for CO have been found for the desorption at 6.4 eV. The wavelength dependence indicates that the primary excitation step is substrate induced. The final state distributions show a high degree of translational, rotational and vibrational excitation and are clearly nonthermal of origin. The results are consistent with the formation of a negative ion intermediate state of the adsorbate. This observation is supported from a comparison to former results on NO/NiO(1 0 0) for which extensive ab initio calculations including electronically excited states exist. A spin state dependence of the vibrational excitation of NO could only be observed for NO/NiO(1 1 1) and is absent for NO/NiO(1 0 0). We attribute this observation to a spin state dependent coupling of the desorbing molecule to the surface in case the spin lattice orientation of the surface shows a preferential orientation. In the (1 1 1) plane the spin orientation is parallel within neighbour nickel ions while it is alternating in the (1 0 0) plane. For both systems studied the velocity component parallel to the surface is constant leading to a strong peaking along the surface normal for the fast molecules. The change from a preferred helicopter rotation (angular momentum

  15. Universality classes for the dynamic surface critical behavior of systems with relaxational dynamics

    NASA Astrophysics Data System (ADS)

    Diehl, H. W.

    1994-01-01

    We investigate the problem of which universality classes of dynamic surface critical behavior exist for semi-infinite systems whose dynamic bulk critical behavior and static surface critical behavior are representative of a given dynamic bulk universality class and a given static surface universality class. To this end systems whose bulk dynamics are described by either model B or model A of Halperin, Hohenberg, and Ma are considered, where the dynamics are allowed to be modified near the surface as follows: In the case of model B, surface terms that locally break the conservation law for the order-parameter density φ are allowed; in the case of model A, φ is assumed to be locally conserved near the surface. Semi-infinite field-theory models are constructed that are (i) compatible with the requested bulk dynamics and the requirements of causality, detailed balance, and relaxation to thermal equilibrium and (ii) minimal in the sense that no redundant or irrelevant surface terms are included. The boundary conditions to which the surface terms of the action correspond are worked out. For model B it is shown that nonconservative surface terms are relevant. Their strength can be parametrized by a coupling constant c~0>=0 whose inverse plays the role of an extrapolation length for the auxiliary (Martin-Siggia-Rose) field φ~. Thus two distinct semi-infinite extensions of model B exist-one with c~0>0 called model BA, and one with c~0=0 called model BB-and each static surface universality class splits up into two dynamic surface universality classes. The static and dynamic surface critical exponents of these dynamic surface universality classes as well as the crossover exponent associated with the nonconservative surface term are shown to be expressible in terms of static bulk and surface exponents. Model BA and its results should apply, e.g., to uniaxial ferromagnets whose rotational spin symmetry is broken in the vicinity of a surface plane. For model A the considered

  16. Assessment of dynamic surface leaching of monolithic surface road materials.

    PubMed

    Paulus, Hélène; Schick, Joachim; Poirier, Jean-Eric

    2016-07-01

    Construction materials have to satisfy, among others, health and environment requirements. To check the environmental compatibility of road construction materials, release of hazardous substances into water must be assessed. Literature mostly describes the leaching behaviour of recycled aggregates for potential use in base or sub-base layers of roads. But little is known about the release of soluble substances by materials mixed with binders and compacted for intended use on road surface. In the present study, we thus performed a diffusion test with sequential renewal of water during a 64 day period according to CEN/TS 16637-2 specifications, on asphalt concretes and hydraulically bound monoliths, two common surface road materials. It is shown that release of dangerous substances is limited in these hydrodynamic conditions. It was particularly true for asphalt concrete leachates where no metallic trace element, sulphate, chloride or fluoride ion could be quantified. This is because of the low hydraulic conductivity and the low polarity of the petroleum hydrocarbon binder of these specimens. For hydraulically bound materials around 20,000 mg/m(2) of sulphate diffused from the monoliths. It is one order of magnitude higher than chloride diffusion and two orders of magnitude higher than fluoride release. No metallic trace element, except small quantities of copper in the last eluate could be quantified. No adverse effect is to be expected for human and environmental health from the leachates of these compacted surface road construction materials, because all the measured parameters were below EU (Council Directive 98/83/EC) or WHO guidelines for drinking water standards. Copyright © 2016 Elsevier Ltd. All rights reserved.

  17. Femtosecond pulses in a dense two-level medium: Spectral transformations, transient processes, and collisional dynamics

    SciTech Connect

    Novitsky, Denis V.

    2011-07-15

    Propagation of ultrashort optical pulses in a dense resonant medium is considered in the semiclassical limit. In our analysis, we place emphasis on several main points. First, we study transformations of spectra in the process of pulse propagation and interactions with another pulse. The second point involves the transient processes (including pulse compression) connected with self-induced transparency soliton formation inside the medium. Finally, the third aspect is the study of collisions of co- and counterpropagating pulses in the medium. In the last case, the investigation of symmetric and asymmetric collisions shows the possibility of effectively controlling the parameters of transmitted radiation.

  18. Simulation of Gas-Surface Dynamical Interactions

    DTIC Science & Technology

    2007-07-01

    the interacting particle on the surface. Trapping probabilities often scale as Ei cosn θi with n < 2. An exponent of n = 0 corresponds to total energy...1996). [85] A. E. Wiskerke, F. H. Geuzebroek, A. W. Kleyn, and B. E. Hayden, Surf. Sci. 272, 256 (1992). [86] J. E. Hurst , L. Wharton, K. C. Janda

  19. Using surface deformation to image reservoir dynamics

    SciTech Connect

    Vasco, D.W.; Karasaki, K.; Doughty, C.

    2000-02-01

    The inversion of surface deformation data such as tilt, displacement, or strain provides a noninvasive method for monitoring subsurface volume change. Reservoir volume change is related directly to processes such as pressure variations induced by injection and withdrawal. The inversion procedure is illustrated by an application to tiltmeter data from the Hijiori test site in Japan. An inversion of surface tilt data allows one to image flow processes in a fractured granodiorite. Approximately 650 barrels of water, injected 2 km below the surface, produces a peak surface tilt of the order of 0.8 microradians. The authors find that the pattern of volume change in the granodiorite is very asymmetrical, elongated in a north-northwesterly direction, and the maximum volume change is offset by more than 0.7 km to the east of the pumping well. The inversion of a suite of leveling data from the Wilmington oil field in Long Beach, California, images large-scale reservoir volume changes in 12 one- to two-year increments from 1976 to 1996. The influence of various production strategies is seen in the reservoir volume changes. In particular, a steam flood in fault block 2 in the northwest portion of the field produced a sudden decrease in reservoir volume.

  20. Bubble Dynamics on a Heated Surface

    NASA Technical Reports Server (NTRS)

    Kassemi, Mohammad; Rashidnia, Nasser

    1996-01-01

    In this work, we study the combined thermocapillary and natural convective flow generated by a bubble on a heated solid surface. The interaction between gas and vapor bubbles with the surrounding fluid is of interest for both space and ground-based processing. On earth, the volumetric forces are dominant, especially, in apparatuses with large volume to surface ratio. But in the reduced gravity environment of orbiting spacecraft, surface forces become more important and the effects of Marangoni convection are easily unmasked. In order to delineate the roles of the various interacting phenomena, a combined numerical-experimental approach is adopted. The temperature field is visualized using Mach-Zehnder interferometry and the flow field is observed by a laser sheet flow visualization technique. A finite element numerical model is developed which solves the two-dimensional momentum and energy equations and includes the effects of bubble surface deformation. Steady state temperature and velocity fields predicted by the finite element model are in excellent qualitative agreement with the experimental results. A parametric study of the interaction between Marangoni and natural convective flows including conditions pertinent to microgravity space experiments is presented. Numerical simulations clearly indicate that there is a considerable difference between 1-g and low-g temperature and flow fields induced by the bubble.

  1. SYSTEM IDENTIFICATION OF SURFACE SHIP DYNAMICS.

    DTIC Science & Technology

    The feasibility of applying a Newtonian system identification technique to a nonlinear three degree of freedom system of equations describing the...steering and maneuvering of a surface ship is investigated. The input to the system identification program is provided by both analog and digital

  2. The short- to medium-term predictive accuracy of static and dynamic risk assessment measures in a secure forensic hospital.

    PubMed

    Chu, Chi Meng; Thomas, Stuart D M; Ogloff, James R P; Daffern, Michael

    2013-04-01

    Although violence risk assessment knowledge and practice has advanced over the past few decades, it remains practically difficult to decide which measures clinicians should use to assess and make decisions about the violence potential of individuals on an ongoing basis, particularly in the short to medium term. Within this context, this study sought to compare the predictive accuracy of dynamic risk assessment measures for violence with static risk assessment measures over the short term (up to 1 month) and medium term (up to 6 months) in a forensic psychiatric inpatient setting. Results showed that dynamic measures were generally more accurate than static measures for short- to medium-term predictions of inpatient aggression. These findings highlight the necessity of using risk assessment measures that are sensitive to important clinical risk state variables to improve the short- to medium-term prediction of aggression within the forensic inpatient setting. Such knowledge can assist with the development of more accurate and efficient risk assessment procedures, including the selection of appropriate risk assessment instruments to manage and prevent the violence of offenders with mental illnesses during inpatient treatment.

  3. Metal enrichment of the intracluster medium: a three-dimensional picture of chemical and dynamical properties

    NASA Astrophysics Data System (ADS)

    Cora, Sofía A.

    2006-06-01

    We develop a model for the metal enrichment of the intracluster medium (ICM) that combines a cosmological non-radiative hydrodynamical N-body/SPH (smoothed particle hydrodynamic) simulation of a cluster of galaxies, and a semi-analytic model of galaxy formation. The novel feature of our hybrid model is that the chemical properties of the diffuse gas in the underlying simulation are dynamically and consistently generated from stars in the galaxies. We follow the production of several chemical elements, provided by low- and intermediate-mass stars, core collapse and Type Ia supernovae. We analyse the spatial distribution of metals in the ICM, investigate the way in which the chemical enrichment proceeds and use iron emissivity as a tracer of gas motions. The similar abundance patterns developed by O and Fe indicate that both types of supernovae pollute the ICM in a similar fashion. Their radial abundance profiles are enhanced in the inner 100h-1 kpc in the last Gyr because of the convergence of enriched gas clumps to the cluster centre; this increment cannot be explained by the metal ejection of cluster galaxies which is quite low at the present epoch. Our results support a scenario in which part of the central intracluster gas comes from gas clumps that, in the redshift range of z~ 0.2 to 0.5, have been enriched to solar values and are at large distances from the cluster centre (from ~1 to 6h-1 Mpc) moving at very high velocities (from ~1300 to 2500kms-1). The turbulent gas motions within the cluster, originated in the inhomogeneous gas infall during the cluster assembly, are manifested in emission-weighted velocity maps as gradients that can be as large as ~1000kms-1 over distances of a few hundred kpc. Gradients of this magnitude are also seen in velocity distributions along sightlines through the cluster centre. Doppler shifting and broadening suffered by the Fe Kα 6.7-keV emission line along such sightlines could be used to probe these gas large-scale motions

  4. Dynamic interactions of Leidenfrost droplets on liquid metal surface

    NASA Astrophysics Data System (ADS)

    Ding, Yujie; Liu, Jing

    2016-09-01

    Leidenfrost dynamic interaction effects of the isopentane droplets on the surface of heated liquid metal were disclosed. Unlike conventional rigid metal, such conductive and deformable liquid metal surface enables the levitating droplets to demonstrate rather abundant and complex dynamics. The Leidenfrost droplets at different diameters present diverse morphologies and behaviors like rotation and oscillation. Depending on the distance between the evaporating droplets, they attract and repulse each other through the curved surfaces beneath them and their vapor flows. With high boiling point up to 2000 °C, liquid metal offers a unique platform for testing the evaporating properties of a wide variety of liquid even solid.

  5. 3D vesicle dynamics simulations with a linearly triangulated surface

    NASA Astrophysics Data System (ADS)

    Boedec, G.; Leonetti, M.; Jaeger, M.

    2011-02-01

    Simulations of biomembranes have gained an increasing interest in the past years. Specificities of these membranes propose new challenges for the numerics. In particular, vesicle dynamics are governed by bending forces as well as a surface incompressibility constraint. A method to compute the bending force density resultant onto piecewise linearly triangulated surface meshes is described. This method is coupled with a boundary element method solver for inner and outer fluids, to compute vesicle dynamics under external flows. The surface incompressibility constraint is satisfied by the construction of a projection operator.

  6. Enhancement of Raman scattering signals from gaseous medium near the surface of a holographic aluminum diffraction grating

    NASA Astrophysics Data System (ADS)

    Petrov, D. V.; Sedinkin, D. O.; Zaripov, A. R.

    2016-11-01

    The possibility of applying surface-enhanced Raman scattering (RS) for amplification of RS intensity in gaseous media is investigated. A more than sixfold enhancement of the RS signal is detected experimentally from the main atmospheric air components during interaction of continuous-wave laser radiation with a holographic aluminum diffraction grating. The averaged value of the RS signals' amplification factor in the near-surface 30-nm-thick layer at the boundary between the diffraction grating and gaseous medium amounted to 3 × 103.

  7. Dynamic friction of self-affine surfaces

    NASA Astrophysics Data System (ADS)

    Schmittbuhl, Jean; Vilotte, Jean-Pierre; Roux, Stéphane

    1994-02-01

    We investigate the velocity dependence of the friction between two rigid blocks limited by a self-affine surface such as the one generated by a crack. The upper solid is subjected either to gravity or to an external elastic stiffness, and is driven horizontally at constant velocity, V, while the lower solid is fixed. For low velocities, the apparent friction coefficient is constant. For high velocities, the apparent friction is shown to display a velocity weakening. The weakening can be related to the variation of the mean contact time due to the occurrence of jumps during the motions. The cross-over between these two regimes corresponds to a characteristic velocity which depends on the geometry of the surfaces and on the mean normal force. In the case of simple gravity loading, the velocity dependence of the apparent friction at high velocities is proportional to 1/V^2 where V is the imposed tangential velocity. In the case of external elastic stiffness, two velocity weakening regimes can be identified, the first is identical to the gravity case with a 1/V^2 dependence, the second appears at higher velocities and is characterized by a 1/V variation. The characteristic velocity of this second cross-over depends on the roughness and the elastic stiffness. The statistical distribution of ballistic flight distances is analysed, and is shown to reveal in all cases the self-affinity of the contacting surfaces. Nous analysons la dépendence en vitesse du frottement entre deux solides limités par une surface rugueuse auto-affine comme celle d'une surface de fracture. Le solide supérieur est soumis soit à la gravité, soit à une raideur élastique externe, et est entraîné à vitesse horizontale constante V sur le solide inférieur fixe. A faible vitesse, le coefficient de friction apparent, est constant. A forte vitesse, le coefficient de friction apparent devient inversement proportionnel à la vitesse. Cette dépendance peut être reliée à la variation du temps

  8. Temperature dependent droplet impact dynamics on flat and textured surfaces

    NASA Astrophysics Data System (ADS)

    Alizadeh, Azar; Bahadur, Vaibhav; Zhong, Sheng; Shang, Wen; Li, Ri; Ruud, James; Yamada, Masako; Ge, Liehui; Dhinojwala, Ali; Sohal, Manohar

    2012-03-01

    Droplet impact dynamics determines the performance of surfaces used in many applications such as anti-icing, condensation, boiling, and heat transfer. We study impact dynamics of water droplets on surfaces with chemistry/texture ranging from hydrophilic to superhydrophobic and across a temperature range spanning below freezing to near boiling conditions. Droplet retraction shows very strong temperature dependence especially on hydrophilic surfaces; it is seen that lower substrate temperatures lead to lesser retraction. Physics-based analyses show that the increased viscosity associated with lower temperatures combined with an increased work of adhesion can explain the decreased retraction. The present findings serve as a starting point to guide further studies of dynamic fluid-surface interaction at various temperatures.

  9. Dynamics of Spreading on Micro-Textured Surfaces

    NASA Astrophysics Data System (ADS)

    Mohammad Karim, Alireza; Rothstein, Jonathan; Kavehpour, Pirouz

    2015-11-01

    Ultrahydrophobic surfaces, due to their large water-repellency characteristic, have a vast variety of applications in technology and nature, such as de-icing of airplane wings, efficiency increase of power plants, and efficiency of pesticides on plants, etc. The significance of ultrahydrophobic surfaces requires enhancing the knowledge on the spreading dynamics on such surfaces. The best way to produce an ultrahydrophobic surface is by patterning of smooth hydrophobic surfaces with micron sized posts. In this research, the micro-textured surfaces have been fabricated by patterning several different sizes of micro-textured posts on Teflon plates. The experimental study has been performed using forced spreading with Tensiometer to obtain the dependencw of dynamic contact angle to the contact line velocity to describe the spreading dynamics of Newtonian liquids on the micro-textured surfaces. The effect of the geometrical descriptions of the micro-posts along with the physical properties of liquids on the spreading dynamics on micro-textured Teflon plates have been also studied.

  10. The Surface Wave Dynamics Experiment (SWADE)

    NASA Technical Reports Server (NTRS)

    Long, S. R.; Oberholtzer, J. D.; Wright, C. W.; Shirk, H. G.

    1988-01-01

    SWADE was developed to study the dynamics of the wave field development in the open ocean with the following specific objectives: (1) to understand the development of the wave directional spectrum under various conditions; (2) to determine the effect of waves on the air/sea transfers of momentum, heat, and mass; (3) to determine breaking distributions as a function of sea state, wind, and boundary stability; and (4) to provide data and analyses for ERS-1 validation. The experiment is designed for the winter of 1990 to 1991. Four buoys will be deployed for 6 months starting October 1990 and ending March 1991. During that time period, three intensive periods of 2 weeks duration each will be selected for frequent aircraft flights for wave data collection to satisfy scientific studies, as well as ERS-1 validation needs.

  11. Chemical Dynamics at Surfaces of Metal Nanomaterials

    DTIC Science & Technology

    2014-07-23

    and to use the new tools to investigate whether a fundamental physical principle, the Born-Oppenheimer Approximation ( BOA ), is valid on the surfaces...systems largely depend on whether BOA is valid12-14. In the following, the accomplishments will be briefly described. 2.1 The vibrational cross angle...nct vibrati ite boxes in (marked w with a simil oretical calc f 4nm Au p rface of 4n angstrom m ation ( BOA d to be much BOA is wh vibrationa very

  12. Dynamical quantum filtering in hydrogen surface reactions

    NASA Astrophysics Data System (ADS)

    Diño, Wilson Agerico; Kasai, Hideaki; Okiji, Ayao

    1998-11-01

    We report on how surfaces that adsorb hydrogen could act as rotational quantum state filters and cause, for example, D 2 molecules desorbing in the vibrational ground state from Cu(111) to exhibit strong rotational alignment. For low final translational energies, we found that desorbing D 2 molecules have rotational alignment factor values corresponding to cartwheel-type rotational preference. As the final translational energy increases, the corresponding alignment factor increases initially to values corresponding to helicopter-type rotational preference and then, eventually, decreases to values almost compatible with a spatially isotropic distribution, as the translational energy increases further.

  13. Static and dynamic contact angles of water droplet on a solid surface using molecular dynamics simulation.

    PubMed

    Hong, Seung Do; Ha, Man Yeong; Balachandar, S

    2009-11-01

    The present study investigates the variation of static contact angle of a water droplet in equilibrium with a solid surface in the absence of a body force and the dynamic contact angles of water droplet moving on a solid surface for different characteristic energies using the molecular dynamics simulation. With increasing characteristic energy, the static contact angle in equilibrium with a solid surface in the absence of a body force decreases because the hydrophobic surface changes its characteristics to the hydrophilic surface. In order to consider the effect of moving water droplet on the dynamic contact angles, we apply the constant acceleration to an individual oxygen and hydrogen atom. In the presence of a body force, the water droplet changes its shape with larger advancing contact angle than the receding angle. The dynamic contact angles are compared with the static contact angle in order to see the effect of the presence of a body force.

  14. Effect of the Earth's surface topography on the quasi-dynamic earthquake cycle

    NASA Astrophysics Data System (ADS)

    Ohtani, M.; Hirahara, K.

    2014-12-01

    For quasi-dynamic earthquake cycle simulations (ECSs) using BIEM, we have developed a method of calculating slip response function (SRF) in a homogeneous elastic medium with an arbitrary shaped Earth's surface topography (Ohtani and Hirahara, 2013; Paper1). In this study, we report the improvement in our method. Following Hok and Fukuyama (2011), we set the Earth's surface as a free surface, in addition to the fault interface, in a homogeneous full-space medium. Then, using the analytic solution in full-space, we can calculate the Earth's surface deformation, then the SRF change. The surface cell setting determines the accuracy. For reducing the computational amount, we use the different sizes of the surface region and its divided subfault cells, depending on the fault depth. Paper1 used the uniform size for surface cells. Here, we improved our method where the Earth's surface cells closer to the trench have the finer sizes for achieving more accuracy. With such numerical SRF, we performed the quasi-dynamic ECS on a model, where the Earth's surface is convex upward. Basically, with this topography, the slip behavior approaches the full-space case, from the half-space with flat surface case. This is because the distance from the Earth's surface to the fault becomes large. When we set two asperities with negative A - B in the positive A - B background at 10km and 35km depths, the two asperities rupture independently. The recurrence time of the shallow asperity is Trshalf = 34.95, Trsflat = 34.89, and Trsactual =32.82 years, when using analytic SRF in half-space, and numerical SRF with flat surface and with actual topography, respectively. For each case, the recurrence time of the deep asperity is Tr1_dhalf = 26.80, Tr1_dflat = 26.89, and Tr1_dactual =26.69 years. Thus, the shallower asperity is more affected by the Earth's surface topography than the deeper one, because the distance change rate from the surface to the fault is larger. On the other hand, when we set

  15. Fluid dynamics of liquids on Titans surface

    NASA Astrophysics Data System (ADS)

    Ori, Gian Gabriele; Marinangeli, Lucia; Baliva, Antonio; Bressan, Mario; Strom, Robert G.

    1998-10-01

    On the surface of Titan liquids can be present in three types of environments : (i) oceans, (ii) seas and lakes, and (iii) fluvial channels. The liquid in these environments will be affected by several types of motion: progressive (tidal) waves, wind-generated waves and unidirectional currents. The physical parameters of the liquid on Titans surface can be reconstructed using the Peng-Robinson equation of state. The total energy of the waves, both tidal and wind, depends on the gravity and liquid density ; both values are lower on Titan than on Earth. Thus, the same total energy will produce larger waves on Titan. This is also valid also for the progressive waves, as it is confirmed by the physical relationship between horizontal velocity, wave amplitude, and depth of the liquid. Wind-driven waves also will tend to be larger, because the viscosity of the liquid (which is lower on Titan) controls the deformation of the liquid under shear stress. Wind-generated waves would be rather large, but the dimension of the liquid basin limits the size of the waves ; in small lakes or seas the wave power cannot reach large values. Unidirectional currents are also affected by the liquid properties. Both the relations from driving and resting forces and the Reynolds number suggests that the flows exhibit a large erosional capacity and that, theoretically, a true fluvial network could be formed. However, caution should be exercised, because the cohesion of the sedimentary interface can armour bottom and induce laterally extensive, unchanelled sheet flows with small erosional capacity.

  16. Land Surface Microwave Emissivity Dynamics: Observations, Analysis and Modeling

    NASA Technical Reports Server (NTRS)

    Tian, Yudong; Peters-Lidard, Christa D.; Harrison, Kenneth W.; Kumar, Sujay; Ringerud, Sarah

    2014-01-01

    Land surface microwave emissivity affects remote sensing of both the atmosphere and the land surface. The dynamical behavior of microwave emissivity over a very diverse sample of land surface types is studied. With seven years of satellite measurements from AMSR-E, we identified various dynamical regimes of the land surface emission. In addition, we used two radiative transfer models (RTMs), the Community Radiative Transfer Model (CRTM) and the Community Microwave Emission Modeling Platform (CMEM), to simulate land surface emissivity dynamics. With both CRTM and CMEM coupled to NASA's Land Information System, global-scale land surface microwave emissivities were simulated for five years, and evaluated against AMSR-E observations. It is found that both models have successes and failures over various types of land surfaces. Among them, the desert shows the most consistent underestimates (by approx. 70-80%), due to limitations of the physical models used, and requires a revision in both systems. Other snow-free surface types exhibit various degrees of success and it is expected that parameter tuning can improve their performances.

  17. Land Surface Microwave Emissivity Dynamics: Observations, Analysis and Modeling

    NASA Technical Reports Server (NTRS)

    Tian, Yudong; Peters-Lidard, Christa D.; Harrison, Kenneth W.; Kumar, Sujay; Ringerud, Sarah

    2014-01-01

    Land surface microwave emissivity affects remote sensing of both the atmosphere and the land surface. The dynamical behavior of microwave emissivity over a very diverse sample of land surface types is studied. With seven years of satellite measurements from AMSR-E, we identified various dynamical regimes of the land surface emission. In addition, we used two radiative transfer models (RTMs), the Community Radiative Transfer Model (CRTM) and the Community Microwave Emission Modeling Platform (CMEM), to simulate land surface emissivity dynamics. With both CRTM and CMEM coupled to NASA's Land Information System, global-scale land surface microwave emissivities were simulated for five years, and evaluated against AMSR-E observations. It is found that both models have successes and failures over various types of land surfaces. Among them, the desert shows the most consistent underestimates (by approx. 70-80%), due to limitations of the physical models used, and requires a revision in both systems. Other snow-free surface types exhibit various degrees of success and it is expected that parameter tuning can improve their performances.

  18. Optimization of Fermentation Medium for Extracellular Lipase Production from Aspergillus niger Using Response Surface Methodology

    PubMed Central

    Jia, Jia; Yang, Xiaofeng; Wu, Zhiliang; Zhang, Qian; Lin, Zhi; Guo, Hongtao; Lin, Carol Sze Ki; Wang, Jianying; Wang, Yunshan

    2015-01-01

    Lipase produced by Aspergillus niger is widely used in various industries. In this study, extracellular lipase production from an industrial producing strain of A. niger was improved by medium optimization. The secondary carbon source, nitrogen source, and lipid were found to be the three most influential factors for lipase production by single-factor experiments. According to the statistical approach, the optimum values of three most influential parameters were determined: 10.5 g/L corn starch, 35.4 g/L soybean meal, and 10.9 g/L soybean oil. Using this optimum medium, the best lipase activity was obtained at 2,171 U/mL, which was 16.4% higher than using the initial medium. All these results confirmed the validity of the model. Furthermore, results of the Box-Behnken Design and quadratic models analysis indicated that the carbon to nitrogen (C/N) ratio significantly influenced the enzyme production, which also suggested that more attention should be paid to the C/N ratio for the optimization of enzyme production. PMID:26366414

  19. Optimization of Fermentation Medium for Extracellular Lipase Production from Aspergillus niger Using Response Surface Methodology.

    PubMed

    Jia, Jia; Yang, Xiaofeng; Wu, Zhiliang; Zhang, Qian; Lin, Zhi; Guo, Hongtao; Lin, Carol Sze Ki; Wang, Jianying; Wang, Yunshan

    2015-01-01

    Lipase produced by Aspergillus niger is widely used in various industries. In this study, extracellular lipase production from an industrial producing strain of A. niger was improved by medium optimization. The secondary carbon source, nitrogen source, and lipid were found to be the three most influential factors for lipase production by single-factor experiments. According to the statistical approach, the optimum values of three most influential parameters were determined: 10.5 g/L corn starch, 35.4 g/L soybean meal, and 10.9 g/L soybean oil. Using this optimum medium, the best lipase activity was obtained at 2,171 U/mL, which was 16.4% higher than using the initial medium. All these results confirmed the validity of the model. Furthermore, results of the Box-Behnken Design and quadratic models analysis indicated that the carbon to nitrogen (C/N) ratio significantly influenced the enzyme production, which also suggested that more attention should be paid to the C/N ratio for the optimization of enzyme production.

  20. Controlling surfaces in plasma processing: role of ions via molecular dynamics simulations of surface chemistry

    NASA Astrophysics Data System (ADS)

    Humbird, David; Graves, David B.

    2002-08-01

    A study of the interactions of energetic ions with various surfaces using molecular dynamics simulations is reported. Silicon atoms in the amorphous region are readily mixed by argon ions. Limited mixing in the crystalline layer is observed. Fluorine adsorbed on the silicon surface does not mix into the layer with argon ion impact. When an energetic F+ impacts a silicon surface, the uptake and apparent sub-surface mixing of F is much greater than Ar+-induced mixing. However, a closer examination shows that the F impacts have primarily increased the Si surface area by creating crevices and cracks, and that the F remains mainly on the surface of this layer.

  1. Molecular dynamics simulation of annealed ZnO surfaces

    SciTech Connect

    Min, Tjun Kit; Yoon, Tiem Leong; Lim, Thong Leng

    2015-04-24

    The effect of thermally annealing a slab of wurtzite ZnO, terminated by two surfaces, (0001) (which is oxygen-terminated) and (0001{sup ¯}) (which is Zn-terminated), is investigated via molecular dynamics simulation by using reactive force field (ReaxFF). We found that upon heating beyond a threshold temperature of ∼700 K, surface oxygen atoms begin to sublimate from the (0001) surface. The ratio of oxygen leaving the surface at a given temperature increases as the heating temperature increases. A range of phenomena occurring at the atomic level on the (0001) surface has also been explored, such as formation of oxygen dimers on the surface and evolution of partial charge distribution in the slab during the annealing process. It was found that the partial charge distribution as a function of the depth from the surface undergoes a qualitative change when the annealing temperature is above the threshold temperature.

  2. Dynamics of small mobile helium clusters near tungsten surfaces

    NASA Astrophysics Data System (ADS)

    Hu, Lin; Hammond, Karl D.; Wirth, Brian D.; Maroudas, Dimitrios

    2014-08-01

    We report the results of a systematic atomic-scale analysis of the dynamics of small mobile helium clusters in tungsten, near tungsten surfaces. These helium clusters are attracted to tungsten surfaces due to an elastic interaction force that drives surface segregation. As the clusters migrate toward the surface, trap mutation and cluster dissociation are activated at rates higher than in the bulk. These kinetic processes are responsible for important structural, morphological, and compositional features in plasma-exposed tungsten, including surface adatoms, near-surface immobile helium-vacancy complexes, and retained helium content. Detailed results are presented for di-helium and tri-helium clusters near low-Miller-index tungsten surfaces.

  3. Structure and dynamics of fluorinated alkanes on silicon dioxide surfaces

    NASA Astrophysics Data System (ADS)

    Tsige, Mesfin

    2007-03-01

    Despite their great promise in various applications, the structure and dynamics of fluorinated alkanes at interfaces is still an open question. In particular, the knowledge from both theoretical and experimental perspectives is very limited when it comes to understanding the interface between these systems and a solid substrate. Molecular dynamics simulations based on the All Atom OPLS model are used to predict the equilibrium structure and dynamics of short fluorinated alkanes on both amorphous and crystalline silicon dioxide surfaces. In order to understand the effect of layer-layer interaction on the ordering of chains in a given layer, the thickness of the liquid film is increased layer-by-layer from monolayer to multilayers. Results for structural and dynamics of the liquid films near the silicon dioxide surfaces will be presented.

  4. Dynamic forces between bubbles and surfaces and hydrodynamic boundary conditions.

    PubMed

    Manor, Ofer; Vakarelski, Ivan U; Stevens, Geoffrey W; Grieser, Franz; Dagastine, Raymond R; Chan, Derek Y C

    2008-10-21

    A bubble attached to the end of an atomic force microscope cantilever and driven toward or away from a flat mica surface across an aqueous film is used to characterize the dynamic force that arises from hydrodynamic drainage and electrical double layer interactions across the nanometer thick intervening aqueous film. The hydrodynamic response of the air/water interface can range from a classical fully immobile, no-slip surface in the presence of added surfactants to a partially mobile interface in an electrolyte solution without added surfactants. A model that includes the convection and diffusion of trace surface contaminants can account for the observed behavior presented. This model predicts quantitatively different interfacial dynamics to the Navier slip model that can also be used to fit dynamic force data with a post hoc choice of a slip length.

  5. Molecular dynamics studies of interfacial water at the alumina surface.

    SciTech Connect

    Argyris, Dr. Dimitrios; Ho, Thomas; Cole, David

    2011-01-01

    Interfacial water properties at the alumina surface were investigated via all-atom equilibrium molecular dynamics simulations at ambient temperature. Al-terminated and OH-terminated alumina surfaces were considered to assess the structural and dynamic behavior of the first few hydration layers in contact with the substrates. Density profiles suggest water layering up to {approx}10 {angstrom} from the solid substrate. Planar density distribution data indicate that water molecules in the first interfacial layer are organized in well-defined patterns dictated by the atomic terminations of the alumina surface. Interfacial water exhibits preferential orientation and delayed dynamics compared to bulk water. Water exhibits bulk-like behavior at distances greater than {approx}10 {angstrom} from the substrate. The formation of an extended hydrogen bond network within the first few hydration layers illustrates the significance of water?water interactions on the structural properties at the interface.

  6. Structural and dynamical properties of water on chemically modified surfaces: The role of the instantaneous surface

    NASA Astrophysics Data System (ADS)

    Bekele, Selemon; Tsige, Mesfin

    Surfaces of polymers such as atactic polystyrene (aPS) represent very good model systems for amorphous material surfaces. Such polymer surfaces are usually modified either chemically or physically for a wide range of applications that include friction, lubrication and adhesion. It is thus quite important to understand the structural and dynamical properties of liquids that come in contact with them to achieve the desired functional properties. Using molecular dynamics (MD) simulations, we investigate the structural and dynamical properties of water molecules in a slab of water in contact with atactic polystyrene surfaces of varying polarity. We find that the density of water molecules and the number distribution of hydrogen bonds as a function of distance relative to an instantaneous surface exhibit a structure indicative of a layering of water molecules near the water/PS interface. For the dynamics, we use time correlation functions of hydrogen bonds and the incoherent structure function for the water molecules. Our results indicate that the polarity of the surface dramatically affects the dynamics of the interfacial water molecules with the dynamics slowing down with increasing polarity. This work was supported by NSF Grant DMR1410290.

  7. Optimization of culture medium for novel cell-associated tannase production from Bacillus massiliensis using response surface methodology.

    PubMed

    Belur, Prasanna D; Goud, Rakesh; Goudar, Dinesh C

    2012-02-01

    Naturally immobilized tannase (tannin acyl hydrolase, E.C. 3.1.1.20) has many advantages, as it avoids the expensive and laborious operation of isolation, purification, and immobilization, plus it is highly stable in adverse pH and temperature. However, in the case of cell-associated enzymes, since the enzyme is associated with the biomass, separation of the pure biomass is necessary. However, tannic acid, a known inducer of tannase, forms insoluble complexes with media proteins, making it difficult to separate pure biomass. Therefore, this study optimizes the production of cell-associated tannase using a "protein-tannin complex" free media. An exploratory study was first conducted in shake-flasks to select the inducer, carbon source, and nitrogen sources. As a result it was found that gallic acid induces tannase synthesis, a tryptose broth gives higher biomass, and lactose supplementation is beneficial. The medium was then optimized using response surface methodology based on the full factorial central composite design in a 3 l bioreactor. A 2(3) factorial design augmented by 7 axial points (alpha = 1.682) and 2 replicates at the center point was implemented in 17 experiments. A mathematical model was also developed to show the effect of each medium component and their interactions on the production of cell-associated tannase. The validity of the proposed model was verified, and the optimized medium was shown to produce maximum cell-associated tannase activity of 9.65 U/l, which is 93.8% higher than the activity in the basal medium, after 12 h at pH 5.0, 30 degrees C. The optimum medium consists of 38 g/l lactose, 50 g/l tryptose, and 2.8 g/l gallic acid.

  8. Towards a Dynamic Conceptual Framework for English-Medium Education in Multilingual University Settings

    ERIC Educational Resources Information Center

    Dafouz, Emma; Smit, Ute

    2016-01-01

    At a time of increasing internationalization in tertiary education, English-Medium Education in Multilingual University Settings (EMEMUS) has become a common practice. While there is already ample research describing this phenomenon at a local level (Smit and Dafouz 2012a), the theoretical side needs to be elaborated. This article thus aims to…

  9. Origins of Irish-Medium Education: The Dynamic Core of Language Revitalisation in Northern Ireland

    ERIC Educational Resources Information Center

    O Baoill, Donall P.

    2007-01-01

    The establishment and growth of Irish-medium education has been central to the revitalisation of the language in Northern Ireland in recent years. Historically, the struggle by the minority of Irish speakers in the region to provide all-Irish schools has been both the goal and the engine of renewal and expansion during a period of community and…

  10. Towards a Dynamic Conceptual Framework for English-Medium Education in Multilingual University Settings

    ERIC Educational Resources Information Center

    Dafouz, Emma; Smit, Ute

    2016-01-01

    At a time of increasing internationalization in tertiary education, English-Medium Education in Multilingual University Settings (EMEMUS) has become a common practice. While there is already ample research describing this phenomenon at a local level (Smit and Dafouz 2012a), the theoretical side needs to be elaborated. This article thus aims to…

  11. Ultrafast exciton dynamics at molecular surfaces

    NASA Astrophysics Data System (ADS)

    Monahan, Nicholas R.

    Further improvements to device performance are necessary to make solar energy conversion a compelling alternative to fossil fuels. Singlet exciton fission and charge separation are two processes that can heavily influence the power conversion efficiency of a solar cell. During exciton fission one singlet excitation converts into two triplet excitons, potentially doubling the photocurrent generated by higher energy photons. There is significant discord over the singlet fission mechanism and of particular interest is whether the process involves a multiexciton intermediate state. I used time-resolved two-photon photoemission to investigate singlet fission in hexacene thin films, a model system with strong electronic coupling. My results indicate that a multiexciton state forms within 40 fs of photoexcitation and loses singlet character on a 280 fs timescale, creating two triplet excitons. This is concordant with the transient absorption spectra of hexacene single crystals and definitively proves that exciton fission in hexacene proceeds through a multiexciton state. This state is likely common to all strongly-coupled systems and my results suggest that a reassessment of the generally-accepted singlet fission mechanism is required. Charge separation is the process of splitting neutral excitons into carriers that occurs at donor-acceptor heterojunctions in organic solar cells. Although this process is essential for device functionality, there are few compelling explanations for why it is highly efficient in certain organic photovoltaic systems. To investigate the charge separation process, I used the model system of charge transfer excitons at hexacene surfaces and time-resolved two-photon photoemission. Charge transfer excitons with sufficient energy spontaneously delocalize, growing from about 14 nm to over 50 nm within 200 fs. Entropy drives this delocalization, as the density of states within the Coulomb potential increases significantly with energy. This charge

  12. Geostrophic dynamics at surfaces in the atmosphere and ocean

    NASA Astrophysics Data System (ADS)

    Tulloch, Ross

    Observed dynamics near bounding upper surfaces in the atmosphere and ocean are interpreted in terms of quasi-geostrophic theory. The quasi-geostrophic equations consist of advection of linearized potential vorticity coupled with advection of temperature at the upper and lower bounding surfaces. We show that the standard vertical finite difference formulation of 3D quasi-geostrophic flow accurately represents the flow only down to a critical horizontal scale that decreases with vertical grid spacing. To overcome this constraint, we derive a surface-modal formulation which accurately and efficiently captures both the surface dynamics due to temperature anomalies on the upper and lower boundaries, and the interior dynamics due to potential vorticity anomalies, without the need for high vertical resolution. In the atmosphere, the horizontal wavenumber spectra of wind and temperature near the tropopause have a steep -3 slope at synoptic scales and a shallow -5/3 slope at mesoscales, with a smooth transition between the two regimes from 800km to 200km. We demonstrate that when the surface temperature anomalies are resolved, quasi-geostrophic flow driven by baroclinic instability exhibits such a transition near the tropopause. The horizontal scale of transition between -3 and -5/3 slopes depends on the relative magnitudes of the mean surface temperature gradient and the mean potential vorticity gradient. In the ocean, sea surface height anomalies measured by satellite altimetry exhibit shallower spectral slopes than quasi-geostrophic theory predicts, and faster than expected westward phase propagation of sea surface height in the midlatitudes. We argue that, in some regions, the shallow spectral slopes are due to surface quasi-geostrophic dynamics, and that the westward phase propagation in the midlatitudes is indicative of a transition from a linear Rossby wave regime in the tropics to a nonlinear turbulent regime in the midlatitudes.

  13. Synergistic using medium-resolution and high-resolution remote sensing imagery to extract impervious surface for Dianci Basin

    NASA Astrophysics Data System (ADS)

    Hong, Liang; Yang, Kun; Deng, Ming; Liu, Cun

    2014-03-01

    The knowledge of impervious surfaces, especially the magnitude, location, geometry, spatial pattern of impervious surfaces, is significant to urban ecosystem studies, including urban hydrology, urban climate, land use planning and resource management.Impervious surface area (ISA) is considered a key indicator of environmental quality and can be used to address complex urban environmental issues, particularly those related to the health of urban watersheds. ISA is also an indicator of non-point source pollution or polluted runoff. Remote sensing offers a consistent framework for representing spatial patterns and rates of urbanization over time through accurate observations of impervious surface area. Most of the existing methods of extracting impervious surface based on remote sensing concentrate on an urban scale, but the rapid and accurate methods of extracting impervious surfaces in a basin scale are nearly nonexistent in China and abroad. In recent years,with the rapid urbanization especially surrounding the Dianchi water body, the impervious surface coverage rate also grows rapidly and results in severe degradation of basin water environment within Dianchi watershed. In this study, we developed an approach to extract impervious surface for Dianci Basin by synergistic using medium-resolution and high-resolution remote sensing imagery. Subpixel percent impervious surfaces at Thematic Mapper (TM) images were mapped using the classification and regression tree(CART) algorithm. Sub-pixel impervious surfaces at 30m resolution were mapped in this study area through regression tree models. The estimated ISA results were evaluated through independent ISA reference data derived from high resolution QuickBird. The results prove the suitability of the approach for a widely automated and mapping of impervious surfaces in a basin scale.

  14. Ionization dynamics of water dimer on ice surface

    NASA Astrophysics Data System (ADS)

    Tachikawa, Hiroto

    2016-05-01

    The solid surface provides an effective two-dimensional reaction field because the surface increases the encounter probability of bi-molecular collision reactions. Also, the solid surface stabilizes a reaction intermediate because the excess energy generated by the reaction dissipates into the bath modes of surface. The ice surface in the universe is one of the two dimensional reaction fields. However, it is still unknown how the ice surface affects to the reaction mechanism. In the present study, to elucidate the specific property of the ice surface reaction, ionization dynamics of water dimer adsorbed on the ice surface was theoretically investigated by means of direct ab-initio molecular dynamics (AIMD) method combined with ONIOM (our own n-layered integrated molecular orbital and molecular mechanics) technique, and the result was compared with that of gas phase reaction. It was found that a proton is transferred from H2O+ to H2O within the dimer and the intermediate complex H3O+(OH) is formed in both cases. However, the dynamic features were different from each other. The reaction rate of the proton transfer on the ice surface was three times faster than that in the gas phase. The intermediate complex H3O+(OH) was easily dissociated to H3O+ and OH radical on the ice surface, and the lifetime of the complex was significantly shorter than that of gas phase (100 fs vs. infinite). The reason why the ice surface accelerates the reaction was discussed in the present study.

  15. Novel Schiff-base molecules as efficient corrosion inhibitors for mild steel surface in 1 M HCl medium: experimental and theoretical approach.

    PubMed

    Saha, Sourav Kr; Dutta, Alokdut; Ghosh, Pritam; Sukul, Dipankar; Banerjee, Priyabrata

    2016-07-21

    In order to evaluate the effect of the functional group present in the ligand backbone towards corrosion inhibition performances, three Schiff-base molecules namely, (E)-4-((2-(2,4-dinitrophenyl)hydrazono)methyl)pyridine (L(1)), (E)-4-(2-(pyridin-4-ylmethylene)hydrazinyl)benzonitrile (L(2)) and (E)-4-((2-(2,4-dinitrophenyl)hydrazono)methyl)phenol (L(3)) were synthesized and used as corrosion inhibitors on mild steel in 1 M HCl medium. The corrosion inhibition effectiveness of the studied inhibitors was investigated by weight loss and several sophisticated analytical tools such as potentiodynamic polarization and electrochemical impedance spectroscopy measurements. Experimentally obtained results revealed that corrosion inhibition efficiencies followed the sequence: L(3) > L(1) > L(2). Electrochemical findings showed that inhibitors impart high resistance towards charge transfer across the metal-electrolyte interface and behaved as mixed type inhibitors. Scanning electron microscopy (SEM) was also employed to examine the protective film formed on the mild steel surface. The adsorption as well as inhibition ability of the inhibitor molecules on the mild steel surface was investigated by quantum chemical calculation and molecular dynamic (MD) simulation. In quantum chemical calculations, geometry optimized structures of the Schiff-base inhibitors, electron density distribution in HOMO and LUMO and Fukui indices of each atom were employed for their possible mode of interaction with the mild steel surfaces. MD simulations revealed that all the inhibitors molecules adsorbed in parallel orientation with respect to the Fe(110) surface.

  16. Measurement of dynamic surface tension by mechanically vibrated sessile droplets.

    PubMed

    Iwata, Shuichi; Yamauchi, Satoko; Yoshitake, Yumiko; Nagumo, Ryo; Mori, Hideki; Kajiya, Tadashi

    2016-04-01

    We developed a novel method for measuring the dynamic surface tension of liquids using mechanically vibrated sessile droplets. Under continuous mechanical vibration, the shape of the deformed droplet was fitted by numerical analysis, taking into account the force balance at the drop surface and the momentum equation. The surface tension was determined by optimizing four parameters: the surface tension, the droplet's height, the radius of the droplet-substrate contact area, and the horizontal symmetrical position of the droplet. The accuracy and repeatability of the proposed method were confirmed using drops of distilled water as well as viscous aqueous glycerol solutions. The vibration frequency had no influence on surface tension in the case of pure liquids. However, for water-soluble surfactant solutions, the dynamic surface tension gradually increased with vibration frequency, which was particularly notable for low surfactant concentrations slightly below the critical micelle concentration. This frequency dependence resulted from the competition of two mechanisms at the drop surface: local surface deformation and surfactant transport towards the newly generated surface.

  17. Measurement of dynamic surface tension by mechanically vibrated sessile droplets

    NASA Astrophysics Data System (ADS)

    Iwata, Shuichi; Yamauchi, Satoko; Yoshitake, Yumiko; Nagumo, Ryo; Mori, Hideki; Kajiya, Tadashi

    2016-04-01

    We developed a novel method for measuring the dynamic surface tension of liquids using mechanically vibrated sessile droplets. Under continuous mechanical vibration, the shape of the deformed droplet was fitted by numerical analysis, taking into account the force balance at the drop surface and the momentum equation. The surface tension was determined by optimizing four parameters: the surface tension, the droplet's height, the radius of the droplet-substrate contact area, and the horizontal symmetrical position of the droplet. The accuracy and repeatability of the proposed method were confirmed using drops of distilled water as well as viscous aqueous glycerol solutions. The vibration frequency had no influence on surface tension in the case of pure liquids. However, for water-soluble surfactant solutions, the dynamic surface tension gradually increased with vibration frequency, which was particularly notable for low surfactant concentrations slightly below the critical micelle concentration. This frequency dependence resulted from the competition of two mechanisms at the drop surface: local surface deformation and surfactant transport towards the newly generated surface.

  18. Medium-energy backscattered electron diffraction studies of TiO 2(110): relation to surface structure

    NASA Astrophysics Data System (ADS)

    Maschhoff, Brian L.; Pan, Jian-Mei; Madey, Theodore E.

    1991-12-01

    Medium-energy backscattered electron diffraction (MEED) studies are reported for the rutile TiO 2(110) surface. Two-dimensional diffraction images are obtained using a retarding field analyzer with a microchannel plate-intensified detector. Background removal is accomplished using digital image processing techniques. We find that the backscattered pattern for 750 eV incident electrons is predominantly due to diffraction of the outgoing electrons (subsequent to backscattering from subsurface atoms) by overlying lattice atoms. We also find effects related to the orientation of the incident beam relative to the surface. These effects are ascribed to diffraction of the incoming electrons (prior to backscattering) and possibly the focusing of electron intensity on second-layer atoms. Single-scattering cluster (SSC) calculations are used to model the outgoing diffraction process. The results are qualitatively consistent with a bulk-like termination of the TiO 2(110) surface.

  19. Bayesian inversion analysis of nonlinear dynamics in surface heterogeneous reactions

    NASA Astrophysics Data System (ADS)

    Omori, Toshiaki; Kuwatani, Tatsu; Okamoto, Atsushi; Hukushima, Koji

    2016-09-01

    It is essential to extract nonlinear dynamics from time-series data as an inverse problem in natural sciences. We propose a Bayesian statistical framework for extracting nonlinear dynamics of surface heterogeneous reactions from sparse and noisy observable data. Surface heterogeneous reactions are chemical reactions with conjugation of multiple phases, and they have the intrinsic nonlinearity of their dynamics caused by the effect of surface-area between different phases. We adapt a belief propagation method and an expectation-maximization (EM) algorithm to partial observation problem, in order to simultaneously estimate the time course of hidden variables and the kinetic parameters underlying dynamics. The proposed belief propagation method is performed by using sequential Monte Carlo algorithm in order to estimate nonlinear dynamical system. Using our proposed method, we show that the rate constants of dissolution and precipitation reactions, which are typical examples of surface heterogeneous reactions, as well as the temporal changes of solid reactants and products, were successfully estimated only from the observable temporal changes in the concentration of the dissolved intermediate product.

  20. AschFlow - A dynamic landslide run-out model for medium scale hazard analysis.

    NASA Astrophysics Data System (ADS)

    Luna, Byron Quan; Blahut, Jan; van Asch, Theo; van Westen, Cees; Kappes, Melanie

    2015-04-01

    Landslides and debris flow hazard assessments require a scale-dependent analysis in order to mitigate damage and other negative consequences at the respective scales of occurrence. Medium or large scale landslide run-out modelling for many possible landslide initiation areas has been a cumbersome task in the past. This arises from the difficulty to precisely define the location and volume of the released mass and from the inability of the run-out models to compute the displacement with a large amount of individual initiation areas (computational exhaustive). Most of the existing physically based run-out models have complications in handling such situations and therefore empirical methods have been used as a practical mean to predict landslides mobility at a medium scale (1:10,000 to 1:50,000). In this context, a simple medium scale numerical model for rapid mass movements in urban and mountainous areas was developed. The deterministic nature of the approach makes it possible to calculate the velocity, height and increase in mass by erosion, resulting in the estimation of various forms of impacts exerted by debris flows at the medium scale The established and implemented model ("AschFlow") is a 2-D one-phase continuum model that simulates, the entrainment, spreading and deposition process of a landslide or debris flow at a medium scale. The flow is thus treated as a single phase material, whose behavior is controlled by rheology (e.g. Voellmy or Bingham). The developed regional model "AschFlow" was applied and evaluated in well documented areas with known past debris flow events.

  1. Volume radiation generated by a medium-IR SEW propagating on a smooth metal surface

    SciTech Connect

    Libenson, M.N.; Makin, V.S.; Trubaev, V.V.

    1995-03-01

    The volume wave radiating from a smooth surface region that guides an SEW is shown to be a grazing wave; in earlier experiments, this wave was detected at relatively large angles with respect to the surface. 4 refs., 2 figs., 1 tab.

  2. Dynamic Topography at Earth's Surface: Fact or Fiction? (Invited)

    NASA Astrophysics Data System (ADS)

    Lithgow-Bertelloni, C. R.; Silver, P. G.

    2009-12-01

    Contributions to Earth’s surface topography range from short-wavelength uncompensated features due to tectonic activity, to variations in crustal structure and long-wavelength deflections of the lithosphere caused by mantle dynamics. The latter we call dynamic topography. Dynamic topography elevates or depresses the surface even if the density anomaly giving rise to flow is deep in the mantle. Dynamic topography is also a major contributor to Earth’s gravitational potential and to surface deformation. However, direct observations of dynamic topography are elusive, because signals are obscured by the isostatic contribution due to crustal and lithospheric structure. The only seemingly unequivocal signals of dynamically supported topography have been found over mantle upwellings on both continents (Africa [Lithgow-Bertelloni and Silver, 1998] and Arabia [Daradich et al., 2004]) and oceanic basins (North-Atlantic [Conrad et al., 2004]). Recent work on Africa’s geomorphic history [Moore et al., 2009] and North Atlantic gravity and topography have called even these results into questions. In downwelling regions (near slabs) no clear signals have been found. I will explore why this dichotomy may exist and relate it to the need for dynamic topography in mantle flow models, with an eye towards the effects of phase transitions, lateral variations in viscosity and layered convection. I will also present recent results on dynamic topography over flat slab segments that overturn the conventional wisdom and explain basin topography in the Andean foreland. Along with the new models I will discuss a recent global lithospheric structure model with which to compute the residual topography, i.e. the “observed” dynamic topography.

  3. Investigation of drop dynamic contact angle on copper surface

    NASA Astrophysics Data System (ADS)

    Orlova, Evgenija; Feoktistov, Dmitriy; Kuznetsov, Geniy

    2015-01-01

    This paper presents experimental results of the studying the effect of surface roughness, microstructure and flow rate on the dynamic contact angle at spreading of distilled non deaerate water drop on a solid horizontal substrates. Copper substrates with different roughness have been investigated. For each substrate static contact angles depending on volume flow rate have been obtained using shadow system. Increasing the volume flow rate resulted in an increase of the static contact angle. It was found that with increasing surface roughness dynamic contact angle arises. Also difference in formation of the equilibrium contact angle at low and high rates of drop growth has been detected.

  4. Monitoring Earth Surface Dynamics With Optical Imagery

    NASA Astrophysics Data System (ADS)

    Leprince, S.; Berthier, E.; Ayoub, F.; Delacourt, C.; Avouac, J.

    2007-12-01

    Optical images can be used to measure accurately a variety of Earth surface processes such as co-seismic ground deformation, ice-flow, landsliding and sand-dunes migration. Although the technique of correlating multi- temporal images is not new, it is not widely used yet due to technical limitations - mainly geometric distortion of the images induced by the imaging system, biased correlation techniques, and implementation difficulties. Most of these obstacles were overcome by recent methodological advances implemented in a user-friendly software package, COSI-Corr, which allows for automatic and precise ortho-rectification, co-registration, and subpixel correlation of pushbroom satellite and aerial images. The procedure does not require external information such as GPS measurements of ground control points, and is solely based on the knowledge of the topography and on the ancillary data provided with the observing platform. In particular, we take advantage of the availability of accurate digital elevation models with global coverage (SRTM). Sub-pixel change detection, i.e. correlation, is then applied on the set of ortho-images produced. COSI-Corr makes it possible to measure local displacements between temporal series of images, possibly acquired by different instruments and at different resolutions, with accuracy of the measurements on the order of a small fraction of the nominal images' resolution. We apply this methodology to the measurement of the horizontal coseismic displacement field induced by the Mw 7.1 1999 Hector Mine earthquake, California, using a 10-m SPOT 4 pre-earthquake image and a 15-m ASTER post-earthquake image. We illustrate the potential of this approach to measure glacier flow, and present the horizontal displacements in the Mer de Glace area (Alps), over 26 days derived from SPOT 5 images. Landsliding is also investigated on the La Valette landslide (southern French Alps), and we present a dense measurement of the cumulative horizontal

  5. Some aspects of two-phase flow, heat transfer and dynamic instabilities in medium and high pressure steam generators

    NASA Astrophysics Data System (ADS)

    Unal, H. C.

    1981-03-01

    Experimental data for void fraction, incipient point of boiling, initial point of net vapor generation, bubble dynamics, dryout, two-phase flow pressure drop and density-wave oscillations were obtained in long, sodium heated steam generator tubes of different geometries for a wide range of operating conditions and at medium and high pressures. These data and data from literature taken in sodium and electrically heated steam generator tubes were correlated. Aspects of two-phase flow, heat transfer and density-wave oscillations in these steam generators disclosed include the distribution factor in small- and medium-size diameter steam generator tubes, the characteristic of the transitions at the incipient point of boiling and initial point of net vapor generation, bubble growth during subcooled nucleate flow boiling, the importance of the equivalent length for dryout in non-uniformly heated steam generator tubes and the mechanisms of density-wave oscillations in once-through steam generator tubes.

  6. Dynamical medium depletion in high-order above-threshold ionization with few-cycle laser pulses

    SciTech Connect

    Altucci, C.; Velotta, R.; Tosa, V.; Nam, C.H.

    2004-12-01

    The influence of dynamical medium depletion in high-order above-threshold ionization (ATI) in left/right asymmetry of photoelectron energy spectra is analyzed. Based on a classical analysis of high-order ATI electrons produced by few-cycle laser pulses, calculated asymmetry maps of electron spectra reproduce very well the experimental results reported in Lindner et al. [Phys. Rev. Lett. 92, 113001 (2004)], utilized for determining the Guoy phase shift of few-cycle laser pulses. The anomalous behavior of the high-energy part of the ATI electron spectra is, then, fully understood in terms of earlier medium depletion occurring in the leading edge of the laser pulse. In order to correctly reproduce the experimental findings a physical temporal envelope of the laser pulse, which only vanishes at the infinity, plays a crucial role.

  7. Potential energy surfaces and reaction dynamics of polyatomic molecules

    SciTech Connect

    Chang, Yan-Tyng

    1991-11-01

    A simple empirical valence bond (EVB) model approach is suggested for constructing global potential energy surfaces for reactions of polyatomic molecular systems. This approach produces smooth and continuous potential surfaces which can be directly utilized in a dynamical study. Two types of reactions are of special interest, the unimolecular dissociation and the unimolecular isomerization. For the first type, the molecular dissociation dynamics of formaldehyde on the ground electronic surface is investigated through classical trajectory calculations on EVB surfaces. The product state distributions and vector correlations obtained from this study suggest very similar behaviors seen in the experiments. The intramolecular hydrogen atom transfer in the formic acid dimer is an example of the isomerization reaction. High level ab initio quantum chemistry calculations are performed to obtain optimized equilibrium and transition state dimer geometries and also the harmonic frequencies.

  8. The role of dynamic surface tension in cloud droplet activation

    NASA Astrophysics Data System (ADS)

    Petters, Markus D.; Suda, Sarah R.; Christensen, Sara I.

    2013-05-01

    We present new data on the cloud droplet forming abilities of two-component particles that contain the surfactant sodium dodecyl sulfate and sodium chloride or ammonium sulfate. The experiments were designed to test specific predictions made by Kohler theory that accounts for the reduction of surface tension and the partitioning of the surfactant between the interior and the surface of the droplet. We also introduced a pre-humidification step followed by a six minute time delay to test whether dynamic surface tension may lead to kinetic limitations on the partitioning process. Our results confirm previous studies that show that surfactants do not enhance cloud droplet activation relative to what would be predicted from water activity alone. The data obtained with and without time delay were indistinguishable within measurement uncertainty, suggesting that dynamic surface tension does not need to be considered in Kohler theory.

  9. Surface water connectivity dynamics of a large scale extreme flood

    NASA Astrophysics Data System (ADS)

    Trigg, Mark A.; Michaelides, Katerina; Neal, Jeffrey C.; Bates, Paul D.

    2013-11-01

    Uses the MODIS surface water product observations of the 2011 Bangkok flood.A data gap filling method is developed to better preserve the dynamics of the event.We quantify surface water connectivity geostatistically to give new flood insights.There is a clear structure to the connectivity of the event through time and space.Changes and thresholds in the connectivity are linked to major flood mechanisms.

  10. Laser scanning dynamic measurement of the curved surface

    NASA Astrophysics Data System (ADS)

    Hong, Xin; Zheng, Wenxue

    1996-10-01

    A new measurement of the curved surface has been developed. The paper provides an effective, real time and dynamic optical measurement which is suitable for the measurement of airfoil, turbine blade, car and tank's curved surface. The system consists of a laser probe, a charge couple device (CCD), a computer, three servomotors. Consideration is also given to the design of the laser probe and CCD driving circuit.

  11. Structure, biomimetics, and fluid dynamics of fish skin surfaces*

    NASA Astrophysics Data System (ADS)

    Lauder, George V.; Wainwright, Dylan K.; Domel, August G.; Weaver, James C.; Wen, Li; Bertoldi, Katia

    2016-10-01

    The interface between the fluid environment and the surface of the body in swimming fishes is critical for both physiological and hydrodynamic functions. The skin surface in most species of fishes is covered with bony scales or toothlike denticles (in sharks). Despite the apparent importance of fish surfaces for understanding aquatic locomotion and near-surface boundary layer flows, relatively little attention has been paid to either the nature of surface textures in fishes or possible hydrodynamic effects of variation in roughness around the body surface within an individual and among species. Fish surfaces are remarkably diverse and in many bony fishes scales can have an intricate surface texture with projections, ridges, and comblike extensions. Shark denticles (or scales) are toothlike and project out of the skin to form a complexly textured surface that interacts with free-stream flow. Manufacturing biomimetic foils with fishlike surfaces allows hydrodynamic testing and we emphasize here the importance of dynamic test conditions where the effect of surface textures is assessed under conditions of self-propulsion. We show that simple two-dimensional foils with patterned cuts do not perform as well as a smooth control surface, but that biomimetic shark skin foils can swim at higher self-propelled speeds than smooth controls. When the arrangement of denticles on the foil surface is altered, we find that a staggered-overlapped pattern outperforms other arrangements. Flexible foils made of real shark skin outperform sanded controls when foils are moved with a biologically realistic motion program. We suggest that focus on the mechanisms of drag reduction by fish surfaces has been too limiting and an additional role of fish surface textures may be to alter leading edge vortices and flow patterns on moving surfaces in a way that enhances thrust. Analysis of water flow over an artificial shark skin foil under both static and dynamic conditions shows that a shear layer

  12. Sub-nanometer glass surface dynamics induced by illumination.

    PubMed

    Nguyen, Duc; Nienhaus, Lea; Haasch, Richard T; Lyding, Joseph; Gruebele, Martin

    2015-06-21

    Illumination is known to induce stress and morphology changes in opaque glasses. Amorphous silicon carbide (a-SiC) has a smaller bandgap than the crystal. Thus, we were able to excite with 532 nm light a 1 μm amorphous surface layer on a SiC crystal while recording time-lapse movies of glass surface dynamics by scanning tunneling microscopy (STM). Photoexcitation of the a-SiC surface layer through the transparent crystal avoids heating the STM tip. Up to 6 × 10(4) s, long movies of surface dynamics with 40 s time resolution and sub-nanometer spatial resolution were obtained. Clusters of ca. 3-5 glass forming units diameter are seen to cooperatively hop between two states at the surface. Photoexcitation with green laser light recruits immobile clusters to hop, rather than increasing the rate at which already mobile clusters hop. No significant laser heating was observed. Thus, we favor an athermal mechanism whereby electronic excitation of a-SiC directly controls glassy surface dynamics. This mechanism is supported by an exciton migration-relaxation-thermal diffusion model. Individual clusters take ∼1 h to populate states differently after the light intensity has changed. We believe the surrounding matrix rearranges slowly when it is stressed by a change in laser intensity, and clusters serve as a diagnostic. Such cluster hopping and matrix rearrangement could underlie the microscopic mechanism of photoinduced aging of opaque glasses.

  13. Sub-nanometer glass surface dynamics induced by illumination

    SciTech Connect

    Nguyen, Duc; Nienhaus, Lea; Haasch, Richard T.; Lyding, Joseph; Gruebele, Martin

    2015-06-21

    Illumination is known to induce stress and morphology changes in opaque glasses. Amorphous silicon carbide (a-SiC) has a smaller bandgap than the crystal. Thus, we were able to excite with 532 nm light a 1 μm amorphous surface layer on a SiC crystal while recording time-lapse movies of glass surface dynamics by scanning tunneling microscopy (STM). Photoexcitation of the a-SiC surface layer through the transparent crystal avoids heating the STM tip. Up to 6 × 10{sup 4} s, long movies of surface dynamics with 40 s time resolution and sub-nanometer spatial resolution were obtained. Clusters of ca. 3-5 glass forming units diameter are seen to cooperatively hop between two states at the surface. Photoexcitation with green laser light recruits immobile clusters to hop, rather than increasing the rate at which already mobile clusters hop. No significant laser heating was observed. Thus, we favor an athermal mechanism whereby electronic excitation of a-SiC directly controls glassy surface dynamics. This mechanism is supported by an exciton migration-relaxation-thermal diffusion model. Individual clusters take ∼1 h to populate states differently after the light intensity has changed. We believe the surrounding matrix rearranges slowly when it is stressed by a change in laser intensity, and clusters serve as a diagnostic. Such cluster hopping and matrix rearrangement could underlie the microscopic mechanism of photoinduced aging of opaque glasses.

  14. Testing in-medium πN dynamics on pionic atoms

    NASA Astrophysics Data System (ADS)

    Friedman, E.; Gal, A.

    2014-08-01

    A general algorithm for handling the energy dependence of meson-nucleon amplitudes in the nuclear medium has been recently applied to antikaons and to eta mesons. Here we test this approach on πN amplitudes in pionic atoms where direct comparison can be made with ample experimental results. Applying this algorithm to a large-scale fit of 100 pionic-atom data points across the periodic table, which also include the ‘deeply-bound' states in Sn and Pb, reaffirms earlier conclusions on the density-dependent renormalization of the πN threshold isovector amplitude b1, or equivalently the renormalization of the pion decay constant fπ in the nuclear medium.

  15. Interaction of H2 with simple metal surfaces - A model based on the anisotropic effective medium theory

    NASA Technical Reports Server (NTRS)

    Karimi, M.; Ila, D.; Dalins, I.; Vidali, G.

    1990-01-01

    Calculations are presented for the interaction of H2 with surfaces of Cu, Ag, Au and Al. The repulsive part of the potential is evaluated using the results of anisotropic effective medium theory (AEMT) while the attractive part is calculated from anisotropic damped dipole-dipole and damped dipole-quadrupole interactions. The model does not have any fitting parameters and its predictions are in excellent agreement with the available experimental data. The anisotropy of H2 is included in the model but our results show that this effect is very small.

  16. Interaction of H 2 with simple metal surfaces: a model based on the anisotropic effective medium theory

    NASA Astrophysics Data System (ADS)

    Karimi, M.; Ila, D.; Dalins, I.; Vidali, G.

    1990-12-01

    Calculations are presented for the interaction of H 2 with surfaces of Cu, Ag, Au and Al. The repulsive part of the potential is evaluated using the results of anisotropic effective medium theory (AEMT) while the attractive part is calculated from anisotropic damped dipole-dipole and damped dipole-quadrupole interactions. The model does not have any fitting parameters and its predictions are in excellent agreement with the available experimental data. The anisotropy of H 2 is included in the model but our results show that this effect is very small.

  17. Fighting in the Medium of Time: The Dynamics of Operational Tempo

    DTIC Science & Technology

    1988-04-11

    save time. Today, with the value of time more 32 critical than ever, it would be prudent for us to assume that the Soviets would prefer to do the same...level and in technology. Implicit in the approach is an overriding concern for the value of time . Time is the medium that will be contested. It...Operationally, this priority manifests itself in the almost phobic Soviet stress on high rates of advance. Strategically, the value of time is equally

  18. Molecular Dynamics Simulations of Surface Processes: Oxygen Recombination on Silica Surfaces at High Temperature

    DTIC Science & Technology

    2007-07-01

    size-scalable cluster approach with SixOy clusters of increasing size cleaved from the β- cristobalite unit cell. In this study the hybrid Hartree...values of the β- cristobalite cell and extending the Molecular Dynamics Simulations of Surface Processes: Oxygen Recombination on Silica Surfaces at... cristobalite surface is reported as a function of the distance of the N atom from the Si active atom. The dashed line shows the interaction

  19. Reaction dynamics induced by the radioactive ion beam 7Be on medium-mass and heavy targets

    NASA Astrophysics Data System (ADS)

    Mazzocco, M.; Boiano, A.; Boiano, C.; La Commara, M.; Manea, C.; Parascandolo, C.; Pierroutsakou, D.; Stefanini, C.; Strano, E.; Torresi, D.; Acosta, L.; Di Meo, P.; Fernandez-Garcia, J. P.; Glodariu, T.; Grebosz, J.; Guglielmetti, A.; Keeley, N.; Lay, J. A.; Marquinez-Duran, G.; Martel, I.; Mazzocchi, C.; Molini, P.; Nicoletto, M.; Pakou, A.; Parkar, V. V.; Rusek, K.; Sánchez-Benítez, A. M.; Sandoli, M.; Sava, T.; Sgouros, O.; Signorini, C.; Silvestri, R.; Soramel, F.; Soukeras, V.; Stiliaris, E.; Stroe, L.; Toniolo, N.; Zerva, K.

    2015-10-01

    We studied the reaction dynamics induced at Coulomb barrier energies by the weakly-bound Radioactive Ion Beam 7Be (Sα = 1.586 MeV) on medium-mass (58Ni) and heavy (208Pb) targets. The experiments were performed at INFN-LNL (Italy), where a 2-3×105 pps 7Be secondary beam was produced with the RIB in-flight facility EXOTIC. Charged reaction products were detected by means of high-granularity silicon detectors in rather wide angular ranges. The contribution presents an up-to-date status of the data analysis and theoretical interpretation for both systems.

  20. Hydromagnetic Flow and Heat Transfer over a Porous Oscillating Stretching Surface in a Viscoelastic Fluid with Porous Medium

    PubMed Central

    Khan, Sami Ullah; Ali, Nasir; Abbas, Zaheer

    2015-01-01

    An analysis is carried out to study the heat transfer in unsteady two-dimensional boundary layer flow of a magnetohydrodynamics (MHD) second grade fluid over a porous oscillating stretching surface embedded in porous medium. The flow is induced due to infinite elastic sheet which is stretched periodically. With the help of dimensionless variables, the governing flow equations are reduced to a system of non-linear partial differential equations. This system has been solved numerically using the finite difference scheme, in which a coordinate transformation is used to transform the semi-infinite physical space to a bounded computational domain. The influence of the involved parameters on the flow, the temperature distribution, the skin-friction coefficient and the local Nusselt number is shown and discussed in detail. The study reveals that an oscillatory sheet embedded in a fluid-saturated porous medium generates oscillatory motion in the fluid. The amplitude and phase of oscillations depends on the rheology of the fluid as well as on the other parameters coming through imposed boundary conditions, inclusion of body force term and permeability of the porous medium. It is found that amplitude of flow velocity increases with increasing viscoelastic and mass suction/injection parameters. However, it decreases with increasing the strength of the applied magnetic field. Moreover, the temperature of fluid is a decreasing function of viscoelastic parameter, mass suction/injection parameter and Prandtl number. PMID:26657931

  1. Hydromagnetic Flow and Heat Transfer over a Porous Oscillating Stretching Surface in a Viscoelastic Fluid with Porous Medium.

    PubMed

    Khan, Sami Ullah; Ali, Nasir; Abbas, Zaheer

    2015-01-01

    An analysis is carried out to study the heat transfer in unsteady two-dimensional boundary layer flow of a magnetohydrodynamics (MHD) second grade fluid over a porous oscillating stretching surface embedded in porous medium. The flow is induced due to infinite elastic sheet which is stretched periodically. With the help of dimensionless variables, the governing flow equations are reduced to a system of non-linear partial differential equations. This system has been solved numerically using the finite difference scheme, in which a coordinate transformation is used to transform the semi-infinite physical space to a bounded computational domain. The influence of the involved parameters on the flow, the temperature distribution, the skin-friction coefficient and the local Nusselt number is shown and discussed in detail. The study reveals that an oscillatory sheet embedded in a fluid-saturated porous medium generates oscillatory motion in the fluid. The amplitude and phase of oscillations depends on the rheology of the fluid as well as on the other parameters coming through imposed boundary conditions, inclusion of body force term and permeability of the porous medium. It is found that amplitude of flow velocity increases with increasing viscoelastic and mass suction/injection parameters. However, it decreases with increasing the strength of the applied magnetic field. Moreover, the temperature of fluid is a decreasing function of viscoelastic parameter, mass suction/injection parameter and Prandtl number.

  2. Optimization of culture conditions to improve Helicobacter pylori growth in Ham's F-12 medium by response surface methodology.

    PubMed

    Bessa, L J; Correia, D M; Cellini, L; Azevedo, N F; Rocha, I

    2012-01-01

    Helicobacter pylori is a gastroduodenal pathogen that colonizes the human stomach and is the causal agent of gastric diseases. From the clinical and epidemiological point of view, enhancing and improving the growth of this bacterium in liquid media is an important goal to achieve in order to allow the performance of accurate physiological studies. The aim of this work was to optimize three culture conditions that influence the growth of H. pylori in the defined medium Ham s F-12 supplemented with 5 percent fetal bovine serum by using response surface methodology as a statistical technique to obtain the optimal conditions. The factors studied in this experimental design (Box-Behnken design) were the pH of the medium, the shaking speed (rpm) and the percentage of atmospheric oxygen, in a total of 17 experiments. The biomass specific growth rate was the response measured. The model was validated for pH and shaking speed. The percentage of atmospheric oxygen did not influence the growth for the range of values studied. At the optimal values found for pH and shaking speed, 8 and 130 rpm, respectively, a specific growth rate value of 0.164 h-1, corresponding to a maximal concentration of approximately 1.5x108 CFU/ml, was reached after 8 h. The experimental design strategy allowed, for the first time, the optimization of H. pylori growth in a semi-synthetic medium, which may be important to improve physiological and metabolic studies of this fastidious bacterium.

  3. Optimization of critical medium components using response surface methodology for biomass and extracellular polysaccharide production by Agaricus blazei.

    PubMed

    Liu, Gao-Qiang; Wang, Xiao-Ling

    2007-02-01

    Response surface methodology (RSM) was applied to optimize the critical medium ingredients of Agaricus blazei. A three-level Box-Behnken factorial design was employed to determine the maximum biomass and extracellular polysaccharide (EPS) yields at optimum levels for glucose, yeast extract (YE), and peptone. A mathematical model was then developed to show the effect of each medium composition and its interactions on the production of mycelial biomass and EPS. The model predicted the maximum biomass yield of 10.86 g/l that appeared at glucose, YE, peptone of 26.3, 6.84, and 6.62 g/l, respectively, while a maximum EPS yield of 348.4 mg/l appeared at glucose, YE, peptone of 28.4, 4.96, 5.60 g/l, respectively. These predicted values were also verified by validation experiments. The excellent correlation between predicted and measured values of each model justifies the validity of both the response models. The results of bioreactor fermentation also show that the optimized culture medium enhanced both biomass (13.91 +/- 0.71 g/l) and EPS (363 +/- 4.1 mg/l) production by Agaricus blazei in a large-scale fermentation process.

  4. Optimization of medium components for production of chitin deacetylase by Bacillus amyloliquefaciens Z7, using response surface methodology.

    PubMed

    He, Yuanhao; Xu, Jianping; Wang, Shengjie; Zhou, Guoying; Liu, Junang

    2014-03-04

    Plackett-Burman design and Box-Behnken response surface methodology (RSM) was employed to optimize the medium components for the chitin deacetylase (CDA) activity from Bacillus amyloliquefaciens Z7. Plackett-Burman design was applied to determine the specific medium components affecting CDA activity and found that starch, chitin and MgSO4 were critical in augmenting CDA activity. These significant parameters were further optimized using Box-Behnken RSM and the optimum concentrations of starch, chitin and MgSO4 were found to be 24.4, 8.8 and 0.19 g/L, respectively. The optimum medium composition was chitin 8.8 g/L, starch 24.4 g/L, yeast extract 10g/L, MgSO4 0.19 g/L, K2HPO4 0.3 g/L and NaCl 5 g/L. Under these optimal conditions, the CDA activity of Bacillus amyloliquefaciens Z7 increased distinctly from 18.75 to 27.48 U/mL (46.6% increase in total yield).

  5. Using Dynamic Geometry Software for the Intersection Surfaces

    ERIC Educational Resources Information Center

    Koparan, Timur; Yilmaz, Gül Kaleli

    2015-01-01

    The purpose of this study is to define prospective teacher views about using dynamic geometry software for intersection surfaces. The study was conducted as a case study. For this purpose, data collection tool was developed based on the opinion of two experts. The data collection tool consists of 4 open-ended questions related to the intersection…

  6. Determination of dynamic surface forces using piezoelectric arrays

    NASA Astrophysics Data System (ADS)

    Nitsche, W.; Mirow, P.

    The experimental determination of static and dynamic surface forces on flow bodies using piezoelectric arrays is outlined. The fundamentals of the piezo-array sensor technique (sensor construction, signal separation, and signal transmission) are presented. Practical applications of piezo-arrays in the fields of airfoil aerodynamics and general flow investigations are explained. The obtained measuring results are purely qualitative.

  7. Dynamics of Wetting and Wicking on Rough Surfaces

    NASA Astrophysics Data System (ADS)

    Antao, Dion; Preston, Daniel; Adera, Solomon; Zhu, Yangying; Wang, Evelyn

    Micro/nano engineering of surfaces to enhance the performance of phase-change heat transfer processes has recently gained wide interest. Interfacial phenomena at the micro/nanoscale play an important role in defining the dynamic wetting and wicking characteristics of the surfaces. Here we report experiments that characterize the dynamic wetting and wicking processes on microstructured silicon surfaces. We investigated cylindrical micropillar arrays in a square pattern with various diameter, pitch, and height to characterize key interfacial behavior over a wide range of surface roughness. The experiments were performed by dipping the microstructured sample vertically into a reservoir of de-ionized water and the spreading dynamics were captured with a high speed camera. We observed that both wetting and wicking exhibit a power law dependence on time, however they occur at different time scales. The instantaneous (~10-100 ms) wetting behavior occurs due to the interfacial tensions, and the resultant force acting at the three-phase contact line. The longer time scale (>100 ms) wicking behavior results from the balance of the capillary pressure generated within the microstructure and the viscous pressure loss from flow through the micropillar array. We develop analytical models to predict these different time scale behavior and compare them to experimental results. This work provides insight into key dynamic processes affecting micro/nanostructure enhanced phase-change heat transfer devices.

  8. Relaxational dynamics of water molecules at protein surface

    NASA Astrophysics Data System (ADS)

    Dellerue, S.; Bellissent-Funel, M.-C.

    2000-08-01

    Relaxational dynamics of water molecules at the surface of a C-phycocyanin protein is studied by high resolution quasi-elastic neutron scattering. The neutron quasi-elastic spectra are well described by the α-relaxation process of mode coupling theory of supercooled liquids. The relaxation times of interfacial water exhibit a power law dependence on the wave vector Q. The average diffusion coefficient is 10 times lower than that of bulk water. This confirms that there is a retardation of water molecules at the protein surface which is in good agreement with the results of water at the surface of hydrophilic model systems.

  9. Decay of surface nanostructures via long-time-scale dynamics

    SciTech Connect

    Voter, A.F.; Stanciu, N.

    1998-11-01

    This is the final report of a three-year, Laboratory Directed Research and Development (LDRD) project at the Los Alamos National Laboratory (LANL). The authors have developed a new approach for extending the time scale of molecular dynamics simulations. For infrequent-event systems, the category that includes most diffusive events in the solid phase, this hyperdynamics method can extend the simulation time by a few orders of magnitude compared to direct molecular dynamics. The trajectory is run on a potential surface that has been biased to raise the energy in the potential basins without affecting the transition state region. The method is described and applied to surface and bulk diffusion processes, achieving microsecond and millisecond simulation times. The authors have also developed a new parallel computing method that is efficient for small system sizes. The combination of the hyperdynamics with this parallel replica dynamics looks promising as a general materials simulation tool.

  10. Mapping Impervious Surface Expansion using Medium-resolution Satellite Image Time Series: A Case Study in the Yangtze River Delta, China

    NASA Technical Reports Server (NTRS)

    Gao, Feng; DeColstoun, Eric Brown; Ma, Ronghua; Weng, Qihao; Masek, Jeffrey G.; Chen, Jin; Pan, Yaozhong; Song, Conghe

    2012-01-01

    Cities have been expanding rapidly worldwide, especially over the past few decades. Mapping the dynamic expansion of impervious surface in both space and time is essential for an improved understanding of the urbanization process, land-cover and land-use change, and their impacts on the environment. Landsat and other medium-resolution satellites provide the necessary spatial details and temporal frequency for mapping impervious surface expansion over the past four decades. Since the US Geological Survey opened the historical record of the Landsat image archive for free access in 2008, the decades-old bottleneck of data limitation has gone. Remote-sensing scientists are now rich with data, and the challenge is how to make best use of this precious resource. In this article, we develop an efficient algorithm to map the continuous expansion of impervious surface using a time series of four decades of medium-resolution satellite images. The algorithm is based on a supervised classification of the time-series image stack using a decision tree. Each imerpervious class represents urbanization starting in a different image. The algorithm also allows us to remove inconsistent training samples because impervious expansion is not reversible during the study period. The objective is to extract a time series of complete and consistent impervious surface maps from a corresponding times series of images collected from multiple sensors, and with a minimal amount of image preprocessing effort. The approach was tested in the lower Yangtze River Delta region, one of the fastest urban growth areas in China. Results from nearly four decades of medium-resolution satellite data from the Landsat Multispectral Scanner (MSS), Thematic Mapper (TM), Enhanced Thematic Mapper plus (ETM+) and China-Brazil Earth Resources Satellite (CBERS) show a consistent urbanization process that is consistent with economic development plans and policies. The time-series impervious spatial extent maps derived

  11. Wetting dynamics of alkyl ketene dimer on cellulosic model surfaces

    SciTech Connect

    Garnier, G.; Bertin, M.; Smrckova, M.

    1999-10-26

    The dynamic wetting of a commercial alkyl ketene dimer (AKD) wax was measured on model cellulosic surfaces. The variables investigated were temperature and the surface composition. The model surfaces consisted of cellulose and cellulose acetate films as well as glass. These surfaces are smooth by industrial standards but not on a molecular level. The objective of the study was to predict the extent of AKD wetting during the time frame of papermaking. For smooth surfaces, AKD particles wet but do not spread on the hydrophilic surfaces investigated. AKD wetting proceeds from the balance of the interfacial forces with the viscous dissipation. The effect of gravity can be neglected for papermaking conditions. The Hoffman-Tanner equation modified for partial wetting provided a very good fit of the dynamic wetting. The slope of the graph is a function of temperature but not of the solid surface composition. Maslyiah's model also fits the experimental results well, but with a physically unrealistic value of the fitting parameter. For partial wetting, the complex but rigorous Cox equation is recommended to estimate the slip length over macroscopic wetting dimensions.

  12. Surface-plasmon dispersion relation for the inhomogeneous charge-density medium

    NASA Astrophysics Data System (ADS)

    Harsh, O. K.; Agarwal, B. K.

    1989-04-01

    The surface-plasmon dispersion relation is derived for the plane-bounded electron gas when there is an inhomogeneous charge-density distribution in the plasma. The hydrodynamical model is used. Both cphi and dcphi/dx are taken to be continuous at the surface of the slab, where cphi is the scalar potential. The dispersion relation is compared with the theoretical works of Stern and Ferrell and of Harsh and Agarwal. It is also compared with the observations of Kunz. A dispersion relation for the volume-plasmon oscillations is derived which resembles the well-known relation of Bohm and Pines.

  13. Surface dynamics and mechanics in liquid crystal polymer coatings

    NASA Astrophysics Data System (ADS)

    Liu, Danqing; Broer, Dirk J.

    2015-03-01

    Based on liquid crystal networks we developed `smart' coatings with responsive surface topographies. Either by prepatterning or by the formation of self-organized structures they can be switched on and off in a pre-designed manner. Here we provide an overview of our methods to generate coatings that form surface structures upon the actuation by light. The coating oscillates between a flat surface and a surface with pre-designed 3D micro-patterns by modulating a light source. With recent developments in solid state lighting, light is an attractive trigger medium as it can be integrated in a device for local control or can be used remotely for flood or localized exposure. The basic principle of formation of surface topographies is based on the change of molecular organization in ordered liquid crystal polymer networks. The change in order leads to anisotropic dimensional changes with contraction along the director and expansion to the two perpendicular directions and an increase in volume by the formation of free volume. These two effects work in concert to provide local expansion and contraction in the coating steered by the local direction of molecular orientation. The surface deformation, expressed as the height difference between the activated regions and the non-activated regions divided by the initial film thickness, is of the order of 20%. Switching occurs immediately when the light is switched `on' and `off' and takes several tens of seconds.

  14. Surface and bulk hot electron dynamics in silicon

    NASA Astrophysics Data System (ADS)

    Jeong, Seongtae; Bokor, Jeffrey

    1997-03-01

    The direct time domain study of hot electron dynamics on the silicon surface has been an active area of research. Dynamics in Si(100) surface states was observed(M.W. Rowe, H. Liu, G. P. Williams, Jr., and R. T. Williams, Phys. Rev. B 47, 2048 (1993)) as well as cooling of a hot but thermal distribution of carriers in bulk silicon(J. R. Goldman, and J. A. Prybyla, Phys. Rev. Lett. 72, 1364 (1994)). In this work, a time-resolved photoemission study on the Si(100)2x1 surface with 1.55 eV pump and 4.66 eV probe with 0.2 psec time resolution is reported. It is observed that two-photon absorption is responsible for high kinetic energy electrons above the conduction band minimum (CBM) but direct single-photon excitation into surface states and conduction band states followed by the surface recombination dominates the dynamics. Also observed are an early nonthermal electronic distribution in silicon and its transition into a thermal one followed by a rapid cooling.

  15. Drop impact dynamics on oil-infused nanostructured surfaces.

    PubMed

    Lee, Choongyeop; Kim, Hyunsik; Nam, Youngsuk

    2014-07-22

    We experimentally investigated the impact dynamics of a water drop on oil-infused nanostructured surfaces using high-speed microscopy and scalable metal oxide nano surfaces. The effects of physical properties of the oil and impact velocity on complex fluid dynamics during drop impact were investigated. We show that the oil viscosity does not have significant effects on the maximal spreading radius of the water drop, while it moderately affects the retraction dynamics. The oil viscosity also determines the stability of the infused lubricant oil during the drop impact; i.e., the low viscosity oil layer is easily displaced by the impacting drop, which is manifested by a residual mark on the impact region and earlier initiation of prompt splashing. Also, because of the liquid (water)-liquid (oil) interaction on oil-infused surfaces, various instabilities are developed at the rim during impact under certain conditions, resulting in the flower-like pattern during retraction or elongated filaments during spreading. We believe that our findings will contribute to the rational design of oil-infused surfaces under drop impact conditions by illuminating the complex fluid phenomena on oil-infused surfaces during drop impact.

  16. Numerical Simulation of MHD Hiemenz Flow of a Micropolar Fluid towards a Nonlinear Stretching Surface through a Porous Medium

    NASA Astrophysics Data System (ADS)

    Sharma, Rajesh; Bhargava, Rama

    2015-07-01

    In this article, the two-dimensional boundary layer problem of Hiemenz flow (two-dimensional flow of a fluid near a stagnation point) of an incompressible micropolar fluid towards a nonlinear stretching surface placed in a porous medium in the presence of transverse magnetic field is examined. The resulting nonlinear differential equations governing the problem have been transformed by a similarity transformation into a system of nonlinear ordinary differential equations which are solved numerically by the Element Free Galerkin method. The influence of various parameters on the velocity, microrotation, temperature, and concentration is shown. Some of the results are compared with the Finite Element Method. Finally, validation of the numerical results is demonstrated for local skin friction ? for hydrodynamic micropolar fluid flow on a linearly stretching surface.

  17. Generic method for modular surface modification of cellulosic materials in aqueous medium by sequential "click" reaction and adsorption.

    PubMed

    Filpponen, Ilari; Kontturi, Eero; Nummelin, Sami; Rosilo, Henna; Kolehmainen, Erkki; Ikkala, Olli; Laine, Janne

    2012-03-12

    A generic approach for heterogeneous surface modification of cellulosic materials in aqueous medium, applicable for a wide range of functionalizations, is presented. In the first step, carboxymethyl cellulose (CMC) modified with azide or alkyne functionality, was adsorbed on a cellulosic substrate, thus, providing reactive sites for azide-alkyne cycloaddition click reactions. In the second step, functional units with complementary click units were reacted on the cellulose surface, coated by the click-modified CMC. Selected model functionalizations on diverse cellulosic substrates are shown to demonstrate the generality of the approach. The concept by sequentially combining the robust physical adsorption ("physical click") and robust chemical reaction ("chemical click") allows versatile, simple, and environmentally friendly modification of a cellulosic substrate with virtually any azide- or alkyne-modified molecule and even functionalization with several types of units.

  18. Tunable Spin dependent beam shift by simultaneously tailoring geometric and dynamical phases of light in inhomogeneous anisotropic medium

    NASA Astrophysics Data System (ADS)

    Pal, Mandira; Banerjee, Chitram; Chandel, Shubham; Bag, Ankan; Majumder, Shovan K.; Ghosh, Nirmalya

    2016-12-01

    Spin orbit interaction and the resulting Spin Hall effect of light are under recent intensive investigations because of their fundamental nature and potential applications. Here, we report an interesting manifestation of spin Hall effect of light and demonstrate its tunability in an inhomogeneous anisotropic medium exhibiting spatially varying retardance level. In our system, the beam shift occurs only for one circular polarization mode keeping the other orthogonal mode unaffected, which is shown to arise due to the combined spatial gradients of the geometric phase and the dynamical phase of light. The constituent two orthogonal circular polarization modes of an input linearly polarized light evolve in different trajectories, eventually manifesting as a large and tunable spin separation. The spin dependent beam shift and the demonstrated principle of simultaneously tailoring space-varying geometric and dynamical phase of light for achieving its tunability (of both magnitude and direction), may provide an attractive route towards development of spin-optical devices.

  19. Tunable Spin dependent beam shift by simultaneously tailoring geometric and dynamical phases of light in inhomogeneous anisotropic medium.

    PubMed

    Pal, Mandira; Banerjee, Chitram; Chandel, Shubham; Bag, Ankan; Majumder, Shovan K; Ghosh, Nirmalya

    2016-12-22

    Spin orbit interaction and the resulting Spin Hall effect of light are under recent intensive investigations because of their fundamental nature and potential applications. Here, we report an interesting manifestation of spin Hall effect of light and demonstrate its tunability in an inhomogeneous anisotropic medium exhibiting spatially varying retardance level. In our system, the beam shift occurs only for one circular polarization mode keeping the other orthogonal mode unaffected, which is shown to arise due to the combined spatial gradients of the geometric phase and the dynamical phase of light. The constituent two orthogonal circular polarization modes of an input linearly polarized light evolve in different trajectories, eventually manifesting as a large and tunable spin separation. The spin dependent beam shift and the demonstrated principle of simultaneously tailoring space-varying geometric and dynamical phase of light for achieving its tunability (of both magnitude and direction), may provide an attractive route towards development of spin-optical devices.

  20. Tunable Spin dependent beam shift by simultaneously tailoring geometric and dynamical phases of light in inhomogeneous anisotropic medium

    PubMed Central

    Pal, Mandira; Banerjee, Chitram; Chandel, Shubham; Bag, Ankan; Majumder, Shovan K.; Ghosh, Nirmalya

    2016-01-01

    Spin orbit interaction and the resulting Spin Hall effect of light are under recent intensive investigations because of their fundamental nature and potential applications. Here, we report an interesting manifestation of spin Hall effect of light and demonstrate its tunability in an inhomogeneous anisotropic medium exhibiting spatially varying retardance level. In our system, the beam shift occurs only for one circular polarization mode keeping the other orthogonal mode unaffected, which is shown to arise due to the combined spatial gradients of the geometric phase and the dynamical phase of light. The constituent two orthogonal circular polarization modes of an input linearly polarized light evolve in different trajectories, eventually manifesting as a large and tunable spin separation. The spin dependent beam shift and the demonstrated principle of simultaneously tailoring space-varying geometric and dynamical phase of light for achieving its tunability (of both magnitude and direction), may provide an attractive route towards development of spin-optical devices. PMID:28004825

  1. Anomalously Rapid Hydration Water Diffusion Dynamics Near DNA Surfaces.

    PubMed

    Franck, John M; Ding, Yuan; Stone, Katherine; Qin, Peter Z; Han, Songi

    2015-09-23

    The emerging Overhauser effect dynamic nuclear polarization (ODNP) technique measures the translational mobility of water within the vicinity (5-15 Å) of preselected sites. The work presented here expands the capabilities of the ODNP technique and illuminates an important, previously unseen, property of the translational diffusion dynamics of water at the surface of DNA duplexes. We attach nitroxide radicals (i.e., spin labels) to multiple phosphate backbone positions of DNA duplexes, allowing ODNP to measure the hydration dynamics at select positions along the DNA surface. With a novel approach to ODNP analysis, we isolate the contributions of water molecules at these sites that undergo free translational diffusion from water molecules that either loosely bind to or exchange protons with the DNA. The results reveal that a significant population of water in a localized volume adjacent to the DNA surface exhibits fast, bulk-like characteristics and moves unusually rapidly compared to water found in similar probe volumes near protein and membrane surfaces. Control studies show that the observation of these characteristics are upheld even when the DNA duplex is tethered to streptavidin or the mobility of the nitroxides is altered. This implies that, as compared to protein or lipid surfaces, it is an intrinsic feature of the DNA duplex surface that it interacts only weakly with a significant fraction of the surface hydration water network. The displacement of this translationally mobile water is energetically less costly than that of more strongly bound water by up to several kBT and thus can lower the activation barrier for interactions involving the DNA surface.

  2. Quantum simulation of molecular interaction and dynamics at surfaces

    NASA Astrophysics Data System (ADS)

    Ding, Zi-Jing; Jiao, Yang; Meng, Sheng

    2011-09-01

    The interaction between molecules and solid surfaces plays important roles in various applications, including catalysis, sensors, nanoelectronics, and solar cells. Surprisingly, a full understanding of molecule-surface interaction at the quantum mechanical level has not been achieved even for very simple molecules, such as water. In this mini-review, we report recent progresses and current status of studies on interaction between representative molecules and surfaces. Taking water/metal, DNA bases/carbon nanotube, and organic dye molecule/oxide as examples, we focus on the understanding on the microstructure, electronic property, and electron-ion dynamics involved in these systems obtained from first-principles quantum mechanical calculations. We find that a quantum mechanical description of molecule-surface interaction is essential for understanding interface phenomenon at the microscopic level, such as wetting. New theoretical developments, including van der Waals density functional and quantum nuclei treatment, improve further our understanding of surface interactions.

  3. Modeling the effect of dynamic surfaces on membrane penetration

    NASA Astrophysics Data System (ADS)

    van Lehn, Reid; Alexander-Katz, Alfredo

    2011-03-01

    The development of nanoscale materials for targeted drug delivery is an important current pursuit in materials science. One task of drug carriers is to release therapeutic agents within cells by bypassing the cell membrane to maximize the effectiveness of their payload and minimize bodily exposure. In this work, we use coarse-grained simulations to study nanoparticles (NPs) grafted with hydrophobic and hydrophilic ligands that rearrange in response to the amphiphilic lipid bilayer. We demonstrate that this dynamic surface permits the NP to spontaneously penetrate to the bilayer midplane when the surface ligands are near an order-disorder transition. We believe that this work will lead to the design of new drug carriers capable of non-specifically accessing cell interiors based solely on their dynamic surface properties. Our work is motivated by existing nanoscale systems such as micelles, or NPs grafted with highly mobile ligands or polymer brushes.

  4. Dynamics of temporally-evolving shear layers on the interface between a porous medium and a pure fluid

    NASA Astrophysics Data System (ADS)

    Antoniadis, Panagiotis D.; Papalexandris, Miltiadis V.

    2013-11-01

    In this talk we present results from our study on the dynamics of flows at the macroscopic interface between a porous medium and a pure fluid. To this end, we employ a variation of the unsteady Darcy-Brinkman equation, which is valid both inside and outside the porous medium. The major advantage of this approach is that it does not require additional interface conditions. In the first part of the talk, we present a linear stability analysis for unbounded shear layers on the interfaces of interest. According to our analysis, these layers are unconditionally unstable, regardless of the porosity of the medium. Subsequently, we present results of three-dimensional simulations of such shear layers. According to these simulations, the velocity gradients across the interface result in the onset of a Kelvin-Helmholtz instability which grows over time, leading to spanwise roller formation and pairings. There is also concurrent formation of thin ``rib'' vortices, as in the case of single-phase plane mixing layers. Important characteristics of the flow, such as self-similarity and growth rate of the shear layer, are also discussed. This work is supported by the National Fund for Scientific Research (FNRS), Belgium.

  5. Detection of small surface vessels in near, medium, and far infrared spectral bands

    NASA Astrophysics Data System (ADS)

    Dulski, R.; Milewski, S.; Kastek, M.; Trzaskawka, P.; Szustakowski, M.; Ciurapinski, W.; Zyczkowski, M.

    2011-11-01

    Protection of naval bases and harbors requires close co-operation between security and access control systems covering land areas and those monitoring sea approach routes. The typical location of naval bases and harbors - usually next to a large city - makes it difficult to detect and identify a threat in the dense regular traffic of various sea vessels (i.e. merchant ships, fishing boats, tourist ships). Due to the properties of vessel control systems, such as AIS (Automatic Identification System), and the effectiveness of radar and optoelectronic systems against different targets it seems that fast motor boats called RIB (Rigid Inflatable Boat) could be the most serious threat to ships and harbor infrastructure. In the paper the process and conditions for the detection and identification of high-speed boats in the areas of ports and naval bases in the near, medium and far infrared is presented. Based on the results of measurements and recorded thermal images the actual temperature contrast delta T (RIB / sea) will be determined, which will further allow to specify the theoretical ranges of detection and identification of the RIB-type targets for an operating security system. The data will also help to determine the possible advantages of image fusion where the component images are taken in different spectral ranges. This will increase the probability of identifying the object by the multi-sensor security system equipped additionally with the appropriate algorithms for detecting, tracking and performing the fusion of images from the visible and infrared cameras.

  6. Oxidation-driven surface dynamics on NiAl(100)

    PubMed Central

    Qin, Hailang; Chen, Xidong; Li, Liang; Sutter, Peter W.; Zhou, Guangwen

    2015-01-01

    Atomic steps, a defect common to all crystal surfaces, can play an important role in many physical and chemical processes. However, attempts to predict surface dynamics under nonequilibrium conditions are usually frustrated by poor knowledge of the atomic processes of surface motion arising from mass transport from/to surface steps. Using low-energy electron microscopy that spatially and temporally resolves oxide film growth during the oxidation of NiAl(100) we demonstrate that surface steps are impermeable to oxide film growth. The advancement of the oxide occurs exclusively on the same terrace and requires the coordinated migration of surface steps. The resulting piling up of surface steps ahead of the oxide growth front progressively impedes the oxide growth. This process is reversed during oxide decomposition. The migration of the substrate steps is found to be a surface-step version of the well-known Hele-Shaw problem, governed by detachment (attachment) of Al atoms at step edges induced by the oxide growth (decomposition). By comparing with the oxidation of NiAl(110) that exhibits unimpeded oxide film growth over substrate steps we suggest that whenever steps are the source of atoms used for oxide growth they limit the oxidation process; when atoms are supplied from the bulk, the oxidation rate is not limited by the motion of surface steps. PMID:25548155

  7. Oxidation-driven surface dynamics on NiAl(100)

    DOE PAGES

    Qin, Hailang; Chen, Xidong; Li, Liang; ...

    2014-12-29

    Atomic steps, a defect common to all crystal surfaces, can play an important role in many physical and chemical processes. However, attempts to predict surface dynamics under nonequilibrium conditions are usually frustrated by poor knowledge of the atomic processes of surface motion arising from mass transport from/to surface steps. Using low-energy electron microscopy that spatially and temporally resolves oxide film growth during the oxidation of NiAl(100) we demonstrate that surface steps are impermeable to oxide film growth. The advancement of the oxide occurs exclusively on the same terrace and requires the coordinated migration of surface steps. The resulting piling upmore » of surface steps ahead of the oxide growth front progressively impedes the oxide growth. This process is reversed during oxide decomposition. The migration of the substrate steps is found to be a surface-step version of the well-known Hele-Shaw problem, governed by detachment (attachment) of Al atoms at step edges induced by the oxide growth (decomposition). As a result, by comparing with the oxidation of NiAl(110) that exhibits unimpeded oxide film growth over substrate steps, we suggest that whenever steps are the source of atoms used for oxide growth they limit the oxidation process; when atoms are supplied from the bulk, the oxidation rate is not limited by the motion of surface steps.« less

  8. Oxidation-driven surface dynamics on NiAl(100)

    SciTech Connect

    Qin, Hailang; Chen, Xidong; Li, Liang; Sutter, Peter W.; Zhou, Guangwen

    2014-12-29

    Atomic steps, a defect common to all crystal surfaces, can play an important role in many physical and chemical processes. However, attempts to predict surface dynamics under nonequilibrium conditions are usually frustrated by poor knowledge of the atomic processes of surface motion arising from mass transport from/to surface steps. Using low-energy electron microscopy that spatially and temporally resolves oxide film growth during the oxidation of NiAl(100) we demonstrate that surface steps are impermeable to oxide film growth. The advancement of the oxide occurs exclusively on the same terrace and requires the coordinated migration of surface steps. The resulting piling up of surface steps ahead of the oxide growth front progressively impedes the oxide growth. This process is reversed during oxide decomposition. The migration of the substrate steps is found to be a surface-step version of the well-known Hele-Shaw problem, governed by detachment (attachment) of Al atoms at step edges induced by the oxide growth (decomposition). As a result, by comparing with the oxidation of NiAl(110) that exhibits unimpeded oxide film growth over substrate steps, we suggest that whenever steps are the source of atoms used for oxide growth they limit the oxidation process; when atoms are supplied from the bulk, the oxidation rate is not limited by the motion of surface steps.

  9. Oxidation-driven surface dynamics on NiAl(100)

    NASA Astrophysics Data System (ADS)

    Qin, Hailang; Chen, Xidong; Li, Liang; Sutter, Peter W.; Zhou, Guangwen

    2015-01-01

    Atomic steps, a defect common to all crystal surfaces, can play an important role in many physical and chemical processes. However, attempts to predict surface dynamics under nonequilibrium conditions are usually frustrated by poor knowledge of the atomic processes of surface motion arising from mass transport from/to surface steps. Using low-energy electron microscopy that spatially and temporally resolves oxide film growth during the oxidation of NiAl(100) we demonstrate that surface steps are impermeable to oxide film growth. The advancement of the oxide occurs exclusively on the same terrace and requires the coordinated migration of surface steps. The resulting piling up of surface steps ahead of the oxide growth front progressively impedes the oxide growth. This process is reversed during oxide decomposition. The migration of the substrate steps is found to be a surface-step version of the well-known Hele-Shaw problem, governed by detachment (attachment) of Al atoms at step edges induced by the oxide growth (decomposition). By comparing with the oxidation of NiAl(110) that exhibits unimpeded oxide film growth over substrate steps we suggest that whenever steps are the source of atoms used for oxide growth they limit the oxidation process; when atoms are supplied from the bulk, the oxidation rate is not limited by the motion of surface steps.

  10. SEDIGISM: Structure, excitation, and dynamics of the inner Galactic interstellar medium

    NASA Astrophysics Data System (ADS)

    Schuller, F.; Csengeri, T.; Urquhart, J. S.; Duarte-Cabral, A.; Barnes, P. J.; Giannetti, A.; Hernandez, A. K.; Leurini, S.; Mattern, M.; Medina, S.-N. X.; Agurto, C.; Azagra, F.; Anderson, L. D.; Beltrán, M. T.; Beuther, H.; Bontemps, S.; Bronfman, L.; Dobbs, C. L.; Dumke, M.; Finger, R.; Ginsburg, A.; Gonzalez, E.; Henning, T.; Kauffmann, J.; Mac-Auliffe, F.; Menten, K. M.; Montenegro-Montes, F. M.; Moore, T. J. T.; Muller, E.; Parra, R.; Perez-Beaupuits, J.-P.; Pettitt, A.; Russeil, D.; Sánchez-Monge, Á.; Schilke, P.; Schisano, E.; Suri, S.; Testi, L.; Torstensson, K.; Venegas, P.; Wang, K.; Wienen, M.; Wyrowski, F.; Zavagno, A.

    2017-05-01

    Context. The origin and life-cycle of molecular clouds are still poorly constrained, despite their importance for understanding the evolution of the interstellar medium. Many large-scale surveys of the Galactic plane have been conducted recently, allowing for rapid progress in this field. Nevertheless, a sub-arcminute resolution global view of the large-scale distribution of molecular gas, from the diffuse medium to dense clouds and clumps, and of their relationshipto the spiral structure, is still missing. Aims: We have carried out a systematic, homogeneous, spectroscopic survey of the inner Galactic plane, in order to complement the many continuum Galactic surveys available with crucial distance and gas-kinematic information. Our aim is to combine this data set with recent infrared to sub-millimetre surveys at similar angular resolutions. Methods: The SEDIGISM survey covers 78 deg2 of the inner Galaxy (-60°≤ℓ≤ 18°, |b|≤ 0.5°) in the J = 2-1 rotational transition of 13CO. This isotopologue of CO is less abundant than 12CO by factors up to 100. Therefore, its emission has low to moderate optical depths, and higher critical density, making it an ideal tracer of the cold, dense interstellar medium. The data have been observed with the SHFI single-pixel instrument at APEX. The observational setup covers the 13CO(2-1) and C18O(2-1) lines, plus several transitions from other molecules. Results: The observations have been completed. Data reduction is in progress, and the final data products will be made available in the near future. Here we give a detailed description of the survey and the dedicated data reduction pipeline. To illustrate the scientific potential of this survey, preliminary results based on a science demonstration field covering -20°≤ℓ ≤ -18.5° are presented. Analysis of the 13CO(2-1) data in this field reveals compact clumps, diffuse clouds, and filamentary structures at a range of heliocentric distances. By combining our data with

  11. Surface properties of kaolin and illite suspensions in concentrated calcium hydroxide medium.

    PubMed

    Konan, Koffi Léon; Peyratout, Claire; Bonnet, Jean-Pierre; Smith, Agnès; Jacquet, Alain; Magnoux, Patrick; Ayrault, Philippe

    2007-03-01

    The adsorption behaviour of calcium hydroxide onto illite and kaolin clay minerals was investigated by monitoring with atomic emission spectroscopy and pH measurements the amounts of ions left in solution after exposing clay minerals to calcium hydroxide solutions of various concentrations. Both clay minerals can adsorb calcium and hydroxyl ions. Rather than just considering proton exchanges at the clay mineral surfaces, the adsorption is explained by an approach based on Lewis description of molecules. With this approach, a mechanism for calcium hydroxide adsorption not only at the edges of the clay particles but also onto the faces is proposed. In order to gain a better insight onto the active groups at the surface of the studied clay minerals, adsorption of pyridine and ammonia on illite and kaolin was followed by FTIR spectroscopy. These measurements gave the signature of edges, which are marginally involved in interactions with calcium ions.

  12. Molecular dynamics simulation of water at mineral surfaces: Structure, dynamics, energetics and hydrogen bonding

    NASA Astrophysics Data System (ADS)

    Kalinichev, A. G.; Wang, J.; Kirkpatrick, R.

    2006-05-01

    Fundamental molecular-level understanding of the properties of aqueous mineral interfaces is of great importance for many geochemical and environmental systems. Interaction between water and mineral surfaces substantially affects the properties of both phases, including the reactivity and functionality of the substrate surface, and the structure, dynamics, and energetics of the near surface aqueous phase. Experimental studies of interfacial water structure and dynamics using surface-sensitive techniques such as sum-frequency vibrational spectroscopy or X-ray and neutron reflectivity are not always possible for many practically important substrates, and their results often require interpretation concerning the atomistic mechanisms responsible for the observed behavior. Molecular computer simulations can provide new insight into the underlying molecular- level relationships between the inorganic substrate structure and composition and the structure, ordering, and dynamics of interfacial water. We have performed a series of molecular dynamics (MD) computer simulations of aqueous interfaces with several silicates (quartz, muscovite, and talc) and hydroxides (brucite, portlandite, gibbsite, Ca/Al and Mg/Al double hydroxides) to quantify the effects of the substrate mineral structure and composition on the structural, transport, and thermodynamic properties of water on these mineral surfaces. Due to the prevalent effects of the development of well-interconnected H-bonding networks across the mineral- water interfaces, all the hydroxide surfaces (including a fully hydroxylated quartz surface) show very similar H2O density profiles perpendicular to the interface. However, the predominant orientations of the interfacial H2O molecules and their detailed 2-dimensional near-surface structure and dynamics parallel to the interface are quite different reflecting the differences in the substrate structural charge distribution and the density and orientations of the surface OH

  13. First Principles Studies of Surface Vibrational Dynamics: Li(100)

    NASA Astrophysics Data System (ADS)

    Staikov, Pavlin; Kara, Abdelkader; Rahman, Talat. S.

    1996-03-01

    We present studies of the structure and the dynamics of Li(100) using ab initio, norm-conserving, non-local and soft pseudopotentials with partial core correction, and a plane wave basis. A preconditioned steepest descent method (N. Chetty, M. Weinert, T. S. Rahman, and J. W. Davenport, Phys. Rev. B 52) (1995) 6313. is used to solve iteratively Kohn-Sham equations for a given set of atomic positions. Forces and thereby force constants matrix for ion-cores at the surface and in the bulk are calculated using Hellman-Feynman theorem. We relate the large outward relaxation (K. Kokko, P. T. Salo, R. Laihia, and K. Mansikka, Phys. Rev. B 52) (1995) 7868. of the surface layer to the changes in the surface force constants. Vibrational dynamics at and near the surface are calculated. The polarizations and the frequencies of the surface modes are contrasted with the more usual case of inward top-layer relaxation. The local vibrational density of states are also evaluated and surface thermodynamical properties are explored.

  14. Decoupling of surface diffusion and relaxation dynamics of molecular glasses.

    PubMed

    Zhang, Yue; Fakhraai, Zahra

    2017-04-03

    Tobacco mosaic virus is used as a probe to measure surface diffusion of ultrathin films of N,N'-Bis(3-methylphenyl)-N,N'-diphenylbenzidine (TPD) (12 nm [Formula: see text] 53 nm, where [Formula: see text] is the film thickness) at various temperatures below the glass transition temperature, [Formula: see text], of all films. As the film thickness is decreased, [Formula: see text] decreases rapidly and the average film dynamics are enhanced by 6-14 orders of magnitude. We show that the surface diffusion is invariant of the film thickness decrease and the resulting enhanced overall mobility. The values of the surface diffusion coefficient and its temperature dependence are invariant of film thickness and are the same as the corresponding bulk values ([Formula: see text]400 nm). For the thinnest films ([Formula: see text]20 nm), the effective activation energy for rearrangement (temperature dependence of relaxation times) becomes smaller than the activation energy for surface diffusion. These results suggest that the fast surface diffusion is decoupled from film relaxation dynamics and is a solely free surface property.

  15. Drop impact dynamics on liquid-infused superhydrophobic surfaces

    NASA Astrophysics Data System (ADS)

    Kim, Jeong-Hyun; Rothstein, Jonathan

    2015-11-01

    In this talk, we present a series of experiments investigating the drop impact dynamics on hydrophobic, air-infused and lubricant-infused superhydrophobic surfaces. To create the superhydrophobic surfaces, smooth Teflon (PTFE) surfaces were roughened by a 240-grit sandpaper. The immiscible and incompressible silicone oils with different viscosities were infused into features of the superhydrophobic surfaces by a skim coating technique. The spreading and retraction dynamics on a series of the tested surfaces will be presented. We will show that the maximal deformation of the drops on lubricant-infused surfaces grows with increasing viscosity ratio between a water drop and the infused oil. We will show that this increase in the maximal deformation with the viscosity ratio is consistent with increasing the velocity and the viscosity of the drops but the rims of the drops destabilize with increasing the drop velocity. Finally, we will demonstrate that increasing the viscosity of the infused oil induces higher viscous force at the contact line, resulting in reduction in the movement of the drops during retraction and corresponding increase in the final drop size.

  16. Drop impact and rebound dynamics on an inclined superhydrophobic surface.

    PubMed

    Yeong, Yong Han; Burton, James; Loth, Eric; Bayer, Ilker S

    2014-10-14

    Due to its potential in water-repelling applications, the impact and rebound dynamics of a water drop impinging perpendicular to a horizontal superhydrophobic surface have undergone extensive study. However, drops tend to strike a surface at an angle in applications. In such cases, the physics governing the effects of oblique impact are not well studied or understood. Therefore, the objective of this study was to conduct an experiment to investigate the impact and rebound dynamics of a drop at various liquid viscosities, in an isothermal environment, and on a nanocomposite superhydrophobic surface at normal and oblique impact conditions (tilted at 15°, 30°, 45°, and 60°). This study considered drops falling from various heights to create normal impact Weber numbers ranging from 6 to 110. In addition, drop viscosity was varied by decreasing the temperature for water drops and by utilizing water-glycerol mixtures, which have similar surface tension to water but higher viscosities. Results revealed that oblique and normal drop impact behaved similarly (in terms of maximum drop spread as well as rebound dynamics) at low normal Weber numbers. However, at higher Weber numbers, normal and oblique impact results diverged in terms of maximum spread, which could be related to asymmetry and more complex outcomes. These asymmetry effects became more pronounced as the inclination angle increased, to the point where they dominated the drop impact and rebound characteristics when the surface was inclined at 60°. The drop rebound characteristics on inclined surfaces could be classified into eight different outcomes driven primarily by normal Weber number and drop Ohnesorge numbers. However, it was found that these outcomes were also a function of the receding contact angle, whereby reduced receding angles yielded tail-like structures. Nevertheless, the contact times of the drops with the coating were found to be generally independent of surface inclination.

  17. Molecular Dynamics of a Protein Surface: Ion-Residues Interactions

    PubMed Central

    Friedman, Ran; Nachliel, Esther; Gutman, Menachem

    2005-01-01

    Time-resolved measurements indicated that protons could propagate on the surface of a protein or a membrane by a special mechanism that enhanced the shuttle of the proton toward a specific site. It was proposed that a suitable location of residues on the surface contributes to the proton shuttling function. In this study, this notion was further investigated by the use of molecular dynamics simulations, where Na+ and Cl− are the ions under study, thus avoiding the necessity for quantum mechanical calculations. Molecular dynamics simulations were carried out using as a model a few Na+ and Cl− ions enclosed in a fully hydrated simulation box with a small globular protein (the S6 of the bacterial ribosome). Three independent 10-ns-long simulations indicated that the ions and the protein's surface were in equilibrium, with rapid passage of the ions between the protein's surface and the bulk. However, it was noted that close to some domains the ions extended their duration near the surface, thus suggesting that the local electrostatic potential hindered their diffusion to the bulk. During the time frame in which the ions were detained next to the surface, they could rapidly shuttle between various attractor sites located under the electrostatic umbrella. Statistical analysis of the molecular dynamics and electrostatic potential/entropy consideration indicated that the detainment state is an energetic compromise between attractive forces and entropy of dilution. The similarity between the motion of free ions next to a protein and the proton transfer on the protein's surface are discussed. PMID:15894639

  18. Exploring QCD dynamics in medium energy γA semiexclusive collisions

    NASA Astrophysics Data System (ADS)

    Larionov, A. B.; Strikman, M.

    2016-09-01

    We demonstrate that studies of the semiexclusive large angle photon-nucleus reactions: γ + A →h1 +h2 +(A - 1) * with tagged photon beams of energies 6 ÷ 10 GeV which can be performed in Hall D at Thomas Jefferson National Acceleration Facility (TJNAF) would allow to probe several aspects of the QCD dynamics: establish the t-range in which transition from soft to hard dynamics occurs, compare the strength of the interaction of various mesons and baryons with nucleons at the energies of few GeV, as well as look for the color transparency effects.

  19. Investigating the dynamics of surface-immobilized DNA nanomachines

    PubMed Central

    Dunn, Katherine E.; Trefzer, Martin A.; Johnson, Steven; Tyrrell, Andy M.

    2016-01-01

    Surface-immobilization of molecules can have a profound influence on their structure, function and dynamics. Toehold-mediated strand displacement is often used in solution to drive synthetic nanomachines made from DNA, but the effects of surface-immobilization on the mechanism and kinetics of this reaction have not yet been fully elucidated. Here we show that the kinetics of strand displacement in surface-immobilized nanomachines are significantly different to those of the solution phase reaction, and we attribute this to the effects of intermolecular interactions within the DNA layer. We demonstrate that the dynamics of strand displacement can be manipulated by changing strand length, concentration and G/C content. By inserting mismatched bases it is also possible to tune the rates of the constituent displacement processes (toehold-binding and branch migration) independently, and information can be encoded in the time-dependence of the overall reaction. Our findings will facilitate the rational design of surface-immobilized dynamic DNA nanomachines, including computing devices and track-based motors. PMID:27387252

  20. Investigating the dynamics of surface-immobilized DNA nanomachines

    NASA Astrophysics Data System (ADS)

    Dunn, Katherine E.; Trefzer, Martin A.; Johnson, Steven; Tyrrell, Andy M.

    2016-07-01

    Surface-immobilization of molecules can have a profound influence on their structure, function and dynamics. Toehold-mediated strand displacement is often used in solution to drive synthetic nanomachines made from DNA, but the effects of surface-immobilization on the mechanism and kinetics of this reaction have not yet been fully elucidated. Here we show that the kinetics of strand displacement in surface-immobilized nanomachines are significantly different to those of the solution phase reaction, and we attribute this to the effects of intermolecular interactions within the DNA layer. We demonstrate that the dynamics of strand displacement can be manipulated by changing strand length, concentration and G/C content. By inserting mismatched bases it is also possible to tune the rates of the constituent displacement processes (toehold-binding and branch migration) independently, and information can be encoded in the time-dependence of the overall reaction. Our findings will facilitate the rational design of surface-immobilized dynamic DNA nanomachines, including computing devices and track-based motors.

  1. Fast and Slow Wetting Dynamics on nanostructured surfaces

    NASA Astrophysics Data System (ADS)

    Nandyala, Dhiraj; Rahmani, Amir; Cubaud, Thomas; Colosqui, Carlos

    2015-11-01

    This talk will present force-displacement and spontaneous drop spreading measurements on diverse nanostructured surfaces (e.g., mesoporous titania thin films, nanoscale pillared structures, on silica or glass substrates). Experimental measurements are performed for water-air and water-oil systems. The dynamics of wetting observed in these experiments can present remarkable crossovers from fast to slow or arrested dynamics. The emergence of a slow wetting regime is attributed to a multiplicity of metastable equilibrium states induced by nanoscale surface features. The crossover point can be dramatically advanced or delayed by adjusting specific physical parameters (e.g., viscosity of the wetting phases) and geometric properties of the surface nanostructure (e.g., nanopore/pillar radius and separation). Controlling the crossover point to arrested dynamics can effectively modify the degree of contact angle hysteresis and magnitude of liquid adhesion forces observed on surfaces of different materials. This work is supported by a SEED Award from The Office of Brookhaven National Laboratory Affairs at Stony Brook University.

  2. Efficient modelling of droplet dynamics on complex surfaces.

    PubMed

    Karapetsas, George; Chamakos, Nikolaos T; Papathanasiou, Athanasios G

    2016-03-02

    This work investigates the dynamics of droplet interaction with smooth or structured solid surfaces using a novel sharp-interface scheme which allows the efficient modelling of multiple dynamic contact lines. The liquid-gas and liquid-solid interfaces are treated in a unified context and the dynamic contact angle emerges simply due to the combined action of the disjoining and capillary pressure, and viscous stresses without the need of an explicit boundary condition or any requirement for the predefinition of the number and position of the contact lines. The latter, as it is shown, renders the model able to handle interfacial flows with topological changes, e.g. in the case of an impinging droplet on a structured surface. Then it is possible to predict, depending on the impact velocity, whether the droplet will fully or partially impregnate the structures of the solid, or will result in a 'fakir', i.e. suspended, state. In the case of a droplet sliding on an inclined substrate, we also demonstrate the built-in capability of our model to provide a prediction for either static or dynamic contact angle hysteresis. We focus our study on hydrophobic surfaces and examine the effect of the geometrical characteristics of the solid surface. It is shown that the presence of air inclusions trapped in the micro-structure of a hydrophobic substrate (Cassie-Baxter state) result in the decrease of contact angle hysteresis and in the increase of the droplet migration velocity in agreement with experimental observations for super-hydrophobic surfaces. Moreover, we perform 3D simulations which are in line with the 2D ones regarding the droplet mobility and also indicate that the contact angle hysteresis may be significantly affected by the directionality of the structures with respect to the droplet motion.

  3. Efficient modelling of droplet dynamics on complex surfaces

    NASA Astrophysics Data System (ADS)

    Karapetsas, George; Chamakos, Nikolaos T.; Papathanasiou, Athanasios G.

    2016-03-01

    This work investigates the dynamics of droplet interaction with smooth or structured solid surfaces using a novel sharp-interface scheme which allows the efficient modelling of multiple dynamic contact lines. The liquid-gas and liquid-solid interfaces are treated in a unified context and the dynamic contact angle emerges simply due to the combined action of the disjoining and capillary pressure, and viscous stresses without the need of an explicit boundary condition or any requirement for the predefinition of the number and position of the contact lines. The latter, as it is shown, renders the model able to handle interfacial flows with topological changes, e.g. in the case of an impinging droplet on a structured surface. Then it is possible to predict, depending on the impact velocity, whether the droplet will fully or partially impregnate the structures of the solid, or will result in a ‘fakir’, i.e. suspended, state. In the case of a droplet sliding on an inclined substrate, we also demonstrate the built-in capability of our model to provide a prediction for either static or dynamic contact angle hysteresis. We focus our study on hydrophobic surfaces and examine the effect of the geometrical characteristics of the solid surface. It is shown that the presence of air inclusions trapped in the micro-structure of a hydrophobic substrate (Cassie-Baxter state) result in the decrease of contact angle hysteresis and in the increase of the droplet migration velocity in agreement with experimental observations for super-hydrophobic surfaces. Moreover, we perform 3D simulations which are in line with the 2D ones regarding the droplet mobility and also indicate that the contact angle hysteresis may be significantly affected by the directionality of the structures with respect to the droplet motion.

  4. Demonstration of surface plasmons in metal island films and the effect of the surrounding medium-An undergraduate experiment

    NASA Astrophysics Data System (ADS)

    Orfanides, P.; Buckner, T. F.; Buncick, M. C.; Meriaudeau, F.; Ferrell, T. L.

    2000-10-01

    We present a demonstration of the surface plasmon phenomenon as it occurs in thin metal island films. The metal films are deposited on glass microscope slides. The effect of the surface plasmon resonance may be observed visually on the slide without further apparatus. Heating the film changes the shape of the islands and therefore the resonant frequency of the surface plasmon and changes the color of the film. Placing the film in a dielectric medium changes the resonance condition for the surface plasmon again and changes the color again. We show this by coating the slides with commercially available liquids with different indices of refraction. We present a theoretical model that assumes the islands are oblate spheroids. There are enough details given so that the equations can be programed and the theoretical optical absorbance can be reproduced. We also present a modification to the theory so that the shift in resonant frequency can be calculated when the spheroids are immersed in the index fluids. We describe our apparatus for making thin films and our optical spectrometer system. We then present optical absorbance measurements of thin films of both Ag and Au in air and in two liquids with different indices of refraction.

  5. Dynamics of tungsten and cobalt carbonyls on silica surfaces

    NASA Astrophysics Data System (ADS)

    Muthukumar, Kaliappan; Valenti, Roser; Jeschke, Harald O.

    2013-03-01

    Metal carbonyl species adsorbed on a substrate are the starting point for the electron beam induced deposition of metallic nanostructures. We employ first principles molecular dynamics simulations to investigate the dynamics of tungsten hexa- and pentacarbonyl as well as cobalt octacarbonyl precursor molecules on fully and partially hydroxylated silica substrates. We find that physisorbed carbonyls are quite mobile on a silica surface saturated with hydroxy groups, moving around half an Angstrom per picosecond. In contrast, chemisorbed ions like [W(CO)5]- or [Co(CO)4]- are more stable at room temperature. We determine the vibrational spectra which can provide signatures for experimentally distinguishing the form in which precursors cover a substrate.

  6. Dynamic surface tension analysis of dodecyl sulfate association complexes.

    PubMed

    Quigley, W W; Nabi, A; Prazen, B J; Lenghor, N; Grudpan, K; Synovec, R E

    2001-09-13

    First, a novel calibration method is used to expand the current understanding of spherical drop growth and elongation that occurs during on-line measurements of surface pressure using the dynamic surface tension detector (DSTD). Using a novel surface tension calibration method, the drop radius is calculated as a function of time from experimental drop pressure data and compared to the theoretical drop radius calculated from volumetric flow rate. From this comparison, the drop volume at which the drop shape starts to deviate ( approximately 4 mul) from a spherical shape is readily observed and deviates more significantly by approximately 6 mul drop volume (5% deviation in the ideal spherical drop radius) for the capillary sensing tip employed in the DSTD. From this assessment of drop shape, an experimental method for precise drop detachment referred to as pneumatic drop detachment is employed at a drop volume of 2 mul (two second drops at 60 mul/min) in order to provide rapid dynamic surface tension measurements via the novel on-line calibration methodology. Second, the DSTD is used to observe and study kinetic information for surface-active molecules and association complexes adsorbing to an air-liquid drop interface. Dynamic surface tension measurements are made for sodium dodecyl sulfate (SDS) in the absence and presence of either tetra butyl ammonium (TBA) or chromium (III). Sensitive, indirect detection of chromium and other multiply charged metals at low concentrations is also investigated. The DSTD is utilized in examining the dynamic nature of SDS: cation association at the air-liquid interface of a growing drop. Either TBA or Cr(III) were found to substantially enhance the surface tension lowering of dodecyl sulfate (DS), but the surface tension lowering is accompanied by a considerable kinetic dependence. Essentially, the surface tension lowering of these DS: cation complexes is found to be a fairly slow process in the context of the two second DSTD

  7. Application of response surface methodology for optimizing arginine deiminase production medium for Enterococcus faecium sp. GR7.

    PubMed

    Kaur, Baljinder; Kaur, Rajinder

    2013-01-01

    Arginine metabolism in Enterococcus faecium sp. GR7 was enhanced via arginine deiminase pathway. Process parameters including fermentation media and environmental conditions were optimized using independent experiments and response surface methodology (central composite design). Fermentation media (EAPM) were optimized using independent experiments which resulted in 4-fold increase in arginine deiminase specific activity as compared to basal medium. To further enhance arginine deiminase activity in E. faecium sp. GR7 and biomass production including a five-level central composite design (CCD) was employed to study the interactive effect of three-process variables. Response surface methodology suggested a quadratic model which was further validated experimentally where it showed approximately 15-fold increase in arginine metabolism (in terms of arginine deiminase specific activity) over basal medium. By solving the regression equation and analyzing the response surface cartons, optimal concentrations of the media components (g/L) were determined as arginine 20.0; tryptone 15.0; lactose 10.0; K2HPO4 3.0; NaCl 1.0, MnSO4 0.6 mM; Tween 80 1%; pH 6.0 for achieving specific arginine deiminase activity of 4.6 IU/mG with concomitant biomass production of 12.1 mg/L. The model is significant as the coefficient of determination (R (2)) was 0.87 to 0.90 for all responses. Enhanced arginine deiminase yield from E. faecium, a GRAS lactic acid bacterial strain, is desirable to explore in vitro therapeutic potential of the arginine metabolizing E. faecium sp. GR7.

  8. Molecular dynamics study of screening at ionic surfaces

    NASA Astrophysics Data System (ADS)

    Desai, T. G.

    2007-10-01

    Molecular dynamics simulations of NaCl fluid are used to understand the behavior of ionic fluid to screen the field generated by charges on the ionic crystal surfaces in absence of any external electric field. The NaCl fluid in the strongly coupled regime (corresponding to the melt) in contact with the charged octopolar (111) NaCl surface shows that the spatial correlations decay in an oscillatory manner, with a screening length λQ given by the envelope of the damped oscillations. By contrast to the Debye-Huckel theory, in the strongly coupled regime, λQ increases with increasing coupling strength (also seen in bulk ionic simulations). The NaCl fluid confined between neutral (100) NaCl surfaces also shows weak oscillatory charge decay near the surface. Similar oscillatory exponential decay was seen when the NaCl fluid was confined between two analytically smooth neutral walls. The origin of these oscillations was due to the difference in ion sizes. NaCl fluid confined between neutral octopolar (110) and dipolar (110) surface show stronger density oscillations than (100) surface but comparatively very weak charge oscillations. This paper shows that the strength of the charges on the crystal surfaces is enough to induce a characteristic spatial distribution of charges in the contacting fluid and the extent of distribution depends on the type of surface.

  9. Molecular Dynamics Study of Screening at Ionic Surfaces

    SciTech Connect

    T.G. Desai

    2007-10-01

    Molecular-dynamics simulations of NaCl fluid are used to understand the behavior of ionic fluid to screen the field generated by charges on the ionic crystal surfaces in absence of any external electric field. The NaCl fluid in the strongly-coupled regime (corresponding to the melt) in contact with the charged octopolar (111) NaCl surface shows that the spatial correlations decay in an oscillatory manner, with a screening length, ?Q, given by the envelope of the damped oscillations. By contrast to the Debye-Huckel theory, in the strongly-coupled regime, ?Q increases with increasing coupling strength (also seen in bulk ionic simulations). The NaCl fluid confined between neutral (100) NaCl surfaces also shows weak oscillatory charge decay near the surface. Similar oscillatory exponential decay was seen when the NaCl fluid was confined between two analytically smooth neutral walls. The origin of these oscillations was due to the difference in ion sizes. NaCl fluid confined between neutral octopolar (110) and dipolar (110) surface show stronger density oscillations than (100) surface but omparatively very weak charge oscillations. This paper shows that the strength of the charges on the crystal surfaces is enough to induce a characteristic spatial distribution of charges in the contacting fluid and the extent of distribution depends on the type of surface.

  10. The global distribution and dynamics of surface soil moisture

    NASA Astrophysics Data System (ADS)

    McColl, Kaighin A.; Alemohammad, Seyed Hamed; Akbar, Ruzbeh; Konings, Alexandra G.; Yueh, Simon; Entekhabi, Dara

    2017-01-01

    Surface soil moisture has a direct impact on food security, human health and ecosystem function. It also plays a key role in the climate system, and the development and persistence of extreme weather events such as droughts, floods and heatwaves. However, sparse and uneven observations have made it difficult to quantify the global distribution and dynamics of surface soil moisture. Here we introduce a metric of soil moisture memory and use a full year of global observations from NASA's Soil Moisture Active Passive mission to show that surface soil moisture--a storage believed to make up less than 0.001% of the global freshwater budget by volume, and equivalent to an, on average, 8-mm thin layer of water covering all land surfaces--plays a significant role in the water cycle. Specifically, we find that surface soil moisture retains a median 14% of precipitation falling on land after three days. Furthermore, the retained fraction of the surface soil moisture storage after three days is highest over arid regions, and in regions where drainage to groundwater storage is lowest. We conclude that lower groundwater storage in these regions is due not only to lower precipitation, but also to the complex partitioning of the water cycle by the surface soil moisture storage layer at the land surface.

  11. Dynamics of ice nucleation on water repellent surfaces.

    PubMed

    Alizadeh, Azar; Yamada, Masako; Li, Ri; Shang, Wen; Otta, Shourya; Zhong, Sheng; Ge, Liehui; Dhinojwala, Ali; Conway, Ken R; Bahadur, Vaibhav; Vinciquerra, A Joseph; Stephens, Brian; Blohm, Margaret L

    2012-02-14

    Prevention of ice accretion and adhesion on surfaces is relevant to many applications, leading to improved operation safety, increased energy efficiency, and cost reduction. Development of passive nonicing coatings is highly desirable, since current antiicing strategies are energy and cost intensive. Superhydrophobicity has been proposed as a lead passive nonicing strategy, yet the exact mechanism of delayed icing on these surfaces is not clearly understood. In this work, we present an in-depth analysis of ice formation dynamics upon water droplet impact on surfaces with different wettabilities. We experimentally demonstrate that ice nucleation under low-humidity conditions can be delayed through control of surface chemistry and texture. Combining infrared (IR) thermometry and high-speed photography, we observe that the reduction of water-surface contact area on superhydrophobic surfaces plays a dual role in delaying nucleation: first by reducing heat transfer and second by reducing the probability of heterogeneous nucleation at the water-substrate interface. This work also includes an analysis (based on classical nucleation theory) to estimate various homogeneous and heterogeneous nucleation rates in icing situations. The key finding is that ice nucleation delay on superhydrophobic surfaces is more prominent at moderate degrees of supercooling, while closer to the homogeneous nucleation temperature, bulk and air-water interface nucleation effects become equally important. The study presented here offers a comprehensive perspective on the efficacy of textured surfaces for nonicing applications.

  12. Experimental study of the dynamics of penetration of a solid body into a soil medium

    NASA Astrophysics Data System (ADS)

    Balandin, Vl. V.; Balandin, Vl. Vl.; Bragov, A. M.; Kotov, V. L.

    2016-06-01

    An experimental system is developed to determine the main parameters of the impact and penetration of a solid deformable body into a soft soil medium. This system is based on the technique of an inverse experiment with a measuring rod and the technique of a direct experiment with photo recording and the application of a shadow picture of the interaction of a striker with a soil target. To verify these techniques, the collision of a solid body with soil is studied by a numerical calculation and the time intervals in which the change of the resistance force is proportional to the penetration velocity squared are determined. The penetration resistance coefficients determined in direct and inverse experiments are shown to agree with each other in the collision velocity range 80-400 m/s, which supports the validity of the techniques and the reliability of measuring the total load.

  13. Fluid-particle dynamics for passive tracers advected by a thermally fluctuating viscoelastic medium

    NASA Astrophysics Data System (ADS)

    Hohenegger, Christel; McKinley, Scott A.

    2017-07-01

    Many biological fluids, like mucus and cytoplasm, have prominent viscoelastic properties. As a consequence, immersed particles exhibit subdiffusive behavior, which is to say, the variance of the particle displacement grows sublinearly with time. In this work, we propose a viscoelastic generalization of the Landau-Lifschitz Navier-Stokes fluid model and investigate the properties of particles that are passively advected by such a medium. We exploit certain exact formulations that arise from the Gaussian nature of the fluid model and introduce analysis of memory in the fluid statistics, marking an important step toward capturing fluctuating hydrodynamics among subdiffusive particles. The proposed method is spectral, meshless and is based on the numerical evaluation of the covariance matrix associated with individual fluid modes. With this method, we probe a central hypothesis of passive microrheology, a field premised on the idea that the statistics of particle trajectories can reveal fundamental information about their surrounding fluid environment.

  14. Bouncing dynamics of impact droplets on the convex superhydrophobic surfaces

    NASA Astrophysics Data System (ADS)

    Shen, Yizhou; Liu, Senyun; Zhu, Chunling; Tao, Jie; Chen, Zhong; Tao, Haijun; Pan, Lei; Wang, Guanyu; Wang, Tao

    2017-05-01

    Bouncing dynamics of impact droplets on solid surfaces intensively appeal to researchers due to the importance in many industrial fields. Here, we found that droplets impacting onto dome convex superhydrophobic surfaces could rapidly bounce off with a 28.5% reduction in the contact time, compared with that on flat superhydrophobic surfaces. This is mainly determined by the retracting process of impact droplets. Under the action of dome convexity, the impact droplet gradually evolves into an annulus shape with a special hydrodynamic distribution. As a consequence, both the inner and external rims of the annulus shape droplet possess a higher retracting velocity under the actions of the inertia force and the surface energy change, respectively. Also, the numerical simulation provides a quantitative evidence to further verify the interpretation on the regimes behind the rapidly detached phenomenon of impact droplets.

  15. Molecular Dynamic Simulations on Surface Tension of Methanol

    NASA Astrophysics Data System (ADS)

    Obeidat, Abdalla

    2015-04-01

    Molecular dynamic simulations have been performed to study the surface tension of methanol at low temperatures. Six different models of methanol have been studied to compute the surface tension of different models. The models have been used to predict the surface tensions are: OPLS, Gromos 96, H1, J1, J2, and van Leeuwen model. Our results show that the most accurate model compared to true methanol was van Leeuwen model. The results were fitted to a straight line to predict other data of surface tension at specific temperature. The simulation were performed using the Gromacs package at temperatures: 200, 210, 220, 230, 240, 250, 260, 270, 280, 290, and 300 K. This work is supported by JUST.

  16. Influence of chemistry on wetting dynamics of nanotextured hydrophobic surfaces.

    PubMed

    Di Mundo, Rosa; Palumbo, Fabio; d'Agostino, Riccardo

    2010-04-06

    In this work, the role of a chemical parameter, such as the degree of fluorination, on the wetting behavior of nanotextured hydrophobic surfaces is investigated. Texture and chemistry tuning of the surfaces has been accomplished with single batch radiofrequency low-pressure plasma processes. Polystyrene substrates have been textured by CF(4) plasma etching and subsequently covered by thin films with a tunable F-to-C ratio, obtained in discharges fed with C(4)F(8)-C(2)H(4). Measurements of wetting dynamics reveal a regime transition from adhesive-hydrophobic to slippery-superhydrophobic, i.e., from wet to non wet states, as the F-to-C rises at constant topography. Such achievements are strengthened by calculation of the solid fraction of surface water contact area applying Cassie-Baxter advancing and receding equations to water contact angle data of textured and flat reference surfaces.

  17. Inhibition of Bacterial Pathogens in Medium and on Spinach Leaf Surfaces using Plant-Derived Antimicrobials Loaded in Surfactant Micelles.

    PubMed

    Ruengvisesh, Songsirin; Loquercio, Andre; Castell-Perez, Elena; Taylor, T Matthew

    2015-11-01

    Encapsulation of hydrophobic plant essential oil components (EOC) into surfactant micelles can assist the decontamination of fresh produce surfaces from bacterial pathogens during postharvest washing. Loading of eugenol and carvacrol into surfactant micelles of polysorbate 20 (Tween 20), Surfynol® 485W, sodium dodecyl sulfate (SDS), and CytoGuard® LA 20 (CG20) was determined by identification of the EOC/surfactant-specific maximum additive concentration (MAC). Rheological behavior of dilute EOC-containing micelles was then tested to determine micelle tolerance to shearing. Antimicrobial efficacy of EOC micelles against Escherichia coli O157:H7 and Salmonella enterica serotype Saintpaul was first evaluated by the minimum inhibitory concentration (MIC) and minimum bactericidal concentration (MBC). Pathogen-inoculated spinach was treated with eugenol-containing micelles applied via spraying or immersion methods. SDS micelles produced the highest MACs for EOCs, while Tween 20 loaded the lowest amount of EOCs. Micelles demonstrated Newtonian behavior in response to shearing. SDS and CG20-derived micelles containing EOCs produced the lowest MICs and MBCs for pathogens. E. coli O157:H7 and S. Saintpaul were reduced on spinach surfaces by application of eugenol micelles, though no differences in numbers of surviving pathogens were observed when methods of antimicrobial micelle application (spraying, immersion) was compared (P ≥ 0.05). Data suggest eugenol in SDS and CG20 micelles may be useful for produce surface decontamination from bacterial pathogens during postharvest washing. Antimicrobial essential oil component (EOC)-containing micelles assist the delivery of natural food antimicrobials to food surfaces, including fresh produce, for decontamination of microbial foodborne pathogens. Antimicrobial EOC-loaded micelles were able to inhibit the enteric pathogens Escherichia coli O157:H7 and Salmonella Saintpaul in liquid medium and on spinach surfaces. However

  18. BDNF contributes to both rapid and homeostatic alterations in AMPA receptor surface expression in nucleus accumbens medium spiny neurons

    PubMed Central

    Reimers, Jeremy M.; Loweth, Jessica A.; Wolf, Marina E.

    2015-01-01

    Brain-derived neurotrophic factor (BDNF) plays a critical role in plasticity at glutamate synapses and the effects of repeated cocaine exposure. We recently showed that intracranial injection of BDNF into the rat nucleus accumbens (NAc), a key region for cocaine addiction, rapidly increases AMPA receptor (AMPAR) surface expression. To further characterize BDNF’s role in both rapid AMPAR trafficking and slower, homeostatic changes in AMPAR surface expression, we investigated the effects of acute (30 min) and long-term (24 h) treatment with BDNF on AMPAR distribution in NAc medium spiny neurons from postnatal rats co-cultured with mouse prefrontal cortex (PFC) neurons to restore excitatory inputs. Immunocytochemical studies showed that acute BDNF treatment increased cell surface GluA1 and GluA2 levels, as well as their co-localization, on NAc neurons. This effect of BDNF, confirmed using a protein crosslinking assay, was dependent on ERK but not AKT signaling. In contrast, long-term BDNF treatment decreased AMPAR surface expression on NAc neurons. Based on this latter result, we tested the hypothesis that BDNF plays a role in AMPAR “scaling down” in response to a prolonged increase in neuronal activity produced by bicuculline (24 h). Supporting this hypothesis, decreasing BDNF signaling with the extracellular BDNF scavenger TrkB-Fc prevented the scaling down of GluA1 and GluA2 surface levels in NAc neurons normally produced by bicuculline. In conclusion, BDNF exerts bidirectional effects on NAc AMPAR surface expression, depending on duration of exposure. Furthermore, BDNF’s involvement in synaptic scaling in the NAc differs from its previously described role in the visual cortex. PMID:24712995

  19. Dynamic Imaging of Surface Motion with a Stereo Borescope

    SciTech Connect

    Michael Berninger, Stuart Baker

    2008-12-11

    A new stereo borescope has been investigated that would provide a time-resolved calibrated method of recording the motion and deformation of a three-dimensional (3-D) surface during explosively driven dynamic shock experiments at the Nevada Test Site. In these experiments, geometries would likely prove to be incompatible with conventional direct optical systems. Single line-of-sight borescopes lack adequate depth-of-field for quantitative imaging of the 3-D surface. To improve depth-of-field and provide time resolution, a stereo borescope has been fabricated for use with a nine-frame framing camera. At one end, stereo optics couple light from the dynamic surface into a pair of flexible 1-mm-diameter correlated fiber-optic bundles. At the other end, small-format lenses (~3 mm) interface with the framing camera, which is set up to simultaneously record the separate-perspective views. All nine frames could be recorded in a period as short as 1.8 μs, and spatial resolution is optimized to 11 line-pairs per mm. To achieve pseudo 3-D depth perception, photogrammetric analysis has been demonstrated with commercial software from ADAM technology (Australia). This paper presents the results from time-resolved stereo images of dynamic surfaces collected in a series of high-explosives experiments at the National Security Technologies, LLC, “Boom Box” in Santa Barbara, CA. Experience with the stereo borescope has suggested other potentially useful stereoscopic applications, such as stereo viewing of moving surfaces on the interiors of engines and the heating of moving components, and the viewing material deposition on interior surfaces during machine operations and fabrication processes.

  20. Comparative surface dynamics of amorphous and semicrystalline polymer films

    PubMed Central

    Becker, James S.; Brown, Ryan D.; Killelea, Daniel R.; Yuan, Hanqiu; Sibener, S. J.

    2011-01-01

    The surface dynamics of amorphous and semicrystalline polymer films have been measured using helium atom scattering. Time-of-flight data were collected to resolve the elastic and inelastic scattering components in the diffuse scattering of neutral helium atoms from the surface of a thin poly(ethylene terephthalate) film. Debye–Waller attenuation was observed for both the amorphous and semicrystalline phases of the polymer by recording the decay of elastically scattered helium atoms with increasing surface temperature. Thermal attenuation measurements in the specular scattering geometry yielded perpendicular mean-square displacements of 2.7•10-4 Å2 K-1 and 3.1•10-4 Å2 K-1 for the amorphous and semicrystalline surfaces, respectively. The semicrystalline surface was consistently ∼15% softer than the amorphous across a variety of perpendicular momentum transfers. The Debye–Waller factors were also measured at off-specular angles to characterize the parallel mean-square displacements, which were found to increase by an order of magnitude over the perpendicular mean-square displacements for both surfaces. In contrast to the perpendicular motion, the semicrystalline state was ∼25% stiffer than the amorphous phase in the surface plane. These results were uniquely accessed through low-energy neutral helium atom scattering due to the highly surface-sensitive and nonperturbative nature of these interactions. The goal of tailoring the chemical and physical properties of complex advanced materials requires an improved understanding of interfacial dynamics, information that is obtainable through atomic beam scattering methods. PMID:20713734

  1. Modeling apple surface temperature dynamics based on weather data.

    PubMed

    Li, Lei; Peters, Troy; Zhang, Qin; Zhang, Jingjin; Huang, Danfeng

    2014-10-27

    The exposure of fruit surfaces to direct sunlight during the summer months can result in sunburn damage. Losses due to sunburn damage are a major economic problem when marketing fresh apples. The objective of this study was to develop and validate a model for simulating fruit surface temperature (FST) dynamics based on energy balance and measured weather data. A series of weather data (air temperature, humidity, solar radiation, and wind speed) was recorded for seven hours between 11:00-18:00 for two months at fifteen minute intervals. To validate the model, the FSTs of "Fuji" apples were monitored using an infrared camera in a natural orchard environment. The FST dynamics were measured using a series of thermal images. For the apples that were completely exposed to the sun, the RMSE of the model for estimating FST was less than 2.0 °C. A sensitivity analysis of the emissivity of the apple surface and the conductance of the fruit surface to water vapour showed that accurate estimations of the apple surface emissivity were important for the model. The validation results showed that the model was capable of accurately describing the thermal performances of apples under different solar radiation intensities. Thus, this model could be used to more accurately estimate the FST relative to estimates that only consider the air temperature. In addition, this model provides useful information for sunburn protection management.

  2. Adsorption dynamics of molecular nitrogen at an Fe(111) surface.

    PubMed

    Nosir, M A; Martin-Gondre, L; Bocan, G A; Díez Muiño, R

    2017-03-08

    We present an extensive theoretical study of N2 adsorption mechanisms on an Fe(111) surface. We combine the static analysis of a six-dimensional potential energy surface (6D-PES), based on ab initio density functional theory (DFT) calculations for the system, with quasi-classical trajectory (QCT) calculations to simulate the adsorption dynamics. There are four molecular adsorption states, usually called γ, δ, α, and ε, arising from our DFT calculations. We find that N2 adsorption in the γ-state is non-activated, while the threshold energy is associated with the entrance channel for the other three adsorption states. Our QCT calculations confirm that there are activated and nonactivated paths for the adsorption of N2 on the Fe(111) surface, which is in agreement with previous experimental investigations. Molecular dynamics at a surface temperature Ts = 300 K and impact energies Ei in the 0-5 eV range show the relative occupancy of the γ, δ, α, and ε states. The δ-state, however, is only marginally populated despite its adsorption energy being very similar to that of the γ-state. Our QCT calculations trace the dependence of molecular trapping on the surface temperature Ts and initial impact energy Ei and quantify the rates of the different competitive channels that eventually lead to molecular adsorption.

  3. Dissociative adsorption dynamics of nitrogen on a Fe(111) surface.

    PubMed

    Nosir, M A; Martin-Gondre, L; Bocan, G A; Díez Muiño, R

    2017-09-20

    We study the dissociative adsorption dynamics of N2 on clean bcc Fe(111) surfaces. We base our theoretical analysis on a multidimensional potential energy surface built from density functional theory. The dissociative sticking probability is computed by means of quasi-classical trajectory calculations. For normal incidence and impact energies of the order of a few eV, our theoretical results agree well with existing experimental values. For these energies, the dynamics of the dissociated molecules shows that dissociation is a direct process that follows narrow paths in the multidimensional space. For lower energies of the beam, this direct process is not enough to explain the measured values. A better agreement with the experiment is obtained if we increase the surface temperature to promote the transfer to dissociation of molecules previously trapped. Most of the molecules dissociate very close to the Fe(111) third layer atoms and with an orientation parallel to the surface. A comparison between the dissociation of N2 on Fe(111) and Fe(110) highlights the role of the different energy barriers in both surfaces.

  4. Modeling Apple Surface Temperature Dynamics Based on Weather Data

    PubMed Central

    Li, Lei; Peters, Troy; Zhang, Qin; Zhang, Jingjin; Huang, Danfeng

    2014-01-01

    The exposure of fruit surfaces to direct sunlight during the summer months can result in sunburn damage. Losses due to sunburn damage are a major economic problem when marketing fresh apples. The objective of this study was to develop and validate a model for simulating fruit surface temperature (FST) dynamics based on energy balance and measured weather data. A series of weather data (air temperature, humidity, solar radiation, and wind speed) was recorded for seven hours between 11:00–18:00 for two months at fifteen minute intervals. To validate the model, the FSTs of “Fuji” apples were monitored using an infrared camera in a natural orchard environment. The FST dynamics were measured using a series of thermal images. For the apples that were completely exposed to the sun, the RMSE of the model for estimating FST was less than 2.0 °C. A sensitivity analysis of the emissivity of the apple surface and the conductance of the fruit surface to water vapour showed that accurate estimations of the apple surface emissivity were important for the model. The validation results showed that the model was capable of accurately describing the thermal performances of apples under different solar radiation intensities. Thus, this model could be used to more accurately estimate the FST relative to estimates that only consider the air temperature. In addition, this model provides useful information for sunburn protection management. PMID:25350507

  5. Planation surfaces as a record of medium to large wavelength deformation: the example of the Lake Albert Rift (Uganda) on the East African Dome

    NASA Astrophysics Data System (ADS)

    Brendan, Simon; François, Guillocheau; Cécile, Robin; Jean, Braun; Olivier, Dauteuil; Massimo, Dall'Asta

    2016-04-01

    African relief is characterized by planation surfaces, some of them of continental scale. These surfaces are slightly deformed according to different wavelengths (x10 km; x100 km, x1000 km) which record both mantle dynamics (very long wavelength, x 1000 km) and lithosphere deformation (long wavelength deformation, x 100 km). Different types of these planation surfaces are recognized: - Etchplains capped by iron-duricrust which correspond to erosional nearly flat weathered surfaces resulting from the growth of laterites under warm and humid conditions. - Pediments which define mechanical erosional surfaces with concave or rectilinear profiles delimited by upslope scarps connected upstream with the upper landforms. We here focused on the Lake Albert Rift at the northern termination of the western branch of the East African Rift System of which the two branches are surimposed on the East-African Dome. Different wavelengths of deformation were characterized based on the 3D mapping of stepped planation surfaces: (1) very long wavelength deformations resulting from the uplift of the East African Dome; (2) long wavelength deformations resulting from the opening of the eastern branch and (3) medium wavelength deformations represented by the uplift of rift shoulders like the Rwenzori Mountains. The paleo-landscape reconstruction of Uganda shows the existence of four generations of landforms dated according to their geometrical relationships with volcanic rocks. A four stepped evolution of the Ugandan landforms is proposed: • 70 - 22 Ma: generation of two weathered planation surfaces (etchplain Uw and Iw). The upper one (Uw) records a very humid period culminating at time of the Early Eocene Climatic Optimum (70-45 Ma). It corresponds to the African Surface. A first uplift of the East African Dome generates a second lower planation surface (Iw) connected to the Atlantic Ocean base level; • 17-2.7 Ma: planation of large pediplains connected to the local base level induced

  6. Helium atom surface scattering apparatus for studies of crystalline surface dynamics

    NASA Astrophysics Data System (ADS)

    Safron, S. A.; Skofronick, J. G.

    The primary goal of this grant was the construction of a state-of-the-art He atom-surface spectroscopy (HASS) scattering instrument capable of determining both structure and dynamics of metal, insulator and semiconductor surfaces. The method measures the elastic and inelastic scattering of He atoms from the crystal surface as a function of angle and energy gains or losses. The project was begun on May 1, 1985, and this report covers the progress from inception to present. The nozzle beam has been characterized, both before and after scattering from a LiF crystal surface, and angular distributions from this surface have also been taken. In addition to the specular and Bragg peaks, fine structure between the peaks is shown to be due to various inelastic collision processes reported previously. Current efforts are to measure the inelastic processes by time-of-flight methods so as to repeat the previous surface dispersion measurements.

  7. Binaries Traveling through a Gaseous Medium: Dynamical Drag Forces and Internal Torques

    NASA Astrophysics Data System (ADS)

    Sánchez-Salcedo, F. J.; Chametla, Raul O.

    2014-10-01

    Using time-dependent linear theory, we investigate the morphology of the gravitational wake induced by a binary, whose center of mass moves at velocity {\\boldsymbol {V}}_cm against a uniform background of gas. For simplicity, we assume that the components of the binary are on circular orbits about their common center of mass. The consequences of dynamical friction is twofold. First, gas dynamical friction may drag the center of mass of the binary and cause the binary to migrate. Second, drag forces also induce a braking torque, which causes the orbits of the components of the binary to shrink. We compute the drag forces acting on one component of the binary due to the gravitational interaction with its own wake. We show that the dynamical friction force responsible for decelerating the center of mass of the binary is smaller than it is in the point-mass case because of the loss of gravitational focusing. We show that the braking internal torque depends on the Mach numbers of each binary component about their center of mass, and also on the Mach number of the center of mass of the binary. In general, the internal torque decreases with increasing the velocity of the binary relative to the ambient gas cloud. However, this is not always the case. We also mention the relevance of our results to the period distribution of binaries.

  8. Binaries traveling through a gaseous medium: dynamical drag forces and internal torques

    SciTech Connect

    Sánchez-Salcedo, F. J.; Chametla, Raul O.

    2014-10-20

    Using time-dependent linear theory, we investigate the morphology of the gravitational wake induced by a binary, whose center of mass moves at velocity V{sub cm} against a uniform background of gas. For simplicity, we assume that the components of the binary are on circular orbits about their common center of mass. The consequences of dynamical friction is twofold. First, gas dynamical friction may drag the center of mass of the binary and cause the binary to migrate. Second, drag forces also induce a braking torque, which causes the orbits of the components of the binary to shrink. We compute the drag forces acting on one component of the binary due to the gravitational interaction with its own wake. We show that the dynamical friction force responsible for decelerating the center of mass of the binary is smaller than it is in the point-mass case because of the loss of gravitational focusing. We show that the braking internal torque depends on the Mach numbers of each binary component about their center of mass, and also on the Mach number of the center of mass of the binary. In general, the internal torque decreases with increasing the velocity of the binary relative to the ambient gas cloud. However, this is not always the case. We also mention the relevance of our results to the period distribution of binaries.

  9. Digital image multiplexing/demultiplexing method using spatial spectral diffusion and virtual phase conjugation technique for reduction of dynamic range consumption in holographic medium

    NASA Astrophysics Data System (ADS)

    Goto, Yuta; Okamoto, Atsushi; Takabayashi, Masanori; Ogawa, Kazuhisa; Tomita, Akihisa

    2017-09-01

    The recording density in holographic data storage (HDS) systems is determined by the dynamic range of the recording medium. If a hologram is recorded with a small exposure, the consumption amount of the dynamic range per hologram is reduced, and the recording density can be improved. In this report, we propose a digital image multiplexing/demultiplexing method using spatial spectral diffusion and a virtual phase conjugation technique to reduce the consumption amount of the dynamic range in a recording medium. In our method, multiple signals are simultaneously recorded in a medium by multiplexing those signals using a beam combiner before recording, unlike the general multiplexing method of HDS. Then, each original signal can be reproduced independently by utilizing the property of a random diffuser and a phase-conjugated light. In the simulation, we confirmed that our method can improve the recording density because the consumption of the dynamic range is reduced.

  10. Surface hopping investigation of the relaxation dynamics in radical cations

    NASA Astrophysics Data System (ADS)

    Assmann, Mariana; Weinacht, Thomas; Matsika, Spiridoula

    2016-01-01

    Ionization processes can lead to the formation of radical cations with population in several ionic states. In this study, we examine the dynamics of three radical cations starting from an excited ionic state using trajectory surface hopping dynamics in combination with multiconfigurational electronic structure methods. The efficiency of relaxation to the ground state is examined in an effort to understand better whether fragmentation of cations is likely to occur directly on excited states or after relaxation to the ground state. The results on cyclohexadiene, hexatriene, and uracil indicate that relaxation to the ground ionic state is very fast in these systems, while fragmentation before relaxation is rare. Ultrafast relaxation is facilitated by the close proximity of electronic states and the presence of two- and three-state conical intersections. Examining the properties of the systems in the Franck-Condon region can give some insight into the subsequent dynamics.

  11. Surface hopping investigation of the relaxation dynamics in radical cations

    SciTech Connect

    Assmann, Mariana; Matsika, Spiridoula; Weinacht, Thomas

    2016-01-21

    Ionization processes can lead to the formation of radical cations with population in several ionic states. In this study, we examine the dynamics of three radical cations starting from an excited ionic state using trajectory surface hopping dynamics in combination with multiconfigurational electronic structure methods. The efficiency of relaxation to the ground state is examined in an effort to understand better whether fragmentation of cations is likely to occur directly on excited states or after relaxation to the ground state. The results on cyclohexadiene, hexatriene, and uracil indicate that relaxation to the ground ionic state is very fast in these systems, while fragmentation before relaxation is rare. Ultrafast relaxation is facilitated by the close proximity of electronic states and the presence of two- and three-state conical intersections. Examining the properties of the systems in the Franck-Condon region can give some insight into the subsequent dynamics.

  12. Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurements

    DTIC Science & Technology

    2013-09-30

    Radiometric Measurements Dick K.P. Yue Center for Ocean Engineering Massachusetts Institute of Technology Room 5-321 77 Massachusetts Ave...comply with a collection of information if it does not display a currently valid OMB control number. 1. REPORT DATE 30 SEP 2013 2. REPORT TYPE 3. DATES ...COVERED 00-00-2013 to 00-00-2013 4. TITLE AND SUBTITLE Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurements 5a

  13. Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurement

    DTIC Science & Technology

    2013-09-30

    Radiometric Measurement Lian Shen Department of Mechanical Engineering & St. Anthony Falls Laboratory University of Minnesota Minneapolis, MN...information if it does not display a currently valid OMB control number. 1. REPORT DATE 30 SEP 2013 2. REPORT TYPE 3. DATES COVERED 00-00-2013 to 00-00...2013 4. TITLE AND SUBTITLE Quantifying the Dynamic Ocean Surface Using Underwater Radiometric Measurement 5a. CONTRACT NUMBER 5b. GRANT NUMBER

  14. Sodium diffusion through amorphous silica surfaces: a molecular dynamics study.

    PubMed

    Rarivomanantsoa, Michaël; Jund, Philippe; Jullien, Rémi

    2004-03-08

    We have studied the diffusion inside the silica network of sodium atoms initially located outside the surfaces of an amorphous silica film. We have focused our attention on structural and dynamical quantities, and we have found that the local environment of the sodium atoms is close to the local environment of the sodium atoms inside bulk sodo-silicate glasses obtained by quench. This is in agreement with recent experimental results.

  15. Dynamic optometer. [for electronic recording of human lens anterior surface

    NASA Technical Reports Server (NTRS)

    Wilson, D. C.

    1974-01-01

    A dynamic optometer that electronically records the position of the anterior surface of the human lens is described. The geometrical optics of the eye and optometer, and the scattering of light from the lens, are closely examined to determine the optimum conditions for adjustment of the instrument. The light detector and associated electronics are also considered, and the operating conditions for obtaining the best signal-to-noise ratio are determined.

  16. Medium optimization of antifungal lipopeptide, iturin A, production by Bacillus subtilis in solid-state fermentation by response surface methodology.

    PubMed

    Mizumoto, Shinji; Shoda, Makoto

    2007-08-01

    Iturin A, a lipopeptide antibiotic produced by Bacillus subtilis RB14-CS, suppresses the growth of various plant pathogens. Here, enhancement of iturin A production in solid-state fermentation (SSF) on okara, a soybean curd residue produced during tofu manufacturing, was accomplished using statistical experimental design. Primary experiments showed that the concentrations of carbon and nitrogen sources were the main factors capable of enhancing iturin A production, whereas initial pH, initial water content, temperature, relative humidity, and volume of inoculum were only minor factors. Glucose and soybean meal were the most effective among tested carbon and nitrogen sources, respectively. Based on these preliminary findings, response surface methodology was applied to predict the optimum amounts of the carbon and nitrogen sources in the medium. The maximum iturin A concentration was 5,591 mug/g initial wet okara under optimized condition. Subsequent experiments confirmed that iturin A production was significantly improved under the predicted optimal medium conditions. The SSF product generated under the optimized conditions exhibited significantly higher suppressive effect on the damping-off of tomato caused by Rhizoctonia solani K-1 compared with the product generated under the non-optimized conditions.

  17. Dynamic Melting of Freezing Droplets on Ultraslippery Superhydrophobic Surfaces.

    PubMed

    Chu, Fuqiang; Wu, Xiaomin; Wang, Lingli

    2017-03-08

    Condensed droplet freezing and freezing droplet melting phenomena on the prepared ultraslippery superhydrophobic surface were observed and discussed in this study. Although the freezing delay performance of the surface is common, the melting of the freezing droplets on the surface is quite interesting. Three self-propelled movements of the melting droplets (ice- water mixture) were found including the droplet rotating, the droplet jumping, and the droplet sliding. The melting droplet rotating, which means that the melting droplet rotates spontaneously on the superhydrophobic surface like a spinning top, is first reported in this study and may have some potential applications in various engineering fields. The melting droplet jumping and sliding are similar to those occurring during condensation but have larger size scale and motion scale, as the melting droplets have extra-large specific surface area with much more surface energy available. These self-propelled movements make all the melting droplets on the superhydrophobic surface dynamic, easily removed, which may be promising for the anti-icing/frosting applications.

  18. On the dynamics of homogeneous turbulence near a surface

    NASA Astrophysics Data System (ADS)

    Flores, Oscar; Riley, James J.

    2011-11-01

    It is becoming increasing clear that stably-stratified flows can support a stratified turbulence k - 5 / 3 inertial range, different from Kolmogorov's. Stratification inhibits vertical motions, but the large-scale quasi-horizontal motions produce strong vertical shearing and small-scale instabilities. The result is a k - 5 / 3 horizontal spectrum for the horizontal velocities at scales larger than the Ozmidov scale, the largest scale that can overturn. For smaller scales, the classical Kolmogorov k - 5 / 3 applies. Inspired by data taken near the water surface in a tidal river, we here explore to what extent the dynamics of the nonlinear spectral energy transfer of near-surface turbulence with no mean shear (i.e., horizontally isotropic turbulence bounded by free-slip and no-slip surfaces) is analogous to stably stratified turbulence. To that end, we perform DNS of decaying isotropic turbulence with Reλ ~ 100 , but bounded by a non-slip surface and a free slip surface. The behavior of the flow near the free-slip surface is similar to stratified turbulence, with a tentative k - 5 / 3 range, but the same is not true for the no-slip surface at the present Reynolds numbers. This research was supported by ARO and NSF. Chickadel et al. (2011) to appear in IEEE Geosci. Remote Sens. Lett.

  19. Water at DNA surfaces: Ultrafast dynamics in minor groove recognition

    PubMed Central

    Pal, Samir Kumar; Zhao, Liang; Zewail, Ahmed H.

    2003-01-01

    Water molecules at the surface of DNA are critical to its equilibrium structure, DNA–protein function, and DNA–ligand recognition. Here we report direct probing of the dynamics of hydration, with femtosecond resolution, at the surface of a DNA dodecamer duplex whose native structure remains unperturbed on recognition in minor groove binding with the bisbenzimide drug (Hoechst 33258). By following the temporal evolution of fluorescence, we observed two well separated hydration times, 1.4 and 19 ps, whereas in bulk water the same drug is hydrated with time constants of 0.2 and 1.2 ps. For comparison, we also studied calf thymus DNA for which the hydration exhibits similar time scales to that of dodecamer DNA. However, the time-resolved polarization anisotropy is very different for the two types of DNA and clearly elucidates the rigidity in drug binding and difference in DNA rotational motions. These results demonstrate that hydration at the surface of the groove is a dynamical process with two general types of trajectories; the slowest of them (≈20 ps) are those describing dynamically ordered water. Because of their ultrafast time scale, the “ordered” water molecules are the most weakly bound and are accordingly involved in the entropic (hydration/dehydration) process of recognition. PMID:12815094

  20. A Method for Molecular Dynamics on Curved Surfaces

    PubMed Central

    Paquay, Stefan; Kusters, Remy

    2016-01-01

    Dynamics simulations of constrained particles can greatly aid in understanding the temporal and spatial evolution of biological processes such as lateral transport along membranes and self-assembly of viruses. Most theoretical efforts in the field of diffusive transport have focused on solving the diffusion equation on curved surfaces, for which it is not tractable to incorporate particle interactions even though these play a crucial role in crowded systems. We show here that it is possible to take such interactions into account by combining standard constraint algorithms with the classical velocity Verlet scheme to perform molecular dynamics simulations of particles constrained to an arbitrarily curved surface. Furthermore, unlike Brownian dynamics schemes in local coordinates, our method is based on Cartesian coordinates, allowing for the reuse of many other standard tools without modifications, including parallelization through domain decomposition. We show that by applying the schemes to the Langevin equation for various surfaces, we obtain confined Brownian motion, which has direct applications to many biological and physical problems. Finally we present two practical examples that highlight the applicability of the method: 1) the influence of crowding and shape on the lateral diffusion of proteins in curved membranes; and 2) the self-assembly of a coarse-grained virus capsid protein model. PMID:27028633

  1. The European Continent : Surface Expression of Upper Mantle Dynamics

    NASA Astrophysics Data System (ADS)

    Tondi, M. R.; Schivardi, R.; Molinari, I.; Morelli, A.

    2012-12-01

    The surface topography of Europe shows important variations, most of which are relatively well explained by isostatic compensation of density contrasts within the crust and lithosphere. However, not all of the density contrasts leading to topography reside within the lithosphere. The crucial problem is how to detect the extra topography signal, in addition to that associated with both crustal and lithospheric anomalies. Forte and Perry, 2000 estimate the amplitude of the dynamic topography by removal of the crustal isostatic topography signal from the surface of the Earth. Faccenna and Becker, 2010 infer the equivalent dynamic topography from the normal stress generated at the surface by mantle viscous flow driven by thermal anomalies. Here we consider the correlation between residual topography and mantle residual gravity anomalies. As shown by Pekeris, 1935 and Hager et al., 1985, the viscous mantle flow that is driven by the thermal density contrasts is responsible for the long-wavelength gravity anomalies observed at the surface. They have demonstrated that the gravitational effects of surface deformation caused by the flow is opposite in sign and comparable in magnitude to that of the driving density contrast. The 1°x1° recently assembled European crustal model, EPCrust (Molinari and Morelli, 2011) is used to estimate the effects of the isostatic crust and the mantle residual gravity anomalies. We calculate the correlation matrix between the residual topography and the mantle residual gravity anomalies and we define the regions where the sublithospheric mantle density, below the European continent, contributes to surface topography. To recover the residual topography, the effects of the isostatic crust is estimated with the Panasyuk and Hager (2000) algorithm and subtracted from the observed elevation (ETOPO-1). The mantle residual gravity anomalies are estimated as the differences between the produced gravity field of EPCrust and the observations. 3-D

  2. Ab initio molecular dynamics simulations of the adsorption of H2 on palladium surfaces.

    PubMed

    Gross, Axel

    2010-05-17

    The interaction of hydrogen with palladium surfaces represents a model system for the study of the adsorption and absorption at metal surfaces. Theoretical gas-surface dynamics studies have usually concentrated on the adsorption dynamics on clean surfaces. Only recently has it become possible, based on advances in electronic structure codes and improvements in computer power, to address the much more complex problem of the adsorption dynamics on precovered surfaces. Herein, recent ab initio molecular dynamics studies are discussed that address the adsorption dynamics of hydrogen molecules on hydrogen- and sulfur-precovered Pd surfaces. In addition, the relaxation dynamics of the hydrogen atoms after the dissociation on clean Pd(100) are presented.

  3. Observation of dynamic water microadsorption on Au surface

    SciTech Connect

    Huang, Xiaokang Gupta, Gaurav; Gao, Weixiang; Tran, Van; Nguyen, Bang; McCormick, Eric; Cui, Yongjie; Yang, Yinbao; Hall, Craig; Isom, Harold

    2014-05-15

    Experimental and theoretical research on water wettability, adsorption, and condensation on solid surfaces has been ongoing for many decades because of the availability of new materials, new detection and measurement techniques, novel applications, and different scales of dimensions. Au is a metal of special interest because it is chemically inert, has a high surface energy, is highly conductive, and has a relatively high melting point. It has wide applications in semiconductor integrated circuitry, microelectromechanical systems, microfluidics, biochips, jewelry, coinage, and even dental restoration. Therefore, its surface condition, wettability, wear resistance, lubrication, and friction attract a lot of attention from both scientists and engineers. In this paper, the authors experimentally investigated Au{sub 2}O{sub 3} growth, wettability, roughness, and adsorption utilizing atomic force microscopy, scanning electron microscopy, reflectance spectrometry, and contact angle measurement. Samples were made using a GaAs substrate. Utilizing a super-hydrophilic Au surface and the proper surface conditions of the surrounding GaAs, dynamic microadsorption of water on the Au surface was observed in a clean room environment. The Au surface area can be as small as 12 μm{sup 2}. The adsorbed water was collected by the GaAs groove structure and then redistributed around the structure. A model was developed to qualitatively describe the dynamic microadsorption process. The effective adsorption rate was estimated by modeling and experimental data. Devices for moisture collection and a liquid channel can be made by properly arranging the wettabilities or contact angles of different materials. These novel devices will be very useful in microfluid applications or biochips.

  4. Study of the interaction of inorganic and organic compounds of cell culture medium with a Ti surface.

    PubMed

    Burgos-Asperilla, L; García-Alonso, M C; Escudero, M L; Alonso, C

    2010-02-01

    The interaction between Ti and each component of Dulbecco's modified Eagle's medium was studied in depth using different techniques, such as the measurement of the corrosion potential, electrochemical impedance spectroscopy and polarization curves. The characterization of metal surfaces was carried out by scanning electron microscopy and X-ray photoelectron spectroscopy (XPS). The adsorption process of each component was studied using the quartz crystal balance (QCM). The QCM and XPS results reveal that the adsorption kinetics for phosphate and calcium ions is slow. However, the bovine serum albumin (BSA) totally covers the Ti surface rapidly. Because the passive film (titanium oxide) has acidic hydroxyl groups, the calcium ions would have a bridging effect on the electrostatic adsorption of phosphate ions as well as that of BSA. The polarization curves reveal that the adsorbed glucose permits the ionic diffusion of the oxygen to the electrode, while the BSA and fetal bovine serum (FBS) adsorbed after 7 days of immersion act as a diffusive barrier. The impedance measurement and data fitting to the electrical equivalent circuit model show that the resistance of the proteins/TiO(2) interface, for Ti immersed in FBS, is higher than those obtained for BSA, due to the proteins present in the solution as well as the fact that the adsorbed proteins on the surface are greater.

  5. Dynamic Analysis of Heavy Vehicle Medium Duty Drive Shaft Using Conventional and Composite Material

    NASA Astrophysics Data System (ADS)

    Kumar, Ashwani; Jain, Rajat; Patil, Pravin P.

    2016-09-01

    The main highlight of this study is structural and modal analysis of single piece drive shaft for selection of material. Drive shaft is used for torque carrying from vehicle transmission to rear wheel differential system. Heavy vehicle medium duty transmission drive shaft was selected as research object. Conventional materials (Steel SM45 C, Stainless Steel) and composite materials (HS carbon epoxy, E Glass Polyester Resin Composite) were selected for the analysis. Single piece composite material drive shaft has advantage over conventional two-piece steel drive shaft. It has higher specific strength, longer life, less weight, high critical speed and higher torque carrying capacity. The main criteria for drive shaft failure are strength and weight. Maximum modal frequency obtained is 919 Hz. Various harmful vibration modes (lateral vibration and torsional vibration) were identified and maximum deflection region was specified. For single-piece drive shaft the natural bending frequency should be higher because it is subjected to torsion and shear stress. Single piece drive shaft was modelled using Solid Edge and Pro-E. Finite Element Analysis was used for structural and modal analysis with actual running boundary condition like frictional support, torque and moment. FEA simulation results were validated with experimental literature results.

  6. Biofilm attachment reduction on bioinspired, dynamic, micro-wrinkling surfaces

    NASA Astrophysics Data System (ADS)

    Epstein, Alexander K.; Hong, Donggyoon; Kim, Philseok; Aizenberg, Joanna

    2013-09-01

    Most bacteria live in multicellular communities known as biofilms that are adherent to surfaces in our environment, from sea beds to plumbing systems. Biofilms are often associated with clinical infections, nosocomial deaths and industrial damage such as bio-corrosion and clogging of pipes. As mature biofilms are extremely challenging to eradicate once formed, prevention is advantageous over treatment. However, conventional surface chemistry strategies are either generally transient, due to chemical masking, or toxic, as in the case of leaching marine antifouling paints. Inspired by the nonfouling skins of echinoderms and other marine organisms, which possess highly dynamic surface structures that mechanically frustrate bio-attachment, we have developed and tested a synthetic platform based on both uniaxial mechanical strain and buckling-induced elastomer microtopography. Bacterial biofilm attachment to the dynamic substrates was studied under an array of parameters, including strain amplitude and timescale (1-100 mm s-1), surface wrinkle length scale, bacterial species and cell geometry, and growth time. The optimal conditions for achieving up to ˜ 80% Pseudomonas aeruginosa biofilm reduction after 24 h growth and ˜ 60% reduction after 48 h were combinatorially elucidated to occur at 20% strain amplitude, a timescale of less than ˜ 5 min between strain cycles and a topography length scale corresponding to the cell dimension of ˜ 1 μm. Divergent effects on the attachment of P. aeruginosa, Staphylococcus aureus and Escherichia coli biofilms showed that the dynamic substrate also provides a new means of species-specific biofilm inhibition, or inversely, selection for a desired type of bacteria, without reliance on any toxic or transient surface chemical treatments.

  7. Waves on the surface of a boiling liquid at various medium stratifications

    SciTech Connect

    Sinkevich, O. A.

    2015-08-15

    The stability of relatively small perturbations of the stationary state consisting of a plane liquid layer and a vapor film is studied when no liquid evaporation or vapor condensation occurs in the stationary state. In this case, heat from a hot to cold wall is removed through a vapor–liquid layer via heat conduction. The boundary conditions that take into account liquid evaporation (appearance of a mass flux) at the vapor–liquid phase surface and the temperature dependence of the saturation pressure are derived. Dispersion equations are obtained. The wave processes for the stable (light vapor under a liquid layer) and unstable stratifications of the phases at rest and during their relative motion are studied. The deformation of the phase boundary results in liquid evaporation, changes in the boiling temperature and the saturation pressure, and generation of weakly damped low-amplitude waves of a new type. These waves ensure the stability of a vapor film under a liquid layer at rest or a liquid layer moving at a constant velocity in the gravity field. The velocities of these waves are much higher than the gravity wave velocities. The critical heat flows and wavelengths at which wave boiling regimes at normal pressure can exist are determined, and the calculated and experimental data are compared.

  8. Optimisation of medium composition for probiotic biomass production using response surface methodology.

    PubMed

    Anvari, Masumeh; Khayati, Gholam; Rostami, Shora

    2014-02-01

    This study was aimed to optimise lactose, inulin and yeast extract concentration and also culture pH for maximising the growth of a probiotic bacterium, Bifidobacterium animalis subsp. lactis in apple juice and to assess the effects of these factors by using response surface methodology. A second-order central composite design was applied to evaluate the effects of these independent variables on growth of the microorganism. A polynomial regression model with cubic and quadratic terms was used for analysis of the experimental data. It was found that the effects involving inulin, yeast extract and pH on growth of the bacterium were significant, and the strongest effect was given by the yeast extract concentration. Estimated optimum conditions of the factors on the bacterial growth are as follows: lactose concentration=9·5 g/l; inulin concentration=38·5 mg/l; yeast extract concentration=9·6 g/l and initial pH=6·2.

  9. Imbibition dynamics on surfaces of legs of a small animal and on artificial surfaces mimicking them

    NASA Astrophysics Data System (ADS)

    Tani, Marie; Ishii, Daisuke; Ito, Shuto; Hariyama, Takahiko; Shimomura, Masatsugu; Okumura, Ko

    2014-03-01

    Recently, imbibition of textured surfaces covered with homogeneous micro-pillar arrays has been actively studied partly because of the potential for transport of a small amount of liquids. In most cases, the dynamics is described by the Washburn law, in which the imbibition distance scales with the square root of elapsed time, while a different scaling law has been recently found. In this study, we studied imbibition on legs of a small animal that absorbs water via its legs to find yet another scaling law. Furthermore, imbibition of artificial surfaces mimicking the leg surface was found to be described well by a composite theory.

  10. Experimental studies of surface and gas-phase processes relevant to the interstellar medium and planetary atmospheres

    NASA Astrophysics Data System (ADS)

    Latimer, E.

    The interstellar medium (ISM) is the region of space between stars, where star and planet formation occurs. Molecular hydrogen is vitally important to the chemistry that happens in the ISM, as it initiates most of the reactions. The molecules that result from these reactions act as a coolant for the huge molecular clouds that collapse to form stars. The abundance of molecular hydrogen in the ISM is too high to form through gas phase processes alone. The accepted formation mechanism for H_2 is via heterogeneous catalysis on the surface of interstellar dust grains. These dust grains make up approximately 1% mass of the ISM and are carbonaceous or silicate in composition. The experiment presented in this thesis has been designed to probe ro-vibrational energy of nascent HD formed on an interstellar dust grain analogue. The experiment involves the use of two atom sources, to produce H and D atoms, ultrahigh vacuum chambers and cryogenic cooling to obtain conditions relevant to the ISM. The laser technique of resonance enhanced multiphoton ionisation (REMPI) is employed to state selectively ionise the HD, in order to investigate the internal energy of the newly formed HD when itdesorbs from the highly orientated pyrolitic graphite surface. The results are presented here and are compared to other theoretical and experimental studies; the astrophysical implications are discussed. Also included in this thesis is a study of the electron impact ionisation of OCS using pulsed time-of-flight in conjunction with a 2-D coincidence technique. The experimentalset-up allows fragment ions to be formed by dissociative single, double and triple ionisation to be detected and quantified. The relative partial ionisation cross sections (PICS) and precursor specific relative PICS are derived as well as information on OCS. {2+}. OCS is found in the atmospheres of Jupiter and Venus, where it may exist in a doubly charged state, OCS has been observed in the interstellar medium.

  11. The toxicity of plastic nanoparticles to green algae as influenced by surface modification, medium hardness and cellular adsorption.

    PubMed

    Nolte, Tom M; Hartmann, Nanna B; Kleijn, J Mieke; Garnæs, Jørgen; van de Meent, Dik; Jan Hendriks, A; Baun, Anders

    2017-02-01

    To investigate processes possibly underlying accumulation and ecological effects of plastic nano-particles we have characterized their interaction with the cell wall of green algae. More specifically, we have investigated the influence of particle surface functionality and water hardness (Ca(2+) concentration) on particle adsorption to algae cell walls. Polystyrene nanoparticles with different functional groups (non-functionalized, -COOH and -NH2) as well as coated (starch and PEG) gold nanoparticles were applied in these studies. Depletion measurements and atomic force microscopy (AFM) showed that adsorption of neutral and positively charged plastic nanoparticles onto the cell wall of P. subcapitata was stronger than that of negatively charged plastic particles. Results indicated that binding affinity is a function of both inter-particle and particle-cell wall interactions which are in turn influenced by the medium hardness and particle concentration. Physicochemical modelling using DLVO theory was used to interpret the experimental data, using also values for interfacial surface free energies. Our study shows that material properties and medium conditions play a crucial role in the rate and state of nanoparticle bio-adsorption for green algae. The results show that the toxicity of nanoparticles can be better described and assessed by using appropriate dose metrics including material properties, complexation/agglomeration behavior and cellular attachment and adsorption. The applied methodology provides an efficient and feasible approach for evaluating potential accumulation and hazardous effects of nanoparticles to algae caused by particle interactions with the algae cell walls. Copyright © 2016 Elsevier B.V. All rights reserved.

  12. Medium optimization for pyrroloquinoline quinone (PQQ) production by Methylobacillus sp. zju323 using response surface methodology and artificial neural network-genetic algorithm.

    PubMed

    Wei, Peilian; Si, Zhenjun; Lu, Yao; Yu, Qingfei; Huang, Lei; Xu, Zhinan

    2017-08-09

    Methylobacillus sp. zju323 was adopted to improve the biosynthesis of pyrroloquinoline quinone (PQQ) by systematic optimization of the fermentation medium. The Plackett-Burman design was implemented to screen for the key medium components for the PQQ production. CoCl2 · 6H2O, ρ-amino benzoic acid, and MgSO4 · 7H2O were found capable of enhancing the PQQ production most significantly. A five-level three-factor central composite design was used to investigate the direct and interactive effects of these variables. Both response surface methodology (RSM) and artificial neural network-genetic algorithm (ANN-GA) were used to predict the PQQ production and to optimize the medium composition. The results showed that the medium optimized by ANN-GA was better than that by RSM in maximizing PQQ production and the experimental PQQ concentration in the ANN-GA-optimized medium was improved by 44.3% compared with that in the unoptimized medium. Further study showed that this ANN-GA-optimized medium was also effective in improving PQQ production by fed-batch mode, reaching the highest PQQ accumulation of 232.0 mg/L, which was about 47.6% increase relative to that in the original medium. The present work provided an optimized medium and developed a fed-batch strategy which might be potentially applicable in industrial PQQ production.

  13. Investigations of Few-Nucleon System Dynamics in Medium Energy Domain

    NASA Astrophysics Data System (ADS)

    Ciepał, I.; Kłos, B.; Kistryn, St.; Stephan, E.; Biegun, A.; Bodek, K.; Deltuva, A.; Epelbaum, E.; Eslami-Kalantari, M.; Fonseca, A. C.; Golak, J.; Jha, V.; Kalantar-Nayestanaki, N.; Kamada, H.; Khatri, G.; Kirillov, Da.; Kirillov, Di.; Kliczewski, St.; Kozela, A.; Kravcikova, M.; Machner, H.; Magiera, A.; Martinska, G.; Messchendorp, J.; Nogga, A.; Parol, W.; Ramazani-Moghaddam-Arani, A.; Roy, B. J.; Sakai, H.; Sekiguchi, K.; Sitnik, I.; Siudak, R.; Skibiński, R.; Sworst, R.; Urban, J.; Witała, H.; Wrońska, A.; Zejma, J.

    2013-08-01

    Precise and large set of cross sections, vector A x , A y and tensor A xx , A xy , A yy analyzing powers for the 1 H( d, pp) n breakup reactions were measured at 100 and 130 MeV deuteron beam energies with the use of the SALAD and BINA detectors at KVI and Germanium Wall setup at FZ-Jülich. Results are compared with various theoretical approaches which model the three-nucleon (3N) system dynamics. The calculations are based on different two-nucleon (2N) potentials which can be combined with models of the three-nucleon force (3NF) and other pieces of the dynamics can also be included like the Coulomb interaction and relativistic effects. The cross sections data reveal seizable 3NF and Coulomb force influence. In case of analyzing powers very low sensitivity to the effects was found and the data are well describe by 2N models only. At 130 MeV for A xy serious disagreements appear when 3NF models are included into calculations.

  14. Meso-mechanical analysis of deformation characteristics for dynamically triggered slip in a granular medium

    NASA Astrophysics Data System (ADS)

    Griffa, M.; Ferdowsi, B.; Daub, E. G.; Guyer, R. A.; Johnson, P. A.; Marone, C.; Carmeliet, J.

    2012-10-01

    The deformation characteristics of a sheared granular layer during stick-slip are studied from a meso-mechanical viewpoint, both in the absence and in the presence of externally applied vibration. The ultimate goal is to characterize the physics of dynamic earthquake triggering, where one earthquake, i.e., slip on one fault, is triggered via the seismic waves radiated by another spatially and temporally distant seismic event. Toward this goal, we performed Discrete Element Method simulations of a two-dimensional packing of disks, mimicking a mature geologic fault. These simulations were used to investigate the affine and non-affine deformations inside the granular layer and their spatial-temporal evolution across the stick-slip cycle. The simulation results show that slip in general is accompanied by the appearance of localized regions with high values of both affine and non-affine deformations. These regions are temporally correlated and are mainly concentrated in a shear zone at the interface between the granular layer and the driving block. Dynamic triggering is found to initiate slip when vibration is applied late in the stick-slip cycle, when the system is close to a critical state. It is also found that vibration itself introduces a large amount of affine and non-affine strains, which leads to the initiation of slip at lower shear stress than an equivalent slip event without vibration.

  15. Dynamics of adsorbed polymers on attractive homogeneous surfaces

    PubMed Central

    Yang, Qing-Hui; Luo, Meng-Bo

    2016-01-01

    Dynamic behaviors of polymer chains adsorbed on an attractive, homogeneous surface are studied by using dynamic Monte Carlo simulations. The translational diffusion coefficient Dxy parallel to the surface decreases as the intra-polymer attraction strength EPP or the polymer-surface attraction strength EPS increases. The rotational relaxation time τR increases with EPS, but the dependence of τR on EPP is dependent on the adsorption state of the polymer. We find that τR decreases with increasing EPP for a partially adsorbed polymer but it increases with EPP for a fully adsorbed polymer. Scaling relations Dxy ~ N−α and τR ~ Nβ are found for long polymers. The scaling exponent α is independent of EPS for long polymers but increases with EPP from α = 1.06 at EPP = 0. While β ≈ 2.7 is also roughly independent of EPS for the adsorbed polymer at EPP = 0, but β increases with EPS at EPP > 0. Moreover, we find that β always decreases with increasing EPP. Our results reveal different effects of the attractive surface on the diffusion and rotation of adsorbed polymers. PMID:27849002

  16. Observation of the Korteweg-de Vries soliton in molecular dynamics simulations of a dusty plasma medium

    NASA Astrophysics Data System (ADS)

    Kumar, Sandeep; Tiwari, Sanat Kumar; Das, Amita

    2017-03-01

    The excitation and evolution of Korteweg-de Vries (KdV) solitons in a dusty plasma medium are studied using Molecular Dynamics (MD) simulations. The dusty plasma medium is modelled as a collection of dust particles interacting through Yukawa potential, which takes into account dust charge screening due to the lighter electron and ion species. The collective response of such screened dust particles to an applied electric field impulse is studied here. An excitation of a perturbed positive density pulse propagating in one direction along with a train of negative perturbed rarefactive density oscillations in the opposite direction is observed. These observations are in accordance with evolution governed by the KdV equation. Detailed studies of (a) amplitude vs. width variation of the observed pulse, (b) the emergence of intact separate pulses with an associated phase shift after collisional interaction amidst them, etc., conclusively qualify the positive pulses observed in the simulations as KdV solitons. It is also observed that by increasing the strength of the electric field impulse, multiple solitonic structures get excited. The excitations of the multiple solitons are similar to the experimental observations reported recently by Boruah et al. [Phys. Plasmas 23, 093704 (2016)] for dusty plasmas. The role of coupling parameter has also been investigated here, which shows that with increasing coupling parameter, the amplitude of the solitonic pulse increases whereas its width decreases.

  17. Efficient analysis of mode profiles in elliptical microcavity using dynamic-thermal electron-quantum medium FDTD method.

    PubMed

    Khoo, E H; Ahmed, I; Goh, R S M; Lee, K H; Hung, T G G; Li, E P

    2013-03-11

    The dynamic-thermal electron-quantum medium finite-difference time-domain (DTEQM-FDTD) method is used for efficient analysis of mode profile in elliptical microcavity. The resonance peak of the elliptical microcavity is studied by varying the length ratio. It is observed that at some length ratios, cavity mode is excited instead of whispering gallery mode. This depicts that mode profiles are length ratio dependent. Through the implementation of the DTEQM-FDTD on graphic processing unit (GPU), the simulation time is reduced by 300 times as compared to the CPU. This leads to an efficient optimization approach to design microcavity lasers for wide range of applications in photonic integrated circuits.

  18. Reaction dynamics induced by the radioactive ion beam {sup 7}Be on medium-mass and heavy targets

    SciTech Connect

    Mazzocco, M. Stefanini, C.; Strano, E.; Torresi, D.; Lay, J. A.; Molini, P.; Soramel, F.; Boiano, A.; Parascandolo, C.; Pierroutsakou, D.; Di Meo, P.; Boiano, C.; La Commara, M.; Sandoli, M.; Silvestri, R.; Manea, C.; Nicoletto, M.; Acosta, L.; Fernandez-Garcia, J. P.; Glodariu, T.; and others

    2015-10-15

    We studied the reaction dynamics induced at Coulomb barrier energies by the weakly-bound Radioactive Ion Beam {sup 7}Be (S{sub α} = 1.586 MeV) on medium-mass ({sup 58}Ni) and heavy ({sup 208}Pb) targets. The experiments were performed at INFN-LNL (Italy), where a 2-3×10{sup 5} pps {sup 7}Be secondary beam was produced with the RIB in-flight facility EXOTIC. Charged reaction products were detected by means of high-granularity silicon detectors in rather wide angular ranges. The contribution presents an up-to-date status of the data analysis and theoretical interpretation for both systems.

  19. Viscoplasticity with dynamic yield surface coupled to damage

    NASA Astrophysics Data System (ADS)

    Johansson, M.; Runesson, K.

    1997-07-01

    A formulation of viscoplasticity theory, with kinetic coupling to damage, is presented. The main purpose is to describe rate-dependent material behavior and failure processes, including creep-rupture (for constant load) and creep-fatigue (for cyclic load). The Duvaut-Lions' formulation of viscoplasticity is adopted with quite general hardening of the quasistatic yield surface. The formulation is thermodynamically consistent, i.e. the dissipation inequality is satisfied. Like in the classical viscoplasticity formulations, the rate-independent response is activated at a very small loading rate. In addition, an (unconventional) dynamic yield surface is introduced, and this is approached asymptotically at infinite loading rate. Explicit constitutive relations are established for a quasistatic yield surface of von Mises type with nonlinear hardening. The resulting model is assessed for a variety of loading situations.

  20. Spreading dynamics of droplet on an inclined surface

    NASA Astrophysics Data System (ADS)

    Shen, Chaoqun; Yu, Cheng; Chen, Yongping

    2016-06-01

    A three-dimensional unsteady theoretical model of droplet spreading process on an inclined surface is developed and numerically analyzed to investigate the droplet spreading dynamics via the lattice Boltzmann simulation. The contact line motion and morphology evolution for the droplet spreading on an inclined surface, which are, respectively, represented by the advancing/receding spreading factor and droplet wetted length, are evaluated and analyzed. The effects of surface wettability and inclination on the droplet spreading behaviors are examined. The results indicate that, dominated by gravity and capillarity, the droplet experiences a complex asymmetric deformation and sliding motion after the droplet comes into contact with the inclined surfaces. The droplet firstly deforms near the solid surface and mainly exhibits a radial expansion flow in the start-up stage. An evident sliding-down motion along the inclination is observed in the middle stage. And the surface-tension-driven retraction occurs during the retract stage. Increases in inclination angle and equilibrium contact angle lead to a faster droplet motion and a smaller wetted area. In addition, increases in equilibrium contact angle lead to a shorter duration time of the middle stage and an earlier entry into the retract stage.

  1. Apparatus and Method for Focusing a Light Beam in a Three-Dimensional Recording Medium by a Dynamic Holographic Device

    NASA Technical Reports Server (NTRS)

    Juday, Richard D. (Inventor)

    1998-01-01

    An apparatus is disclosed for reading and/or writing information or to from an optical recording medium having a plurality of information storage layers. The apparatus includes a dynamic holographic optical element configured to focus light on the optical recording medium. a control circuit arranged to supply a drive signal to the holographic optical element, and a storage device in communication with the control circuit and storing at least a first drive signal and a second drive signal. The holographic optical element focusses light on a first one of the plurality of information storage layers when driven by the first drive signal on a second one of the plurality of information storage layers when driven by the second drive signal. An optical switch is also disclosed for connecting at least one light source in a source array to at least one light receiver in a receiver array. The switch includes a dynamic holographic optical element configured to receive light from the source array and to transmit light to the receiver array, a control circuit arranged to supply a drive signal to the holographic optical element, and a storage device in communication with the control circuit and storing at least a first drive signal and a second drive signal. The holographic optical element connects a first light source in the source array to a first light receiver in the receiver array when driven by the first drive signal and the holographic optical element connects the first light source with the first light receiver and a second light receiver when driven by the second drive signal.

  2. An On-the-Fly Surface-Hopping Program JADE for Nonadiabatic Molecular Dynamics of Polyatomic Systems: Implementation and Applications.

    PubMed

    Du, Likai; Lan, Zhenggang

    2015-04-14

    Nonadiabatic dynamics simulations have rapidly become an indispensable tool for understanding ultrafast photochemical processes in complex systems. Here, we present our recently developed on-the-fly nonadiabatic dynamics package, JADE, which allows researchers to perform nonadiabatic excited-state dynamics simulations of polyatomic systems at an all-atomic level. The nonadiabatic dynamics is based on Tully's surface-hopping approach. Currently, several electronic structure methods (CIS, TDHF, TDDFT(RPA/TDA), and ADC(2)) are supported, especially TDDFT, aiming at performing nonadiabatic dynamics on medium- to large-sized molecules. The JADE package has been interfaced with several quantum chemistry codes, including Turbomole, Gaussian, and Gamess (US). To consider environmental effects, the Langevin dynamics was introduced as an easy-to-use scheme into the standard surface-hopping dynamics. The JADE package is mainly written in Fortran for greater numerical performance and Python for flexible interface construction, with the intent of providing open-source, easy-to-use, well-modularized, and intuitive software in the field of simulations of photochemical and photophysical processes. To illustrate the possible applications of the JADE package, we present a few applications of excited-state dynamics for various polyatomic systems, such as the methaniminium cation, fullerene (C20), p-dimethylaminobenzonitrile (DMABN) and its primary amino derivative aminobenzonitrile (ABN), and 10-hydroxybenzo[h]quinoline (10-HBQ).

  3. Condensation and Wetting Dynamics on Micro/Nano-Structured Surfaces

    NASA Astrophysics Data System (ADS)

    Olceroglu, Emre

    -condensable gases (NCGs), a novel characterization technique has been developed based on image tracking of droplet growth rates. The full-field dynamic characterization of superhydrophobic surfaces during condensation has been achieved using high-speed microscopy coupled with image-processing algorithms. This method is able to resolve heat fluxes as low as 20 W/m 2 and heat transfer coefficients of up to 1000 kW/m2, across an array of 1000's of microscale droplets simultaneously. Nanostructured surfaces with mixed wettability have been used to demonstrate delayed flooding during superhydrophobic condensation. These surfaces have been optimized and characterized using optical and electron microscopy, leading to the observation of self-organizing microscale droplets. The self-organization of small droplets effectively delays the onset of surface flooding, allowing the superhydrophobic surfaces to operate at higher supersaturations. Additionally, hierarchical surfaces have been fabricated and characterized showing enhanced droplet growth rates as compared to existing models. This enhancement has been shown to be derived from the presence of small feeder droplets nucleating within the microscale unit cells of the hierarchical surfaces. Based on the experimental observations, a mechanistic model for growth rates has been developed for superhydrophobic hierarchical surfaces. While superhydrophobic surfaces exhibit high heat transfer rates they are inherently unstable due to the necessity to maintain a non-wetted state in a condensing environment. As an alternative condensation surface, a novel design is introduced here using ambiphilic structures to promote the formation of a thin continuous liquid film across the surface which can still provide the benefits of superhydrophobic condensation. Preliminary results show that the ambiphilic structures restrain the film thickness, thus maintaining a low thermal resistance while simultaneously maximizing the liquid-vapor interface available for

  4. Molecular Dynamics Simulation of Fluid Transport in Nanoscale Pore of Porous Medium

    NASA Astrophysics Data System (ADS)

    Chu, Y.; Lu, J. F.; Lu, W. Q.

    2010-03-01

    In this paper, the Poiseuille water flow inside a nanosized channel style pore formed by two solid parallel walls is studied using molecular dynamics (MD) simulation. Alumina has been chosen as the material of the wall. The flow is initiated by applying a uniform external force on each water molecule inside the channel. Periodic boundary conditions are imposed for the simulation. 12-6 L-J potentials are chosen in the simulation to describe H2O-H2O molecule interactions as well as H2O-Al2O3 molecule interactions. The present work aims at finding that, in the process of hemodialysis, how the filtration velocity and slip boundaries inside the pore of a filtration membrane are affected by the magnitude of the applied external force and how the results are different from that of the simplified Kedem-Ketchalsky (1958) equations employing the present physical parameters.

  5. Spatial patterns of sediment dynamics within a medium-sized watershed over an extreme storm event

    NASA Astrophysics Data System (ADS)

    Gao, Peng; Zhang, Zhirou

    2016-08-01

    In this study, we quantified spatial patterns of sediment dynamics in a watershed of 311 km2 over an extreme storm event using watershed modeling and statistical analyses. First, we calibrated a watershed model, Dynamic Watershed Simulation Model (DWSM) by comparing the predicted with calculated hydrograph and sedigraph at the outlet for this event. Then we predicted values of event runoff volume (V), peak flow (Qpeak), and two types of event sediment yields for lumped morphological units that contain 42 overland elements and 21 channel segments within the study watershed. Two overland elements and the connected channel segment form a first-order subwatershed, several of which constitute a larger nested subwatershed. Next we examined (i) the relationships between these variables and area (A), precipitation (P), mean slope (S), soil erodibility factor, and percent of crop and pasture lands for all overland elements (i.e., the small spatial scale, SSS), and (ii) those between sediment yield, Qpeak, A, P, and event runoff depth (h) for the first-order and nested subwatersheds along two main creeks of the study watershed (i.e., the larger spatial scales, LSS). We found that at the SSS, sediment yield was nonlinearly well related to A and P, but not Qpeak and h; whereas at the LSS, linear relationships between sediment yield and Qpeak existed, so did the Qpeak-A, and Qpeak-P relationships. This linearity suggests the increased connectivity from the SSS to LSS, which was caused by ignorance of channel processes within overland elements. It also implies that sediment was transported at capacity during the extreme event. So controlling sediment supply from the most erodible overland elements may not efficiently reduce the downstream sediment load.

  6. Ultrafast Excited State Dynamics in Molecular Motors: Coupling of Motor Length to Medium Viscosity.

    PubMed

    Conyard, Jamie; Stacko, Peter; Chen, Jiawen; McDonagh, Sophie; Hall, Christopher R; Laptenok, Sergey P; Browne, Wesley R; Feringa, Ben L; Meech, Stephen R

    2017-03-16

    Photochemically driven molecular motors convert the energy of incident radiation to intramolecular rotational motion. The motor molecules considered here execute four step unidirectional rotational motion. This comprises a pair of successive light induced isomerizations to a metastable state followed by thermal helix inversions. The internal rotation of a large molecular unit required in these steps is expected to be sensitive to both the viscosity of the medium and the volume of the rotating unit. In this work, we describe a study of motor motion in both ground and excited states as a function of the size of the rotating units. The excited state decay is ultrafast, highly non-single exponential, and is best described by a sum of three exponential relaxation components. The average excited state decay time observed for a series of motors with substituents of increasing volume was determined. While substitution does affect the lifetime, the size of the substituent has only a minor effect. The solvent polarity dependence is also slight, but there is a significant solvent viscosity effect. Increasing the viscosity has no effect on the fastest of the three decay components, but it does lengthen the two slower decay times, consistent with them being associated with motion along an intramolecular coordinate displacing a large solvent volume. However, these slower relaxation times are again not a function of the size of the substituent. We conclude that excited state decay arises from motion along a coordinate which does not necessarily require complete rotation of the substituents through the solvent, but is instead more localized in the core structure of the motor. The decay of the metastable state to the ground state through a helix inversion occurs 14 orders of magnitude more slowly than the excited state decay, and was measured as a function of substituent size, solvent viscosity and temperature. In this case neither substituent size nor solvent viscosity influences

  7. Cooling rate and size effects on the medium-range structure of multicomponent oxide glasses simulated by molecular dynamics

    NASA Astrophysics Data System (ADS)

    Tilocca, Antonio

    2013-09-01

    A set of molecular dynamics simulations were performed to investigate the effect of cooling rate and system size on the medium-range structure of melt-derived multicomponent silicate glasses, represented by the quaternary 45S5 Bioglass composition. Given the significant impact of the glass degradation on applications of these materials in biomedicine and nuclear waste disposal, bulk structural features which directly affect the glass dissolution process are of particular interest. Connectivity of the silicate matrix, ion clustering and nanosegregation, distribution of ring and chain structural patterns represent critical features in this context, which can be directly extracted from the models. A key issue is represented by the effect of the computational approach on the corresponding glass models, especially in light of recent indications questioning the suitability of conventional MD approaches (that is, involving melt-and-quench of systems containing ˜103 atoms at cooling rates of 5-10 K/ps) when applied to model these glasses. The analysis presented here compares MD models obtained with conventional and nonconventional cooling rates and system sizes, highlighting the trend and range of convergence of specific structural features in the medium range. The present results show that time-consuming computational approaches involving much lower cooling rates and/or significantly larger system sizes are in most cases not necessary in order to obtain a reliable description of the medium-range structure of multicomponent glasses. We identify the convergence range for specific properties and use them to discuss models of several glass compositions for which a possible influence of cooling-rate or size effects had been previously hypothesized. The trends highlighted here represent an important reference to obtain reliable models of multicomponent glasses and extract converged medium-range structural features which affect the glass degradation and thus their application

  8. Cooling rate and size effects on the medium-range structure of multicomponent oxide glasses simulated by molecular dynamics

    SciTech Connect

    Tilocca, Antonio

    2013-09-21

    A set of molecular dynamics simulations were performed to investigate the effect of cooling rate and system size on the medium-range structure of melt-derived multicomponent silicate glasses, represented by the quaternary 45S5 Bioglass composition. Given the significant impact of the glass degradation on applications of these materials in biomedicine and nuclear waste disposal, bulk structural features which directly affect the glass dissolution process are of particular interest. Connectivity of the silicate matrix, ion clustering and nanosegregation, distribution of ring and chain structural patterns represent critical features in this context, which can be directly extracted from the models. A key issue is represented by the effect of the computational approach on the corresponding glass models, especially in light of recent indications questioning the suitability of conventional MD approaches (that is, involving melt-and-quench of systems containing ∼10{sup 3} atoms at cooling rates of 5-10 K/ps) when applied to model these glasses. The analysis presented here compares MD models obtained with conventional and nonconventional cooling rates and system sizes, highlighting the trend and range of convergence of specific structural features in the medium range. The present results show that time-consuming computational approaches involving much lower cooling rates and/or significantly larger system sizes are in most cases not necessary in order to obtain a reliable description of the medium-range structure of multicomponent glasses. We identify the convergence range for specific properties and use them to discuss models of several glass compositions for which a possible influence of cooling-rate or size effects had been previously hypothesized. The trends highlighted here represent an important reference to obtain reliable models of multicomponent glasses and extract converged medium-range structural features which affect the glass degradation and thus their

  9. Evaluation of a coupled model for numerical simulation of a multiphase flow system in a porous medium and a surface fluid.

    PubMed

    Hibi, Yoshihiko; Tomigashi, Akira

    2015-09-01

    Numerical simulations that couple flow in a surface fluid with that in a porous medium are useful for examining problems of pollution that involve interactions among atmosphere, water, and groundwater, including saltwater intrusion along coasts. Coupled numerical simulations of such problems must consider both vertical flow between the surface fluid and the porous medium and complicated boundary conditions at their interface. In this study, a numerical simulation method coupling Navier-Stokes equations for surface fluid flow and Darcy equations for flow in a porous medium was developed. Then, the basic ability of the coupled model to reproduce (1) the drawdown of a surface fluid observed in square-pillar experiments, using pillars filled with only fluid or with fluid and a porous medium and (2) the migration of saltwater (salt concentration 0.5%) in the porous medium using the pillar filled with fluid and a porous medium was evaluated. Simulations that assumed slippery walls reproduced well the results with drawdowns of 10-30 cm when the pillars were filled with packed sand, gas, and water. Moreover, in the simulation of saltwater infiltration by the method developed in this study, velocity was precisely reproduced because the experimental salt concentration in the porous medium after saltwater infiltration was similar to that obtained in the simulation. Furthermore, conditions across the boundary between the porous medium and the surface fluid were satisfied in these numerical simulations of square-pillar experiments in which vertical flow predominated. Similarly, the velocity obtained by the simulation for a system coupling flow in surface fluid with that in a porous medium when horizontal flow predominated satisfied the conditions across the boundary. Finally, it was confirmed that the present simulation method was able to simulate a practical-scale surface fluid and porous medium system. All of these numerical simulations, however, required a great deal of

  10. Medium-size droplets of methyl ricinoleate are reduced by cell-surface activity in the gamma-decalactone production by Yarrowia lipolytica.

    PubMed

    Waché, Y; Bergmark, K; Courthaudon, J L; Aguedo, M; Nicaud, J M; Belin, J M

    2000-03-01

    Size of methyl ricinoleate droplets during biotransformation into gamma-decalactone by Yarrowia lipolytica was measured in both homogenized and non-homogenized media. In non-homogenized but shaken medium, droplets had an average volume surface diameter d32 of 2.5 microm whereas it was 0.7 microm in homogenized and shaken medium. But as soon as yeast cells were inoculated, both diameters became similar at about 0.7 microm and did not vary significantly until the end of the culture. The growth of Y. lipolytica in both media was very similar except for the lag phase which was lowered in homogenized medium conditions.

  11. Stem cells from human exfoliated deciduous teeth differentiate toward neural cells in a medium dynamically cultured with Schwann cells in a series of polydimethylsiloxanes scaffolds

    NASA Astrophysics Data System (ADS)

    Su, Wen-Ta; Pan, Yu-Jing

    2016-08-01

    Objective. Schwann cells (SCs) are primary structural and functional cells in the peripheral nervous system. These cells play a crucial role in peripheral nerve regeneration by releasing neurotrophic factors. This study evaluated the neural differentiation potential effects of stem cells from human exfoliated deciduous teeth (SHEDs) in a rat Schwann cell (RSC) culture medium. Approach. SHEDs and RSCs were individually cultured on a polydimethylsiloxane (PDMS) scaffold, and the effects of the RSC medium on the SHEDs differentiation between static and dynamic cultures were compared. Main results. Results demonstrated that the SHED cells differentiated by the RSC cultured medium in the static culture formed neurospheres after 7 days at the earliest, and SHED cells formed neurospheres within 3 days in the dynamic culture. These results confirm that the RSC culture medium can induce neurospheres formation, the speed of formation and the number of neurospheres (19.16 folds high) in a dynamic culture was superior to the static culture for 3 days culture. The SHED-derived spheres were further incubated in the RSCs culture medium, these neurospheres continuously differentiated into neurons and neuroglial cells. Immunofluorescent staining and RT-PCR revealed nestin, β-III tubulin, GFAP, and γ-enolase of neural markers on the differentiated cells. Significance. These results indicated that the RSC culture medium can induce the neural differentiation of SHED cells, and can be used as a new therapeutic tool to repair nerve damage.

  12. Exo-pectinase production by Bacillus pumilus using different agricultural wastes and optimizing of medium components using response surface methodology.

    PubMed

    Tepe, Ozlem; Dursun, Arzu Y

    2014-01-01

    In this research, the production of exo-pectinase by Bacillus pumilus using different agricultural wastes was studied. Agricultural wastes containing pectin such as wheat bran, sugar beet pulp, sunflower plate, orange peel, banana peel, apple pomace and grape pomace were tested as substrates, and activity of exo-pectinase was determined only in the mediums containing sugar beet pulp and wheat bran. Then, effects of parameters such as concentrations of solid substrate (wheat bran and sugar beet pulp) (A), ammonium sulphate (B) and yeast extract (C) on the production of exo-pectinase were investigated by response surface methodology. First, wheat bran was used as solid substrate, and it was determined that exo-pectinase activity increased when relatively low concentrations of ammonium sulphate (0.12-0.21% w/v) and yeast extract (0.12-0.3% w/v) and relatively high wheat bran (~5-6% w/v) were used. Then, exo-pectinase production was optimized by response surface methodology using sugar beet pulp as a solid substrate. In comparison to P values of the coefficients, values of not greater than 0.05 of A and B (2) showed that the effect of these process variables in exo-pectinase production was important and that changes done in these variables will alter the enzyme activity.

  13. Effect of the surface potential of the hemodialysis membrane and the electrical charge of the gadolinium contrast medium on dialyzability.

    PubMed

    Okada, Susumu; Inoue, Kohei; Kijima, Tetsuji; Katagiri, Kiwayo; Kumazaki, Tatsuo

    2003-02-01

    To search for methods of improving the excretion of injected gadolinium contrast medium (GdCM) in hemodialysis (HD) patients, we investigated the effect of the surface potential of HD membranes and the electrical charge of GdCM on the dialyzability of GdCM. Ionic (Gd-DTPA) or non-ionic (Gd-DO3A) GdCM solutions were dialyzed using a clinical HD unit. Two types of HD membranes, AN69 with a surface potential and PMMA without, were used. GdCM clearance was then calculated. Gd-DTPA clearance was significantly higher for PMMA membranes than for AN69 membranes. Gd-DO3A clearance was slightly higher for AN69 membranes than for PMMA membranes. The difference in Gd-DTPA and Gd-DO3A clearance values was not significant when PMMA membranes were used. These data indicate that non-ionic GdCM is preferable to ionic GdCM in patients receiving dialysis through an electrically positive membrane. Either ionic or non-ionic GdCM can be used when a normal dialysis membrane is being used.

  14. Surface structure and dipole moments of RbI(001) determined by high-resolution medium-energy ion scattering

    NASA Astrophysics Data System (ADS)

    Okazawa, T.; Hoshino, Y.; Nishimura, T.; Kido, Y.

    2001-11-01

    The surface structure of RbI(001) was determined directly by means of medium-energy ion scattering (MEIS) with a monolayer depth resolution. The rumpled surface structure determined here was compared with semi-classical shell-model calculations. On the basis of a simple model regarding the lattice site ion as a point charge accompanied by a dipole moment, we evaluated the dipole moments of the top- and second-layer I- and Rb+ ions self-consistently from the relaxed lattice positions determined by means of MEIS and from the polarizabilities estimated systematically from experimental refraction data. The balance between a short-range force and a long-range coulombic one determined the equilibrium positions of the top- and second-layer ions; these are consistent with those derived by means of MEIS within the experimental uncertainties of 0.02 Å. This indicates that the polarizablities derived from the refraction data and the interatomic (short-range) potentials of the Born-Mayer type are applicable.

  15. Dynamic response of an array of flexural plates in acoustic medium

    PubMed Central

    Park, Kwan Kyu; Khuri-Yakub, Brutus T.

    2012-01-01

    The dynamic response of a transducer array made up of circular flexural plates in immersion is analytically calculated. The calculation method includes three steps: (1) the calculation of parallel resonant frequency and the velocity profile of each plate, (2) the calculation of mutual acoustic impedance between the plates, and (3) the calculation of velocity response, including the mechanical and acoustic impedance. The calculation method is validated by both finite element analysis and measurement results of a fabricated capacitive micromachined ultrasonic transducer. Based on the calculated velocity, the near-field pressure and the near-to-far field radiation patterns are presented. The flexural plate array in immersion displays two modes of operation. At low frequency, the mode shape of the transducer array is similar to that of a suspended plate and, at certain frequencies, two groups of plates move in opposite phase, which results in the cancellation of the average velocity. At high frequency, the mode shape is similar to that of a piston transducer; however, the near-field pressure distribution is similar to that of a resilient disk. PMID:23039426

  16. Dynamic Critical Rainfall-Based Flash Flood Early Warning and Forecasting for Medium-Small Rivers

    NASA Astrophysics Data System (ADS)

    Liu, Z.; Yang, D.; Hu, J.

    2012-04-01

    China is extremely frequent food disasters hit countries, annual flood season flash floods triggered by rainfall, mudslides, landslides have caused heavy casualties and property losses, not only serious threaten the lives of the masses, but the majority of seriously restricting the mountain hill areas of economic and social development and the people become rich, of building a moderately prosperous society goals. In the next few years, China will focus on prevention and control area in the flash flood disasters initially built "for the surveillance, communications, forecasting, early warning and other non-engineering measure based, non-engineering measures and the combinations of engineering measures," the mitigation system. The latest progresses on global torrential flood early warning and forecasting techniques are reviewed in this paper, and then an early warning and forecasting approach is proposed on the basis of a distributed hydrological model according to dynamic critical rainfall index. This approach has been applied in Suichuanjiang River basin in Jiangxi province, which is expected to provide valuable reference for building a national flash flood early warning and forecasting system as well as control of such flooding.

  17. The bioelectric code: An ancient computational medium for dynamic control of growth and form.

    PubMed

    Levin, Michael; Martyniuk, Christopher J

    2017-09-02

    What determines large-scale anatomy? DNA does not directly specify geometrical arrangements of tissues and organs, and a process of encoding and decoding for morphogenesis is required. Moreover, many species can regenerate and remodel their structure despite drastic injury. The ability to obtain the correct target morphology from a diversity of initial conditions reveals that the morphogenetic code implements a rich system of pattern-homeostatic processes. Here, we describe an important mechanism by which cellular networks implement pattern regulation and plasticity: bioelectricity. All cells, not only nerves and muscles, produce and sense electrical signals; in vivo, these processes form bioelectric circuits that harness individual cell behaviors toward specific anatomical endpoints. We review emerging progress in reading and re-writing anatomical information encoded in bioelectrical states, and discuss the approaches to this problem from the perspectives of information theory, dynamical systems, and computational neuroscience. Cracking the bioelectric code will enable much-improved control over biological patterning, advancing basic evolutionary developmental biology as well as enabling numerous applications in regenerative medicine and synthetic bioengineering. Copyright © 2017 Elsevier B.V. All rights reserved.

  18. Dynamic Corneal Surface Mapping with Electronic Speckle Pattern Interferometry

    NASA Astrophysics Data System (ADS)

    Iqbal, S.; Gualini, M. M. S.

    2013-06-01

    In view of the fast advancement in ophthalmic technology and corneal surgery, there is a strong need for the comprehensive mapping and characterization techniques for corneal surface. Optical methods with precision non-contact approaches have been found to be very useful for such bio measurements. Along with the normal mapping approaches, elasticity of corneal surface has an important role in its characterization and needs to be appropriately measured or estimated for broader diagnostics and better prospective surgical results, as it has important role in the post-op corneal surface reconstruction process. Use of normal corneal topographic devices is insufficient for any intricate analysis since these devices operate at relatively moderate resolution. In the given experiment, Pulsed Electronic Speckle Pattern Interferometry has been utilized along with an excitation mechanism to measure the dynamic response of the sample cornea. A Pulsed ESPI device has been chosen for the study because of its micron-level resolution and other advantages in real-time deformation analysis. A bovine cornea has been used as a sample in the subject experiment. The dynamic response has been taken on a chart recorder and it is observed that it does show a marked deformation at a specific excitation frequency, which may be taken as a characteristic elasticity parameter for the surface of that corneal sample. It was seen that outside resonance conditions the bovine cornea was not that much deformed. Through this study, the resonance frequency and the corresponding corneal deformations are mapped and plotted in real time. In these experiments, data was acquired and processed by FRAMES plus computer analysis system. With some analysis of the results, this technique can help us to refine a more detailed corneal surface mathematical model and some preliminary work was done on this. Such modelling enhancements may be useful for finer ablative surgery planning. After further experimentation

  19. Thermal dynamics of silver clusters grown on rippled silica surfaces

    NASA Astrophysics Data System (ADS)

    Bhatnagar, Mukul; Ranjan, Mukesh; Jolley, Kenny; Lloyd, Adam; Smith, Roger; Mukherjee, Subroto

    2017-02-01

    Silver nanoparticles have been deposited on silicon rippled patterned templates at an angle of incidence of 70° to the surface normal. The templates are produced by oblique incidence argon ion bombardment and as the fluence increases, the periods and heights of the structures increase. Structures with periods of 20 nm, 35 nm and 45 nm have been produced. Moderate temperature vacuum annealing shows the phenomenon of cluster coalescence following the contour of the more exposed faces of the ripple for the case of 35 nm and 45 nm but not at 20 nm where the silver aggregates into larger randomly distributed clusters. In order to understand this effect, the morphological changes of silver nanoparticles deposited on an asymmetric rippled silica surface are investigated through the use of molecular dynamics simulations for different deposition angles of incidence between 0° and 70° and annealing temperatures between 500 K and 900 K. Near to normal incidence, clusters are observed to migrate over the entire surface but for deposition at 70°, a similar patterning is observed as in the experiment. The random distribution of clusters for the periodicity ≈ of 20 nm is linked to the geometry of the silica surface which has a lower ripple height than the longer wavelength structures. Calculations carried out on a surface with such a lower ripple height also demonstrate a similar effect.

  20. Tracer surface diffusion at high pressures: Molecular-dynamics study

    NASA Astrophysics Data System (ADS)

    Zeiri, Yehuda

    2000-09-01

    Molecular-dynamics simulations were employed to investigate the influence of high pressure on tracer surface diffusion. A model potential was used to describe the interaction among the various species in the system. The different binding energy values and masses used in this model simulation correspond to surface diffusion of N2 on Ru(001) surface under pressure of Ar. A pronounced enhancement in the magnitude of the diffusion coefficients was observed when pressure increased from P=0 to P=200 atm. The relationship between diffusion coefficient and three parameters that characterize the system was explored. It was found that the gas temperature and the nature of gas-adsorbate interaction (i.e., attractive or repulsive) have only a negligible influence on the diffusion coefficient. However, a marked variation in the diffusion coefficient was observed when the magnitude of gas-substrate binding energy was altered. The temperature dependence of the surface diffusion coefficient exhibits an Arrhenius behavior for all cases investigated. The relationship between the pressure and both pre-exponential factor and activation energy for surface diffusion was discussed based on a detailed analysis of the diffusion mechanism. The diffusion mechanism was deduced by careful examination of large number of individual trajectories.

  1. Noncontact friction and relaxational dynamics of surface defects.

    PubMed

    She, Jian-Huang; Balatsky, Alexander V

    2012-03-30

    The motion of a cantilever near sample surfaces exhibits additional friction even before two bodies come into mechanical contact. Called noncontact friction (NCF), this friction is of great practical importance to the ultrasensitive force detection measurements. The observed large NCF of a micron-scale cantilever found an anomalously large damping that exceeds theoretical predictions by 8-11 orders of magnitude. This finding points to a contribution beyond fluctuating electromagnetic fields within the van der Waals approach. Recent experiments reported by Saitoh et al. [Phys. Rev. Lett. 105, 236103 (2010)] also found a nontrivial distance dependence of NCF. Motivated by these observations, we propose a mechanism based on the coupling of a cantilever to the relaxation dynamics of surface defects. We assume that the surface defects couple to the cantilever tip via spin-spin coupling and their spin relaxation dynamics gives rise to the backaction terms and modifies both the friction coefficient and the spring constant. We explain the magnitude, as well as the distance dependence of the friction due to these backaction terms. Reasonable agreement is found with the experiments.

  2. Dynamic effects induced transition of droplets on biomimetic superhydrophobic surfaces.

    PubMed

    Jung, Yong Chae; Bhushan, Bharat

    2009-08-18

    Superhydrophobic surfaces have considerable technological potential for various applications because of their extreme water-repellent properties. Dynamic effects, such as the bouncing and vibration of a droplet, can destroy the composite solid-air-liquid interface. The impact pressure of a bouncing droplet and the inertia force of a vibrating droplet affect the transition from a solid-air-liquid interface to a solid-liquid interface. Therefore, it is necessary to study the dynamic effect of droplets under various system parameters (impact velocity and frequency and amplitude of vibration). A new model for the prediction of the wetting and dewetting process during droplet vibration based on the relationship between the adhesion force and the inertia force of a droplet is proposed. To investigate whether micro-, nano-, and hierarchical structures can resist the destabilizing factors responsible for the transition, a study of bouncing and vibration of a water droplet is systematically conducted on various surfaces. The physics of wetting phenomena for water droplet studies is of fundamental importance in the geometrical design of superhydrophobic surfaces.

  3. Droplets impact on textured surfaces: Mesoscopic simulation of spreading dynamics

    NASA Astrophysics Data System (ADS)

    Wang, Yuxiang; Chen, Shuo

    2015-02-01

    Superhydrophobic surfaces have attracted much attention due to their excellent water-repellent property. In the present study, droplets in the ideal Cassie state were focused on, and a particle-based numerical method, many-body dissipative particle dynamics, was employed to explore the mechanism of droplets impact on textured surfaces. A solid-fluid interaction with three linear weight functions was used to generate different wettability and a simple but efficient method was introduced to compute the contact angle. The simulated results show that the static contact angle is in good agreement with the Cassie-Baxter formula for smaller ∅S and Fa, but more deviation will be produced for larger ∅S and Fa, and it is related to the fact that the Cassie-Baxter theory does not consider the contact angle hysteresis effect in their formula. Furthermore, high impact velocity can induce large contact angle hysteresis on textured surfaces with larger ∅S and Fa. The typical time-based evolutions of the spreading diameter were simulated, and they were analyzed from an energy transformation viewpoint. These results also show that the dynamical properties of droplet, such as rebounding or pinning, contact time and maximum spreading diameters, largely depend on the comprehensive effects of the material wettability, fraction of the pillars and impact velocities of the droplets.

  4. The molecular dissociation of formaldehyde at medium photoexcitation energies: A quantum chemistry and direct quantum dynamics study

    SciTech Connect

    Araujo, Marta; Magalhaes, Alexandre L.; Lasorne, Benjamin; Worth, Graham A.; Bearpark, Michael J.; Robb, Michael A.

    2009-10-14

    The mechanisms of radiationless decay involved in the photodissociation of formaldehyde into H{sub 2} and CO have been investigated using complete active space self-consistent field (CASSCF) calculations and direct dynamics variational multiconfiguration Gaussian (DD-vMCG) quantum dynamics in the S{sub 1}, T{sub 1}, and S{sub 0} states. A commonly accepted scheme involves Fermi Golden Rule internal conversion from S{sub 1} followed by dissociation of vibrationally hot H{sub 2}CO in S{sub 0}. We recently proposed a novel mechanism [M. Araujo et al., J. Phys. Chem. A 112, 7489 (2008)] whereby internal conversion and dissociation take place in concert through a seam of conical intersection between S{sub 1} and S{sub 0} after the system has passed through an S{sub 1} transition barrier. The relevance of this mechanism depends on the efficiency of tunneling in S{sub 1}. At lower energy, an alternative scheme to internal conversion involves intersystem crossing via T{sub 1} to regenerate the reactant before the S{sub 0} barrier to dissociation. We propose here a previously unidentified mechanism leading directly to H{sub 2} and CO products via T{sub 1}. This channel opens at medium energies, near or above the T{sub 1} barrier to dissociation and still lower than the S{sub 1} barrier, thus making T{sub 1} a possible shortcut to molecular dissociation.

  5. A molecular dynamics study on the transport of a charged biomolecule in a polymeric adsorbent medium and its adsorption onto a charged ligand

    NASA Astrophysics Data System (ADS)

    Riccardi, E.; Wang, J.-C.; Liapis, A. I.

    2010-08-01

    The transport of a charged adsorbate biomolecule in a porous polymeric adsorbent medium and its adsorption onto the covalently immobilized ligands have been modeled and investigated using molecular dynamics modeling and simulations as the third part of a novel fundamental methodology developed for studying ion-exchange chromatography based bioseparations. To overcome computational challenges, a novel simulation approach is devised where appropriate atomistic and coarse grain models are employed simultaneously and the transport of the adsorbate is characterized through a number of locations representative of the progress of the transport process. The adsorbate biomolecule for the system studied in this work changes shape, orientation, and lateral position in order to proceed toward the site where adsorption occurs and exhibits decreased mass transport coefficients as it approaches closer to the immobilized ligand. Furthermore, because the ligands are surrounded by counterions carrying the same type of charge as the adsorbate biomolecule, it takes the biomolecule repeated attempts to approach toward a ligand in order to displace the counterions in the proximity of the ligand and to finally become adsorbed. The formed adsorbate-ligand complex interacts with the counterions and polymeric molecules and is found to evolve slowly and continuously from one-site (monovalent) interaction to multisite (multivalent) interactions. Such a transition of the nature of adsorption reduces the overall adsorption capacity of the ligands in the adsorbent medium and results in a type of surface exclusion effect. Also, the adsorption of the biomolecule also presents certain volume exclusion effects by not only directly reducing the pore volume and the availability of the ligands in the adjacent regions, but also causing the polymeric molecules to change to more compact structures that could further shield certain ligands from being accessible to subsequent adsorbate molecules. These

  6. A molecular dynamics study on the transport of a charged biomolecule in a polymeric adsorbent medium and its adsorption onto a charged ligand.

    PubMed

    Riccardi, E; Wang, J-C; Liapis, A I

    2010-08-28

    The transport of a charged adsorbate biomolecule in a porous polymeric adsorbent medium and its adsorption onto the covalently immobilized ligands have been modeled and investigated using molecular dynamics modeling and simulations as the third part of a novel fundamental methodology developed for studying ion-exchange chromatography based bioseparations. To overcome computational challenges, a novel simulation approach is devised where appropriate atomistic and coarse grain models are employed simultaneously and the transport of the adsorbate is characterized through a number of locations representative of the progress of the transport process. The adsorbate biomolecule for the system studied in this work changes shape, orientation, and lateral position in order to proceed toward the site where adsorption occurs and exhibits decreased mass transport coefficients as it approaches closer to the immobilized ligand. Furthermore, because the ligands are surrounded by counterions carrying the same type of charge as the adsorbate biomolecule, it takes the biomolecule repeated attempts to approach toward a ligand in order to displace the counterions in the proximity of the ligand and to finally become adsorbed. The formed adsorbate-ligand complex interacts with the counterions and polymeric molecules and is found to evolve slowly and continuously from one-site (monovalent) interaction to multisite (multivalent) interactions. Such a transition of the nature of adsorption reduces the overall adsorption capacity of the ligands in the adsorbent medium and results in a type of surface exclusion effect. Also, the adsorption of the biomolecule also presents certain volume exclusion effects by not only directly reducing the pore volume and the availability of the ligands in the adjacent regions, but also causing the polymeric molecules to change to more compact structures that could further shield certain ligands from being accessible to subsequent adsorbate molecules. These

  7. Dynamics and transport properties of three surface quasigeostrophic point vortices

    NASA Astrophysics Data System (ADS)

    Taylor, C. K.; Llewellyn Smith, Stefan G.

    2016-11-01

    The surface quasi-geostrophic (SQG) equations are a model for low-Rossby number geophysical flows in which the dynamics are governed by potential temperature dynamics on the boundary. We examine point vortex solutions to this model as well as the chaotic flows induced by three point vortices. The chaotic transport induced by these flows is investigated using techniques of Poincaré maps and the Finite Time Braiding Exponent (FTBE). This chaotic transport is representative of the mixing in the flow, and these terms are used interchangeably in this work. Compared with point vortices in two-dimensional flow, the SQG vortices are found to produce flows with higher FTBE, indicating more mixing. Select results are presented for analyzing mixing for arbitrary vortex strengths.

  8. Dynamics and transport properties of three surface quasigeostrophic point vortices.

    PubMed

    Taylor, C K; Llewellyn Smith, Stefan G

    2016-11-01

    The surface quasi-geostrophic (SQG) equations are a model for low-Rossby number geophysical flows in which the dynamics are governed by potential temperature dynamics on the boundary. We examine point vortex solutions to this model as well as the chaotic flows induced by three point vortices. The chaotic transport induced by these flows is investigated using techniques of Poincaré maps and the Finite Time Braiding Exponent (FTBE). This chaotic transport is representative of the mixing in the flow, and these terms are used interchangeably in this work. Compared with point vortices in two-dimensional flow, the SQG vortices are found to produce flows with higher FTBE, indicating more mixing. Select results are presented for analyzing mixing for arbitrary vortex strengths.

  9. Adaptive integral dynamic surface control of a hypersonic flight vehicle

    NASA Astrophysics Data System (ADS)

    Aslam Butt, Waseem; Yan, Lin; Amezquita S., Kendrick

    2015-07-01

    In this article, non-linear adaptive dynamic surface air speed and flight path angle control designs are presented for the longitudinal dynamics of a flexible hypersonic flight vehicle. The tracking performance of the control design is enhanced by introducing a novel integral term that caters to avoiding a large initial control signal. To ensure feasibility, the design scheme incorporates magnitude and rate constraints on the actuator commands. The uncertain non-linear functions are approximated by an efficient use of the neural networks to reduce the computational load. A detailed stability analysis shows that all closed-loop signals are uniformly ultimately bounded and the ? tracking performance is guaranteed. The robustness of the design scheme is verified through numerical simulations of the flexible flight vehicle model.

  10. Frictional dynamics of viscoelastic solids driven on a rough surface.

    PubMed

    Landes, François P; Rosso, Alberto; Jagla, E A

    2015-07-01

    We study the effect of viscoelastic dynamics on the frictional properties of a (mean-field) spring-block system pulled on a rough surface by an external drive. When the drive moves at constant velocity V, two dynamical regimes are observed: at fast driving, above a critical threshold V(c), the system slides at the drive velocity and displays a friction force with velocity weakening. Below V(c) the steady sliding becomes unstable and a stick-slip regime sets in. In the slide-hold-slide driving protocol, a peak of the friction force appears after the hold time and its amplitude increases with the hold duration. These observations are consistent with the frictional force encoded phenomenologically in the rate-and-state equations. Our model gives a microscopical basis for such macroscopic description.

  11. Dynamic Scaling of Island-size Distribution on Anisotropic Surfaces

    NASA Astrophysics Data System (ADS)

    Li, Maozhi; Wang, E. G.; Liu, Banggui; Zhang, Zhenyu

    2002-03-01

    Dynamic scaling of island-size distribution on isotropic and anisotropic surfaces in submonolayer growth is systematically studied using kinetic Monte Carlo simulations. It is found that the island-size distribution in anisotropic submonolayer growth exhibits a general dynamic scaling behavior. An analytic expression is proposed for the scaling function, and is compared with the simulation results. This scaling function not only improves previous results for the isotropic growth (1), but also describes the scaling behavior of the island-size distribution in anisotropic submonolayer growth very well (2). 1. J. G. Amar and F. Family, Phys. Rev. Lett. 74, 2066 (1995). 2. M. Z. Li, E. G. Wang, B. G. Liu, and Z. Y. Zhang, Phys. Rev. Lett. (submitted).

  12. Vertical dynamics of a horizontally oscillating active object in a two-dimensional granular medium.

    PubMed

    Huang, Ling; Ran, Xianwen; Blumenfeld, Raphael

    2016-12-01

    We use a discrete-element method simulation and analytical considerations to study the dynamics of a self-energized object, modeled as a disk, oscillating horizontally within a two-dimensional bed of denser and smaller particles. We find that, for given material parameters, the immersed object (IO) may rise, sink, or not change depth, depending on the oscillation amplitude and frequency, as well as on the initial depth. With time, the IO settles at a specific depth that depends on the oscillation parameters. We construct a phase diagram of this behavior in the oscillation frequency and velocity amplitude variable space. We explain the observed rich behavior by two competing effects: climbing on particles, which fill voids opening under the disk, and sinking due to bed fluidization. We present a cavity model that allows us to derive analytically general results, which agree very well with the observations and explain quantitatively the phase diagram. Our specific analytical results are the following. (i) Derivation of a critical frequency, f_{c}, above which the IO cannot float up against gravity. We show that this frequency depends only on the gravitational acceleration and the IO size. (ii) Derivation of a minimal amplitude, A_{min}, below which the IO cannot rise even if the frequency is below f_{c}. We show that this amplitude also depends only on the gravitational acceleration and the IO size. (iii) Derivation of a critical value, g_{c}, of the IO's acceleration amplitude, below which the IO cannot sink. We show that the value of g_{c} depends on the characteristics of both the IO and the granular bed, as well as on the initial IO's depth.

  13. Short- and medium-range structure of amorphous zircon from molecular dynamics simulations

    SciTech Connect

    Du, Jincheng; Devanathan, Ram; Corrales, Louis R.; Weber, William J.; Cormack, Alastair N.

    2006-12-18

    We have obtained new insights into the structure of amorphous zircon using classical molecular dynamics simulations with a partial charge model. We present detailed structural characterizations of the simulated high and low density amorphous zircon and compare our results with available neutron diffraction, EXAFS, NMR and other experimental results. The results show that amorphization leads to polymerization of the silicon-oxygen network and the formation of regions rich in zirconium. The average n value of Qn species is 1.6-1.8. A considerable percentage of the oxygen ions (around 20%) have only zirconium in the first coordination shell (free oxygen) in amorphous zircon. The Zr-O bond length (around 2.10?) is shorter and the oxygen coordination number around zirconium smaller (6-7) than those in crystalline zircon, in good agreement with the EXAFS results. The total structure factors of simulated amorphous zircon also agree well with neutron diffraction results. We have examined the effects of the simulation cell size and relative density on the amorphous structure. The general features such as polymerization of silicon-oxygen network and the formation of clustered zirconium rich regions appear to be independent of system size and volume expansion in the range of 11 to 18%. Based on the obtained amorphous zircon structure, experimentally observed lower chemical durability of amorphous zircon compared to its crystalline form can be explained by the existence of the silicon-oxygen networks and zirconium rich regions in amorphous zircon that provides diffusion channels and eases dissolution processes. Battelle operates PNNL for the USDOE

  14. Vertical dynamics of a horizontally oscillating active object in a two-dimensional granular medium

    NASA Astrophysics Data System (ADS)

    Huang, Ling; Ran, Xianwen; Blumenfeld, Raphael

    2016-12-01

    We use a discrete-element method simulation and analytical considerations to study the dynamics of a self-energized object, modeled as a disk, oscillating horizontally within a two-dimensional bed of denser and smaller particles. We find that, for given material parameters, the immersed object (IO) may rise, sink, or not change depth, depending on the oscillation amplitude and frequency, as well as on the initial depth. With time, the IO settles at a specific depth that depends on the oscillation parameters. We construct a phase diagram of this behavior in the oscillation frequency and velocity amplitude variable space. We explain the observed rich behavior by two competing effects: climbing on particles, which fill voids opening under the disk, and sinking due to bed fluidization. We present a cavity model that allows us to derive analytically general results, which agree very well with the observations and explain quantitatively the phase diagram. Our specific analytical results are the following. (i) Derivation of a critical frequency, fc, above which the IO cannot float up against gravity. We show that this frequency depends only on the gravitational acceleration and the IO size. (ii) Derivation of a minimal amplitude, Amin, below which the IO cannot rise even if the frequency is below fc. We show that this amplitude also depends only on the gravitational acceleration and the IO size. (iii) Derivation of a critical value, gc, of the IO's acceleration amplitude, below which the IO cannot sink. We show that the value of gc depends on the characteristics of both the IO and the granular bed, as well as on the initial IO's depth.

  15. The Dynamics and Afterglow Radiation of Gamma-Ray Bursts. I. Constant Density Medium

    NASA Astrophysics Data System (ADS)

    Zhang, Weiqun; MacFadyen, Andrew

    2009-06-01

    Direct multidimensional numerical simulation is the most reliable approach for calculating the fluid dynamics and observational signatures of relativistic jets in gamma-ray bursts (GRBs). We present a two-dimensional relativistic hydrodynamic simulation of a GRB outflow during the afterglow phase, which uses the fifth-order weighted essentially nonoscillatory scheme and adaptive mesh refinement. Initially, the jet has a Lorentz factor of 20. We have followed its evolution up to 150 years. Using the hydrodynamic data, we calculate synchrotron radiation based upon standard afterglow models and compare our results with previous analytic work. We find that the sideways expansion of a relativistic GRB jet is a very slow process and previous analytic works have overestimated its rate. In our computed light curves, a very sharp jet break is seen and the postbreak light curves are steeper than analytic predictions. We find that the jet break in GRB afterglow light curves is mainly caused by the missing flux when the edge of the jet is observed. The outflow becomes nonrelativistic at the end of the Blandford-McKee phase. But it is still highly nonspherical, and it takes a rather long time for it to become a spherical Sedov-von Neumann-Taylor blast wave. We find that the late-time afterglows become increasingly flatter over time. But we disagree with the common notion that there is a sudden flattening in light curves due to the transition into the Sedov-von Neumann-Taylor solution. We have also found that there is a bump in light curves at very late times (~1000 days) due to radiation from the counter jet. We speculate that such a counter jet bump might have already been observed in GRB 980703.

  16. Pairwise Force Smoothed Particle Hydrodynamics model for multiphase flow: Surface tension and contact line dynamics

    NASA Astrophysics Data System (ADS)

    Tartakovsky, Alexandre M.; Panchenko, Alexander

    2016-01-01

    We present a novel formulation of the Pairwise Force Smoothed Particle Hydrodynamics (PF-SPH) model and use it to simulate two- and three-phase flows in bounded domains. In the PF-SPH model, the Navier-Stokes equations are discretized with the Smoothed Particle Hydrodynamics (SPH) method, and the Young-Laplace boundary condition at the fluid-fluid interface and the Young boundary condition at the fluid-fluid-solid interface are replaced with pairwise forces added into the Navier-Stokes equations. We derive a relationship between the parameters in the pairwise forces and the surface tension and static contact angle. Next, we demonstrate the model's accuracy under static and dynamic conditions. Finally, we use the Pf-SPH model to simulate three phase flow in a porous medium.

  17. Surface dating of dynamic landforms: young boulders on aging moraines.

    PubMed

    Hallet, B; Putkonen, J

    1994-08-12

    The dating of landforms is crucial to understanding the evolution, history, and stability of landscapes. Cosmogenic isotope analysis has recently been used to determine quantitative exposure ages for previously undatable landform surfaces. A pioneering application of this technique to date moraines illustrated its considerable potential but suggested a chronology partially inconsistent with existing geological data. Consideration of the dynamic nature of landforms and of the ever-present processes of erosion, deposition, and weathering leads to a resolution of this inconsistency and, more generally, offers guidance for realistic interpretation of exposure ages.

  18. Structure and Dynamics of Octamethylcyclotetrasiloxane Confined between Mica Surfaces.

    PubMed

    Vadhana, V; Ayappa, K G

    2016-03-24

    Using a molecular model for octamethylcyclotetrasiloxane (OMCTS), molecular dynamics simulations are carried out to probe the phase state of OMCTS confined between two mica surfaces in equilibrium with a reservoir. Molecular dynamics simulations are carried out for elevations ranging from 5 to 35 K above the melting point for the OMCTS model used in this study. The Helmholtz free energy is computed for a specific confinement using the two-phase thermodynamic (2PT) method. Analysis of the in-plane pair correlation functions did not reveal signatures of freezing even under an extreme confinement of two layers. OMCTS is found to orient with a wide distribution of orientations with respect to the mica surface, with a distinct preference for the surface parallel configuration in the contact layers. The self-intermediate scattering function is found to decay with increasing relaxation times as the surface separation is decreased, and the two-step relaxation in the scattering function, a signature of glassy dynamics, distinctly evolves as the temperature is lowered. However, even at 5 K above the melting point, we did not observe a freezing transition and the self-intermediate scattering functions relax within 200 ps for the seven-layered confined system. The self-diffusivity and relaxation times obtained from the Kohlrausch-Williams-Watts stretched exponential fits to the late α-relaxation exhibit power law scalings with the packing fraction as predicted by mode coupling theory. A distinct discontinuity in the Helmholtz free energy, potential energy, and a sharp change in the local bond order parameter, Q4, was observed at 230 K for a five-layered system upon cooling, indicative of a first-order transition. A freezing point depression of about 30 K was observed for this five-layered confined system, and at the lower temperatures, contact layers were found to be disordered with long-range order present only in the inner layers. These dynamical signatures indicate that

  19. Development of a practical and cost-effective medium for bioethanol production from the seaweed hydrolysate in surface-aerated fermentor by repeated-batch operation.

    PubMed

    Lee, Sang-Eun; Lee, Ji-Eun; Shin, Ga-Young; Choi, Woon Yong; Kang, Do Hyung; Lee, Hyeon-Yong; Jung, Kyung-Hwan

    2012-01-01

    To develop a practical and cost-effective medium for bioethanol production from the hydrolysate of seaweed Sargassum sagamianum, we investigated the feasibility and performance of bioethanol production in CSL (cornsteep liquor)-containing medium, where yeast Pichia stipitis was used and the repeated batch was carried out in a surface-aerated fermentor. The optimal medium replacement time during the repeated operation was determined to be 36 h, and the surface aeration rates were 30 and 100 ml/min. Under these conditions, the repeatedbatch operation was successfully carried out for 6 runs (216 h), in which the maximum bioethanol concentrations reached about 11-12 g/l at each batch operation. These results demonstrated that bioethanol production could be carried out repeatedly and steadily for 216 h. In these experiments, the total cumulative bioethanol production was 57.9 g and 58.0 g when the surface aeration rates were 30 ml/min and 100 ml/min, respectively. In addition, the bioethanol yields were 0.43 (about 84% of theoretical value) and 0.44 (about 86% of theoretical value) when the surface aeration rates were 30 ml/min and 100 ml/min, respectively. CSL was successfully used as a medium ingredient for the bioethanol production from the hydrolysate of seaweed Sargassum sagamianum, indicating that this medium may be practical and cost-effective for bioethanol production.

  20. Surface conductivity dependent dynamic behaviour of an ultrafine atmospheric pressure plasma jet for microscale surface processing

    NASA Astrophysics Data System (ADS)

    Abuzairi, Tomy; Okada, Mitsuru; Bhattacharjee, Sudeep; Nagatsu, Masaaki

    2016-12-01

    An experimental study on the dynamic behaviour of microcapillary atmospheric pressure plasma jets (APPJs) with 5 μm tip size for surfaces of different conductivity is reported. Electrical and spatio-temporal characteristics of the APPJs are monitored using high voltage probe, current monitor and high speed intensified charge couple device camera. From these experimental results, we presented a simple model to understand the electrical discharge characteristics of the capillary APPJs with double electrodes, and estimated the velocity of the ionization fronts in the jet and the electron density to be 3.5-4.2 km/s and 2-7 × 1017 m-3. By analyzing the dynamics of the microcapillary APPJs for different substrate materials, it was found that the surface irradiation area strongly depended on the substrate conductivity and permittivity, especially in the case of polymer-like substrate, surface irradiation area was significantly broadened probably due to the repelling behaviour of the plasma jets from the accumulated electrical charges on the polymer surface. The effect of applying a substrate bias in the range from -900 V to +900 V on the plasma irradiation onto the substrates was also investigated. From the knowledge of the present results, it is helpful for choosing the substrate materials for microscale surface modification.

  1. Wetting dynamics of colloidal dispersions on agar gel surfaces.

    PubMed

    Seino, Eri; Chida, Shigeki; Mayama, Hiroyuki; Hotta, Jun-ichi; Nonomura, Yoshimune

    2014-10-01

    The effects of silica particle addition on the wetting velocity on flat and fractal agar gel surfaces were analyzed along with the applicability of such particles for controlling the wetting dynamics of water. The contact angles (θD) of the colloidal dispersions obeyed the power law, i.e., θD∝t(-x), where t is time and x is a constant. Wetting was inhibited by the addition of a suitable amount of 20-nm-diameter silica particles. Specifically, the exponent x reached a minimum value for a silica composition of 0.1wt%. However, such inhibition effects were not observed upon the addition of silica particles with diameters of 100, 550, and, 1000nm. The mechanism of the inhibition of the liquid wetting on gel surfaces may be attributed to a slight increase in local viscosity around the contact line during wetting. Copyright © 2014 Elsevier B.V. All rights reserved.

  2. Drops subjected to surface acoustic waves: flow dynamics

    NASA Astrophysics Data System (ADS)

    Brunet, Philippe; Baudoin, Michael; Bou Matar, Olivier; Dynamique Des Systèmes Hors Equilibre Team; Aiman-Films Team

    2012-11-01

    Ultrasonic acoustic waves of frequency beyond the MHz are known to induce streaming flow in fluids that can be suitable to perform elementary operations in microfluidics systems. One of the currently appealing geometry is that of a sessile drop subjected to surface acoustic waves (SAW). Such Rayleigh waves produce non-trival actuation in the drop leading to internal flow, drop displacement, free-surface oscillations and atomization. We recently carried out experiments and numerical simulations that allowed to better understand the underlying physical mechanisms that couple acoustic propagation and fluid actuation. We varied the frequency and amplitude of actuation, as well as the properties of the fluid, and we measured the effects of these parameters on the dynamics of the flow. We compared these results to finite-elements numerical simulations.

  3. Dynamic growth of slip surfaces in catastrophic landslides

    PubMed Central

    Germanovich, Leonid N.; Kim, Sihyun; Puzrin, Alexander M.

    2016-01-01

    This work considers a landslide caused by the shear band that emerges along the potential slip (rupture) surface. The material above the band slides downwards, causing the band to grow along the slope. This growth may first be stable (progressive), but eventually becomes dynamic (catastrophic). The landslide body acquires a finite velocity before it separates from the substrata. The corresponding initial-boundary value problem for a dynamic shear band is formulated within the framework of Palmer & Rice's (Proc. R. Soc. Lond. A 332, 527–548. (doi:10.1098/rspa.1973.0040)) approach, which is generalized to the dynamic case. We obtain the exact, closed-form solution for the band velocity and slip rate. This solution assesses when the slope fails owing to a limiting condition near the propagating tip of the shear band. Our results are applicable to both submarine and subaerial landslides of this type. It appears that neglecting dynamic (inertia) effects can lead to a significant underestimation of the slide size, and that the volumes of catastrophic slides can exceed the volumes of progressive slides by nearly a factor of 2. As examples, we consider the Gaviota and Humboldt slides offshore of California, and discuss landslides in normally consolidated sediments and sensitive clays. In particular, it is conceivable that Humboldt slide is unfinished and may still displace a large volume of sediments, which could generate a considerable tsunami. We show that in the case of submarine slides, the effect of water resistance on the shear band dynamics may frequently be limited during the slope failure stage. For a varying slope angle, we formulate a condition of slide cessation. PMID:26997904

  4. Dynamic growth of slip surfaces in catastrophic landslides.

    PubMed

    Germanovich, Leonid N; Kim, Sihyun; Puzrin, Alexander M

    2016-01-01

    This work considers a landslide caused by the shear band that emerges along the potential slip (rupture) surface. The material above the band slides downwards, causing the band to grow along the slope. This growth may first be stable (progressive), but eventually becomes dynamic (catastrophic). The landslide body acquires a finite velocity before it separates from the substrata. The corresponding initial-boundary value problem for a dynamic shear band is formulated within the framework of Palmer & Rice's (Proc. R. Soc. Lond. A332, 527-548. (doi:10.1098/rspa.1973.0040)) approach, which is generalized to the dynamic case. We obtain the exact, closed-form solution for the band velocity and slip rate. This solution assesses when the slope fails owing to a limiting condition near the propagating tip of the shear band. Our results are applicable to both submarine and subaerial landslides of this type. It appears that neglecting dynamic (inertia) effects can lead to a significant underestimation of the slide size, and that the volumes of catastrophic slides can exceed the volumes of progressive slides by nearly a factor of 2. As examples, we consider the Gaviota and Humboldt slides offshore of California, and discuss landslides in normally consolidated sediments and sensitive clays. In particular, it is conceivable that Humboldt slide is unfinished and may still displace a large volume of sediments, which could generate a considerable tsunami. We show that in the case of submarine slides, the effect of water resistance on the shear band dynamics may frequently be limited during the slope failure stage. For a varying slope angle, we formulate a condition of slide cessation.

  5. Pseudospectral Gaussian quantum dynamics: Efficient sampling of potential energy surfaces.

    PubMed

    Heaps, Charles W; Mazziotti, David A

    2016-04-28

    Trajectory-based Gaussian basis sets have been tremendously successful in describing high-dimensional quantum molecular dynamics. In this paper, we introduce a pseudospectral Gaussian-based method that achieves accurate quantum dynamics using efficient, real-space sampling of the time-dependent basis set. As in other Gaussian basis methods, we begin with a basis set expansion using time-dependent Gaussian basis functions guided by classical mechanics. Unlike other Gaussian methods but characteristic of the pseudospectral and collocation methods, the basis set is tested with N Dirac delta functions, where N is the number of basis functions, rather than using the basis function as test functions. As a result, the integration for matrix elements is reduced to function evaluation. Pseudospectral Gaussian dynamics only requires O(N) potential energy calculations, in contrast to O(N(2)) evaluations in a variational calculation. The classical trajectories allow small basis sets to sample high-dimensional potentials. Applications are made to diatomic oscillations in a Morse potential and a generalized version of the Henon-Heiles potential in two, four, and six dimensions. Comparisons are drawn to full analytical evaluation of potential energy integrals (variational) and the bra-ket averaged Taylor (BAT) expansion, an O(N) approximation used in Gaussian-based dynamics. In all cases, the pseudospectral Gaussian method is competitive with full variational calculations that require a global, analytical, and integrable potential energy surface. Additionally, the BAT breaks down when quantum mechanical coherence is particularly strong (i.e., barrier reflection in the Morse oscillator). The ability to obtain variational accuracy using only the potential energy at discrete points makes the pseudospectral Gaussian method a promising avenue for on-the-fly dynamics, where electronic structure calculations become computationally significant.

  6. PLLA/ZnO nanocomposites: Dynamic surfaces to harness cell differentiation.

    PubMed

    Trujillo, Sara; Lizundia, Erlantz; Vilas, José Luis; Salmeron-Sanchez, Manuel

    2016-08-01

    This work investigates the effect of the sequential availability of ZnO nanoparticles, (nanorods of ∼40nm) loaded within a degradable poly(lactic acid) (PLLA) matrix, in cell differentiation. The system constitutes a dynamic surface, in which nanoparticles are exposed as the polymer matrix degrades. ZnO nanoparticles were loaded into PLLA and the system was measured at different time points to characterise the time evolution of the physicochemical properties, including wettability and thermal properties. The micro and nanostructure were also investigated using AFM, SEM and TEM images. Cellular experiments with C2C12 myoblasts show that cell differentiation was significantly enhanced on ZnO nanoparticles-loaded PLLA, as the polymer degrades and the availability of nanoparticles become more apparent, whereas the release of zinc within the culture medium was negligible. Our results suggest PLLA/ZnO nanocomposites can be used as a dynamic system where nanoparticles are exposed during degradation, activating the material surface and driving cell differentiation.

  7. Molecular dynamics simulation of UO 2 nanocrystals surface

    NASA Astrophysics Data System (ADS)

    Boyarchenkov, A. S.; Potashnikov, S. I.; Nekrasov, K. A.; Kupryazhkin, A. Ya.

    2012-02-01

    In this article we investigated surface of nanocrystals (NCs) of uranium dioxide (UO 2) using molecular dynamics (MD) under isolated (non-periodic) boundary conditions in the approximation of rigid ions and pair potentials (RIPI). It is shown that a cubic shape of NCs is metastable and equilibrium is reached in the process of structural relaxation to the octahedral shape during long simulations of 1000 ns (200 million MD steps), which increase with the size of NC. We measured the size dependences of the lattice parameter and the surface energy density of cubic and octahedral NCs with volumes up to 1000 nm 3 (50 000 particles) at temperatures of 2200 K and 2300 K. For the surfaces {1 0 0} and {1 1 1} we obtained the energy densities σ100 = 1.60 ± 0.02 J/m 2, σ111 = 1.14 ± 0.03 J/m 2 and surface tension constant γ111 = 0.841 ± 0.008 J/m 2. The resulting ratio of σ100/ σ111 = 1.41 ± 0.04 within the error coincides with the experimental value of 1.42 ± 0.05 measured for microscopic cavities in UO 2 monocrystals.

  8. Can foot anthropometric measurements predict dynamic plantar surface contact area?

    PubMed

    McPoil, Thomas G; Vicenzino, Bill; Cornwall, Mark W; Collins, Natalie

    2009-10-28

    Previous studies have suggested that increased plantar surface area, associated with pes planus, is a risk factor for the development of lower extremity overuse injuries. The intent of this study was to determine if a single or combination of foot anthropometric measures could be used to predict plantar surface area. Six foot measurements were collected on 155 subjects (97 females, 58 males, mean age 24.5 +/- 3.5 years). The measurements as well as one ratio were entered into a stepwise regression analysis to determine the optimal set of measurements associated with total plantar contact area either including or excluding the toe region. The predicted values were used to calculate plantar surface area and were compared to the actual values obtained dynamically using a pressure sensor platform. A three variable model was found to describe the relationship between the foot measures/ratio and total plantar contact area (R2 = 0.77, p < 0.0001)). A three variable model was also found to describe the relationship between the foot measures/ratio and plantar contact area minus the toe region (R2 = 0.76, p < 0.0001). The results of this study indicate that the clinician can use a combination of simple, reliable, and time efficient foot anthropometric measurements to explain over 75% of the plantar surface contact area, either including or excluding the toe region.

  9. Dynamic surface tension of surfactant TA: experiments and theory.

    PubMed

    Otis, D R; Ingenito, E P; Kamm, R D; Johnson, M

    1994-12-01

    A bubble surfactometer was used to measure the surface tension of an aqueous suspension of surfactant TA as a function of bubble area over a range of cycling rates and surfactant bulk concentrations. Results of the surface tension-interfacial area loops exhibited a rich variety of phenomena, the character of which varied systematically with frequency and bulk concentration. A model was developed to interpret and explain these data and for use in describing the dynamics of surface layers under more general circumstances. Surfactant was modeled as a single component with surface tension taken to depend on only the interfacial surfactant concentration. Two distinct mechanisms were considered for the exchange of surfactant between the bulk phase and interface. The first is described by a simple kinetic relationship for adsorption and desorption that pertains only when the interfacial concentration is below its maximum equilibrium value. The second mechanism is "squeeze-out" by which surfactant molecules are expelled from an interface compressed past a maximum packing state. The model provided good agreement with experimental measurements for cycling rates from 1 to 100 cycles/min and for bulk concentrations between 0.0073 and 7.3 mg/ml.

  10. Dynamic and reversible surface topography influences cell morphology.

    PubMed

    Kiang, Jennifer D; Wen, Jessica H; del Álamo, Juan C; Engler, Adam J

    2013-08-01

    Microscale and nanoscale surface topography changes can influence cell functions, including morphology. Although in vitro responses to static topography are novel, cells in vivo constantly remodel topography. To better understand how cells respond to changes in topography over time, we developed a soft polyacrylamide hydrogel with magnetic nickel microwires randomly oriented in the surface of the material. Varying the magnetic field around the microwires reversibly induced their alignment with the direction of the field, causing the smooth hydrogel surface to develop small wrinkles; changes in surface roughness, ΔRRMS , ranged from 0.05 to 0.70 μm and could be oscillated without hydrogel creep. Vascular smooth muscle cell morphology was assessed when exposed to acute and dynamic topography changes. Area and shape changes occurred when an acute topographical change was imposed for substrates exceeding roughness of 0.2 μm, but longer-term oscillating topography did not produce significant changes in morphology irrespective of wire stiffness. These data imply that cells may be able to use topography changes to transmit signals as they respond immediately to changes in roughness. Copyright © 2013 Wiley Periodicals, Inc.

  11. Effect of Molecular Architecture on Polymer Melt Surface Dynamics

    NASA Astrophysics Data System (ADS)

    Foster, Mark

    The dynamics of the thermally stimulated surface height fluctuations in a polymer melt dictate wetting, adhesion, and tribology at that surface. These surface fluctuations can be profoundly altered by tethering of the chains. One type of tethering is the tethering of one part of a molecule to another part of the same molecule. This tethering is found in both long chain branched polymers and in macrocycles. We have studied the surface fluctuations with X-ray Photon Correlation Spectroscopy for melts of well-defined, anionically polymerized polystyrenes of various architectures, including linear, 6 arm star, pom-pom, comb and cyclic architectures. For linear chains, the variation of surface relaxation time with in-plane scattering vector can be fit using a hydrodynamic continuum theory (HCT) of thermally stimulated capillary waves that knows nothing of the chain architecture. Assuming the theory is applicable, apparent viscosities of the films may then be inferred from the XPCS data. For unentangled linear chains, the viscosity inferred from XPCS data in this manner is the same as that measured by conventional bulk rheometry. The HCT does a reasonable job of describing the variation of relaxation time with scattering vector for long branched chains also, but only if a viscosity much larger than that of the bulk is assumed. The discrepancy between the viscosity inferred from surface relaxation times using the HCT and that derived from conventional rheometry grows larger as the bulk Tg is approached and is different for each long chain branched architecture. However, for densely branched combs and cyclic chains different behaviors are found. Acknowledgement: Thanks to NSF (CBET 0730692) and the Advanced Photon Source, supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Science, under Contract No. W-31-109-ENG-38.

  12. Molecular dynamics simulation of silicate glasses and their surfaces

    NASA Astrophysics Data System (ADS)

    Yuan, Xianglong

    1999-12-01

    The bulk and surface structures of vitreous silica and silicate glasses have been modeled using the molecular dynamics technique. An extensive preliminary study, on the influences of different potential models and of different simulation approaches on the final bulk and surface structures, concludes that good result can be obtained using the constant volume simulation with a modified pair-wise potential from van Beest and coworkers, together with alkali-oxygen potential models developed in this study. Glass structures with the reliability factors, Rchi of 7.2% for vitreous silica and 5.6% for sodium silicate have been achieved. The environments of O, Si and Na in silicate glasses have been thoroughly examined. Considerable similarities in local structures exist between crystalline and the simulated glass structures. It is found that our simulated glasses more resemble high-pressured experimental glasses, which is implied by the existence of fivefold silicon species. Based on bulk structures studied, glass surfaces were created by a fracture process. It is speculated that surface defect concentrations depend on the topological characteristics of the network structure, and are essential for the viability of surfaces. Analysis of local structures for difference species implies that the sodium silicate surfaces resemble more the Na-rich regions in the bulk structures. An efficient algorithm for finding primitive rings in a topological network has been developed. Analysis using this algorithm shows that reconstruction of Na-rich regions occurs on extending simulation size, demonstrating simulation size influence on modeled glass structures. Finally, our detailed analysis of Si-O-Si bond angle distributions demonstrates that vitreous silica glass has a broader Si-O-Si BAD, whilst sodium silicate glasses favor narrower distributions.

  13. Coffee-stain growth dynamics on dry and wet surfaces

    NASA Astrophysics Data System (ADS)

    Boulogne, François; Ingremeau, François; Stone, Howard A.

    2017-02-01

    The drying of a drop containing particles often results in the accumulation of the particles at the contact line. In this work, we investigate the drying of an aqueous colloidal drop surrounded by a hydrogel that is also evaporating. We combine theoretical and experimental studies to understand how the surrounding vapor concentration affects the particle deposit during the constant radius evaporation mode. In addition to the common case of evaporation on an otherwise dry surface, we show that in a configuration where liquid is evaporating from a flat surface around the drop, the singularity of the evaporative flux at the contact line is suppressed and the drop evaporation is homogeneous. For both conditions, we derive the velocity field and we establish the temporal evolution of the number of particles accumulated at the contact line. We predict the growth dynamics of the stain and the drying timescales. Thus, dry and wet conditions are compared with experimental results and we highlight that only the dynamics is modified by the evaporation conditions, not the final accumulation at the contact line.

  14. Dynamical Properties of Surface-mounted Dipolar Molecular Rotators

    NASA Astrophysics Data System (ADS)

    Underwood, Jason; Price, John; Caskey, Douglas; Michl, Josef

    2007-03-01

    We use dielectric relaxation spectroscopy (DRS) to study the rotational dynamics of dipolar molecules mounted on fused SiO2 surfaces. Each ``molecular rotor'' consists of three parts: 1) a mounting group for attachment to the substrate, 2) a rotating group having a permanent dipole moment, and 3) an axis connecting the rotor to the attachment group. Attachment is facilitated either by covalent bonding through reaction of silane groups with surface hydroxyls or by van der Waals interactions. Fused SiO2 substrates are patterned with interdigitated electrode Au capacitors (C ˜ 1 pF), and rotor molecule dynamics are characterized by measurement of the capacitance C and loss tangent δ≡ReZ/ImZ. We employ a ratio-transformer bridge technique to measure these quantities, with sensitivities in C and δ of 1 aF and 1 ppm, respectively. A unique aspect of this work is the experimental apparatus, which allows us to prepare sub-monolayer films, determine coverage via two independent methods (DRS and XPS), and study molecule rotational motion, in-situ in ultra-high vacuum. Results will be presented on the kinetics of rotor adsorption/desorption, barrier height and asymmetry of the rotational potential of the molecules, and the effects of varying rotor coverages and adventitious H2O.

  15. Sol-gel-modified boron-doped diamond surfaces for methanol and ethanol electro-oxidation in acid medium

    NASA Astrophysics Data System (ADS)

    Salazar-Banda, G. R.; Suffredini, H. B.; Calegaro, M. L.; Tanimoto, S. T.; Avaca, L. A.

    Studies of the methanol and ethanol electro-oxidation reactions on boron-doped diamond (BDD) electrode surfaces modified with Pt, Pt-RuO 2 and Pt-RuO 2-RhO 2 by the sol-gel method are reported here. The materials were initially characterized by X-ray diffraction (XRD), atomic force microscopy (AFM), scanning electron microscopy (SEM) and energy dispersive X-ray analysis (EDX). The XRD analyses indicate that the sol-gel method produces nano-sized deposits on the BDD surfaces. These deposits also form nano-clusters with a size of ca. 100 nm as observed by SEM and AFM. The EDX maps showed that the metals are homogeneously distributed on the BDD surface and have a composition close to the expected one. Cyclic voltammetry experiments in acid medium revealed that the CO poisoning effect for the methanol and the ethanol oxidation reactions is largely inhibited on the Pt-RuO 2-RhO 2/BDD electrode showing the positive contribution of the rhodium oxide to the electrocatalysts performance in these reactions. Potentiostatic polarization curves and the corresponding Tafel plots showed that the addition of RuO 2 and RhO 2 to Pt/BDD produces a more reactive electrocatalyst that adsorbs methanol and ethanol more efficiently and changes the reactions onsets by 120 or 180 mV towards less positive potentials, respectively. Moreover, the stationary current density measured at a fixed potential for ethanol oxidation on the Pt-RuO 2-RhO 2/BDD composite electrode is more than one order of magnitude larger than on a Pt/BDD surface. In addition, chronoamperometric experiments indicate that on those composite electrodes the effect of CO poisoning only appears after a considerable amount of charge has passed through the interface. Consequently, the catalyst containing Pt, RuO 2 and RhO 2 deposited on BDD by the sol-gel method is a very promising composite material to be used in fuel cell anodes.

  16. Nanostructures and dynamics of macromolecules bound to attractive filler surfaces

    NASA Astrophysics Data System (ADS)

    Koga, Tad; Barkley, Deborah; Jiang, Naisheng; Endoh, Maya; Masui, Tomomi; Kishimoto, Hiroyuki; Nagao, Michihiro; Satija, Sushil; Taniguchi, Takashi

    We report in-situ nanostructures and dynamics of polybutadiene (PB) chains bound to carbon black (CB) fillers (the so-called ``bound polymer layer (BPL)'') in a good solvent. The BPL on the CB fillers were extracted by solvent leaching of a CB-filled PB compound and subsequently dispersed in deuterated toluene to label the BPL for small-angle neutron scattering and neutron spin echo techniques. Intriguingly, the results demonstrate that the BPL is composed of two regions regardless of molecular weights of PB: the inner unswollen region of ~ 0.5 nm thick and outer swollen region where the polymer chains display a parabolic profile with a diffuse tail. This two-layer formation on the filler surface is similar to that reported for polymer chains adsorbed on planar substrates from melts. In addition, the results show that the dynamics of the swollen bound chains can be explained by the so-called ``breathing mode'' and is generalized with the thickness of the swollen BPL. Furthermore, we will discuss how the breathing collective dynamics is affected by the presence of polymer chains in a matrix solution. We acknowledge the financial support from NSF Grant No. CMMI-1332499.

  17. Muscular endurance and surface electromyogram in isometric and dynamic exercise.

    PubMed

    Hagberg, M

    1981-07-01

    In nine male volunteers, the endurance time for sustained isometric exercise (right-angle elbow flexion) and dynamic exercise (continuous concentric and eccentric elbow flexions) was measured at different contraction levels. Intermittent isometric exercises were also performed by four of the subjects in whom surface electromyographic elbow flexor recordings were obtained during the three types of exercise. A rapid decrease of the endurance time was seen at contraction levels above 15-20% of the maximum voluntary contraction for both the sustained isometric and dynamic exercise. There were no significant difference between the regression of the endurance time vs. the contraction level for the sustained isometric exercise and that of the dynamic exercise. However, the endurance time was enhanced in the intermittent isometric exercise compared with the sustained isometric exercise. The development of muscle fatigue was well correlated to change of the myoelectric rootmean-square amplitude and the mean power frequency. Differences in exercise did not significantly affect the relation between the time constant of the mean power frequency decrease and the endurance time.

  18. Deterministic nature of the underlying dynamics of surface wind fluctuations

    NASA Astrophysics Data System (ADS)

    Sreelekshmi, R. C.; Asokan, K.; Satheesh Kumar, K.

    2012-10-01

    Modelling the fluctuations of the Earth's surface wind has a significant role in understanding the dynamics of atmosphere besides its impact on various fields ranging from agriculture to structural engineering. Most of the studies on the modelling and prediction of wind speed and power reported in the literature are based on statistical methods or the probabilistic distribution of the wind speed data. In this paper we investigate the suitability of a deterministic model to represent the wind speed fluctuations by employing tools of nonlinear dynamics. We have carried out a detailed nonlinear time series analysis of the daily mean wind speed data measured at Thiruvananthapuram (8.483° N,76.950° E) from 2000 to 2010. The results of the analysis strongly suggest that the underlying dynamics is deterministic, low-dimensional and chaotic suggesting the possibility of accurate short-term prediction. As most of the chaotic systems are confined to laboratories, this is another example of a naturally occurring time series showing chaotic behaviour.

  19. Application of response surface methodology in medium optimization for pyruvic acid production of Torulopsis glabrata TP19 in batch fermentation

    PubMed Central

    Zhang, Jian; Gao, Nian-fa

    2007-01-01

    Response surface methodology (RSM) was used to optimize the fermentation medium for enhancing pyruvic acid production by Torulopsis glabrata TP19. In the first step of optimization, with Plackett-Burman design, ammonium sulfate, glucose and nicotinic acid were found to be the important factors affecting pyruvic acid production significantly. In the second step, a 23 full factorial central composite design and RSM were applied to determine the optimal concentration of each significant variable. A second-order polynomial was determined by the multiple regression analysis of the experimental data. The optimum values for the critical components were obtained as follows: ammonium sulfate 0.7498 (10.75 g/L), glucose 0.9383 (109.38 g/L) and nicotinic acid 0.3633 (7.86 mg/L) with a predicted value of maximum pyruvic acid production of 42.2 g/L. Under the optimal conditions, the practical pyruvic acid production was 42.4 g/L. The determination coefficient (R2) was 0.9483, which ensures adequate credibility of the model. By scaling up fermentation from flask to jar fermentor, we obtained promising results. PMID:17266184

  20. Optimization of lipase production on agro-industrial residue medium by Pseudomonas fluorescens (NRLL B-2641) using response surface methodology

    PubMed Central

    Tanyol, Mehtap; Uslu, Gülşad; Yönten, Vahap

    2015-01-01

    The aim of our research was to explore the most cost-efficient and optimal medium composition for the production of lipase from Pseudomonas fluorescens (NRLL B-2641) culture grown on sunflower oil cake (SuOC) by applying response surface methodology (RSM). The oil cake was used instead of carbon sources. Peptone, ammonium sulphate and the carbon source (SuOC) were the most important factors as it is obligatory for microbial growth. Subsequently, the optimum values for the carbon source, peptone and ammonium sulphate were found to be 11.10% (w/v), 1.18% (w/v) and 0.83% (w/v), respectively. Experiments carried out under optimum conditions revealed a maximum lipase activity of 10.8 U mL−1, which was achieved after 48 h of fermentation. The obtained results were finally verified with batch experiments carried out under the optimum conditions evaluated and it was demonstrated that the SuOC from agro-industrial residue as substrates can be used as an inexpensive base (carbon source) for the production of lipase by P. fluorescens (NRLL B-2641). PMID:26740789

  1. Medium optimization by orthogonal array and response surface methodology for cholesterol oxidase production by Streptomyces lavendulae NCIM 2499.

    PubMed

    Chauhan, Awadesh K; Survase, Shrikant A; Kishenkumar, Jyoti; Annapure, Uday S

    2009-06-01

    This paper deals with the optimization of culture conditions for the production of cholesterol oxidase (COD) by Streptomyces lavendulae NCIM 2499 using the one-factor-at-a-time method, orthogonal array method and response surface methodology (RSM) approaches. The one-factor-at-a-time method was adopted to investigate the effects of medium components (i.e. carbon and nitrogen) and environmental factors (i.e. initial pH) on biomass growth and COD production. Subsequently, an L12 orthogonal matrix was used to evaluate the significance of glycerol, soyabean meal, malt extract, K2HPO4, MgSO4 and NaCl. The effects of media components were ranked according to their effects on the production of COD as malt extract > soyabean meal > K2HPO4 > NaCl > MgSO4 > glycerol. The subsequent optimization of the four most significant factors viz. malt extract, soyabean meal, K2HPO4 and NaCl, was carried out by employing a central composite rotatable design (CCRD) of RSM. There was a 2.48-fold increase in productivity of COD as compared to the unoptimized media by using these statistical approaches.

  2. Cell-surface translational dynamics of nicotinic acetylcholine receptors

    PubMed Central

    Barrantes, Francisco J.

    2014-01-01

    Synapse efficacy heavily relies on the number of neurotransmitter receptors available at a given time. In addition to the equilibrium between the biosynthetic production, exocytic delivery and recycling of receptors on the one hand, and the endocytic internalization on the other, lateral diffusion and clustering of receptors at the cell membrane play key roles in determining the amount of active receptors at the synapse. Mobile receptors traffic between reservoir compartments and the synapse by thermally driven Brownian motion, and become immobilized at the peri-synaptic region or the synapse by: (a) clustering mediated by homotropic inter-molecular receptor–receptor associations; (b) heterotropic associations with non-receptor scaffolding proteins or the subjacent cytoskeletal meshwork, leading to diffusional “trapping,” and (c) protein-lipid interactions, particularly with the neutral lipid cholesterol. This review assesses the contribution of some of these mechanisms to the supramolecular organization and dynamics of the paradigm neurotransmitter receptor of muscle and neuronal cells -the nicotinic acetylcholine receptor (nAChR). Currently available information stemming from various complementary biophysical techniques commonly used to interrogate the dynamics of cell-surface components is critically discussed. The translational mobility of nAChRs at the cell surface differs between muscle and neuronal receptors in terms of diffusion coefficients and residence intervals at the synapse, which cover an ample range of time regimes. A peculiar feature of brain α7 nAChR is its ability to spend much of its time confined peri-synaptically, vicinal to glutamatergic (excitatory) and GABAergic (inhibitory) synapses. An important function of the α7 nAChR may thus be visiting the territories of other neurotransmitter receptors, differentially regulating the dynamic equilibrium between excitation and inhibition, depending on its residence time in each domain. PMID

  3. Land surface dynamics monitoring using microwave passive satellite sensors

    NASA Astrophysics Data System (ADS)

    Guijarro, Lizbeth Noemi

    Soil moisture, surface temperature and vegetation are variables that play an important role in our environment. There is growing demand for accurate estimation of these geophysical parameters for the research of global climate models (GCMs), weather, hydrological and flooding models, and for the application to agricultural assessment, land cover change, and a wide variety of other uses that meet the needs for the study of our environment. The different studies covered in this dissertation evaluate the capabilities and limitations of microwave passive sensors to monitor land surface dynamics. The first study evaluates the 19 GHz channel of the SSM/I instrument with a radiative transfer model and in situ datasets from the Illinois stations and the Oklahoma Mesonet to retrieve land surface temperature and surface soil moisture. The surface temperatures were retrieved with an average error of 5 K and the soil moisture with an average error of 6%. The results show that the 19 GHz channel can be used to qualitatively predict the spatial and temporal variability of surface soil moisture and surface temperature at regional scales. In the second study, in situ observations were compared with sensor observations to evaluate aspects of low and high spatial resolution at multiple frequencies with data collected from the Southern Great Plains Experiment (SGP99). The results showed that the sensitivity to soil moisture at each frequency is a function of wavelength and amount of vegetation. The results confirmed that L-band is more optimal for soil moisture, but each sensor can provide soil moisture information if the vegetation water content is low. The spatial variability of the emissivities reveals that resolution suffers considerably at higher frequencies. The third study evaluates C- and X-bands of the AMSR-E instrument. In situ datasets from the Soil Moisture Experiments (SMEX03) in South Central Georgia were utilized to validate the AMSR-E soil moisture product and to

  4. Crowded surfaces change annealing dynamics of actin filaments.

    PubMed

    Popp, David; Yamamoto, Akihiro; Maéda, Yuichiro

    2007-04-27

    Changes in cell shape that occur in many cellular processes are thought to arise from polymerization of actin filaments near the cell membrane. End-to-end annealing of actin filaments is believed to play only a minor role in this process, as annealing in solution was shown to be a slow process, which is not typical for a bimolecular reaction, its rate constant decreasing over time, being inversely proportional to the filament length. Furthermore, in vitro studies on f-actin solutions were found to display an exponential steady-state length distribution. In the cell, many physiologically important parameters, such as mechanical strength or viscoelastic response are a direct function of the physical properties of the underlying actin cytoskeleton, such as actin filament length distribution and dynamics. How the underlying physical parameters of the actin cytoskeleton may be influenced by the cell surface or molecular crowding remains poorly understood. Using total internal reflection fluorescence (TIRF) microscopy we reinvestigated actin end-to-end annealing in vitro in a more realistic environment. We studied the process near a hydrophilic surface together with crowding agents, in order to mimic the physiological media near the cell membrane, which has substantial amounts of macromolecules present. We find that actin end-to-end annealing changes in three ways near a crowded hydrophilic surface as compared to solution. First the annealing rate becomes a factor of 20 faster than in solution. Second the rate of annealing becomes typical of a bimolecular reaction, shows no length dependence and is basically just a function of the square of the concentration of ends. Lastly the length distribution is Gaussian throughout the entire annealing process. This implicates that dynamic rearrangement of actin filaments by annealing near the leading edge of the cell, could change physical parameters like the mechanical response and contribute significantly to cell motility.

  5. Impact of the In-medium Nucleon-nucleon Cross Section Modification on Early-reaction-phase Dynamics Below 100 A MeV

    SciTech Connect

    Basrak, Z.; Zoric, M.; Eudes, P.; Sebille, F.

    2009-08-26

    With a semi-classical transport model studied is the impact of the in-medium NN cross section modifications on the early energy transformation, dynamical emission and quasiprojectile properties of the Ar+Ni and Ni+Ni reactions at 52, 74 and 95(90) A MeV.

  6. Surface reconstruction in reactive dynamics: A kinetic Monte Carlo approach

    NASA Astrophysics Data System (ADS)

    Noussiou, V. K.; Provata, A.

    2007-07-01

    The oscillatory CO oxidation reaction on the restructuring surface of Pt(1 0 0) is studied through a mesoscopic kinetic Monte Carlo (KMC) approach. The present model is an extension of the standard ZGB model with specific attention to the emergence of oscillations in surface reactions. A square and a purely hexagonal lattice are used as substrates on which the CO oxidation reaction steps take place. The dynamics of the reaction on the two substrates exhibit the ZGB kinetic phase transitions, at different kinetic parameter values for each substrate. Surface reconstruction is modelled through switching between the two lattice types. Oscillations are produced in those parametric areas where the steady state concentrations on the two substrates are considerably different. The parametric area where notable oscillations are observed is narrow, but is greatly enhanced when different sticking coefficients of oxygen are taken into account. CO diffusion introduced microscopically to the model on the hexagonal lattice shifts the kinetic transition points and increases considerably the time needed to reach the steady state.

  7. Evaporation dynamics from wetted porous surfaces affected by internal drainage

    NASA Astrophysics Data System (ADS)

    Lehmann, Peter; Fuchs, Josefa; Dehaspe, Joni; Breitenstein, Daniel; Wunderli, Hans; Or, Dani

    2017-04-01

    Land surface evaporation dynamics following periodic rainfall events is complicated by liquid phase redistribution and concurrent internal drainage. The maintenance of constant and high evaporation rates (stage 1 evaporation) is predicated on water supply to the surface via continuous capillary pathways up to a characteristic depth defined by porous media properties. The objective is to extend the description to realistic conditions where evaporation and internal drainage occur concurrently. Column experiments have shown that evaporative losses were drastically reduced when drainage takes place. For initially high water content (and hydraulic conductivity) drainage dominates and shortens opportunity for stage 1 evaporation. A range of intermediate results emerges in which transition to stage 2 evaporation depends on initial conditions and soil properties. We derived a new definition of evaporative characteristic length that links soil hydraulic properties and initial conditions with predicted evaporative losses from wetted land surface. Experiments and theoretical considerations confirm the existence of an optimal water content defining conditions for maximal evaporative losses during stage 1.

  8. Plankton dynamics in thermally-stratified free-surface turbulence

    NASA Astrophysics Data System (ADS)

    Lovecchio, Salvatore; Soldati, Alfredo

    2015-11-01

    Thermal stratification induced by solar heating near the ocean-atmosphere interface influences the transfer fluxes of heat, momentum and chemical species across the interface. Due to thermal stratification, a region of large temperature gradients (thermocline) may form with strong consequences for the marine ecosystem. In particular, the thermocline is believed to prevent phytoplankton from reaching the well-lit surface layer, where they can grow through the process of photosynthesis. In this paper, we use a DNS-based Eulerian-Lagrangian approach to examine the role of stratification on phytoplankton dynamics in thermally-stratified free-surface turbulence. We focus on gyrotactic self-propelled phytoplankton cells, considering different stratification levels (quantified by the Richardson number) and different gyro tactic re-orientation times. We show that the modulation of turbulent fluctuations induced by stable stratification has a strong effect on the orientation and distribution of phytoplankton, possibly leading to trapping of some species within the thermocline. Specifically, we observe the appearance of a depletion layer just below the free-surface as stratification increases, accompanied by a reduction in the vertical stability of phytoplankton cells.

  9. Dynamics of fibronectin adsorption on TiO2 surfaces.

    PubMed

    Sousa, S R; Brás, M Manuela; Moradas-Ferreira, P; Barbosa, M A

    2007-06-19

    In the present work we analyze the dynamics of fibronectin (FN) adsorption on two different stable titanium oxides, with varied surface roughness, and chemically similar to those used in clinical practice. The two types of titanium oxide surfaces used were TiO2 sputtered on Si (TiO2 sp) and TiO2 formed on commercially pure titanium after immersion in H2O2 (TiO2 cp). Surface characterization was previously carried out using different techniques (Sousa, S. R.; Moradas-Ferreira, P.; Melo, L. V.; Saramago, B.; Barbosa, M. A. Langmuir 2004, 20 (22), 9745-9754). Imaging and roughness analysis before and after FN adsorption used atomic force microscopy (AFM) in tapping mode, in air, and in magnetic alternating current mode, in liquid (water). FN adsorption as a function of time was followed by X-ray photoelectron spectroscopy (XPS), by radiolabeling of FN with 125I (125I-FN), and by ellipsometry. Exchangeability studies were performed using FN and HSA. AFM roughness analysis revealed that, before FN adsorption, both TiO2 surfaces exhibited a lower root-mean-square (Rq) and maximum peak with the depth of the maximum valley (Rmax) roughness in air than in water, due to TiO2 hydration. After protein adsorption, the same behavior was observed for the TiO2 sp substrate, while Rq and Rmax roughness values in air and in water were similar in the case of the TiO2 cp substrate, for the higher FN concentration used. Surface roughness was always significantly higher on the TiO2 cp surfaces. AFM led to direct visualization of adsorbed FN on both surfaces tested, indicating that after 10 min of FN incubation the TiO2 sp surface was partially covered by FN. The adsorbed protein seems to form globular aggregates or ellipsoids, and FN aggregates coalesce, forming clusters as the time of adsorption and the concentration increase. Radiolabeling of FN revealed that a rapid adsorption occurs on both surfaces and the amount adsorbed increased with time, reaching a maximum after 60 min of

  10. Projection system design of medium-frequency wave dynamic infrared scene projector based on digital micromirror device

    NASA Astrophysics Data System (ADS)

    Li, Yandong; Fu, Yuegang; Liu, Zhiying; Zhang, Xueli; Lu, Jing

    2014-11-01

    Infrared target simulator can simulate the real target and background infrared imaging in the laboratory, offer the exactly controlled and repeated condition for the testing and evaluation to the performance of the infrared detection equipment, testing each performance index during the development phase. The characteristics of the infrared optical systems were analyzed. The system parameters which worked at long wave with 1024 ×768 DMD were given. An optical system of medium-frequency wave dynamic infrared scene projector based on the digital micromirror device (DMD) was given by using secondary imaging. The optical system was designed with a long distance of exit pupil, large working distance and short focal length .The exit pupil distance of the system could reach 740 mm, the entrance pupil aperture is 26.5 mm, and the field angle is 12°x9°. In order to get better resolution and image quality, an optimization result and the system aberration were obtained by the ZEMAX software. The whole optical system using the materials of Ge and Si consisted of 6 elements. It was designed with a refractive hybrid system to reduce color aberration and thermal aberration in the temperature range of 10-40¬°. The projector optical system takes advantage of high quality image with MTF better than 0.6 at a spatial frequency of 16 lp/mm in the full field of view, and the distortion is better than 0.5% which is operational within the working temperature.

  11. Beam dynamics and error study of the medium energy beam transport line in the Korea Heavy-Ion Medical Accelerator

    NASA Astrophysics Data System (ADS)

    Kim, Chanmi; Kim, Eun-San; Hahn, Garam

    2016-11-01

    The Korea Heavy Ion Medical Accelerator consists of an injector and a synchrotron for an ion medical accelerator that is the first carbon-ion therapy system in Korea. The medium energy beam transport(MEBT) line connects the interdigital H-mode drift tube linac and the synchrotron. We investigated the beam conditions after the charge stripper by using the LISE++ and the SRIM codes. The beam was stripped from C4+ into C6+ by using the charge stripper. We investigated the performance of a de-buncher in optimizing the energy spread and the beam distribution in z-dW/W (direction of beam progress-beam and energy) phase. We obtained the results of the tracking simulation and the error analysis by using the TRACK code. Possible misalignments and rotations of the magnets were considered in the simulations. States of the beam were examined when errors occurred in the magnets by the applying analytic fringe field model in TRACK code. The condition for the beam orbit was optimized by using correctors and profile monitors to correct the orbit. In this paper, we focus on the beam dynamics and the error studies dedicated to the MEBT beam line and show the optimized beam parameters for the MEBT.

  12. Universal Modified Newtonian Dynamics Relation between the Baryonic and "Dynamical" Central Surface Densities of Disc Galaxies

    NASA Astrophysics Data System (ADS)

    Milgrom, Mordehai

    2016-09-01

    I derive a new modified Newtonian dynamics (MOND) relation for pure-disc galaxies: The "dynamical" central surface density, ΣD0 , deduced from the measured velocities, is a universal function of only the true, "baryonic'' central surface density, ΣB0 : ΣD0=ΣMS (ΣB0/ΣM) , where ΣM≡a0/2 π G is the MOND surface density constant. This surprising result is shown to hold in both existing, nonrelativistic MOND theories. S (y ) is derived: S (y )=∫0yν (y')d y' , with ν (y ) being the interpolating function of the theory. The relation aymptotes to ΣD0=ΣB0 for ΣB0≫ΣM , and to ΣD0=(4 ΣMΣB0)1 /2 for ΣB0≪ΣM . This study was prompted by the recent finding of a correlation between related attributes of disc galaxies by Lelli et al.. The MOND central-surface-densities relation agrees very well with these results.

  13. Universal Modified Newtonian Dynamics Relation between the Baryonic and "Dynamical" Central Surface Densities of Disc Galaxies.

    PubMed

    Milgrom, Mordehai

    2016-09-30

    I derive a new modified Newtonian dynamics (MOND) relation for pure-disc galaxies: The "dynamical" central surface density, Σ_{D}^{0}, deduced from the measured velocities, is a universal function of only the true, "baryonic'' central surface density, Σ_{B}^{0}: Σ_{D}^{0}=Σ_{M}S(Σ_{B}^{0}/Σ_{M}), where Σ_{M}≡a_{0}/2πG is the MOND surface density constant. This surprising result is shown to hold in both existing, nonrelativistic MOND theories. S(y) is derived: S(y)=∫_{0}^{y}ν(y^{'})dy^{'}, with ν(y) being the interpolating function of the theory. The relation aymptotes to Σ_{D}^{0}=Σ_{B}^{0} for Σ_{B}^{0}≫Σ_{M}, and to Σ_{D}^{0}=(4Σ_{M}Σ_{B}^{0})^{1/2} for Σ_{B}^{0}≪Σ_{M}. This study was prompted by the recent finding of a correlation between related attributes of disc galaxies by Lelli et al.. The MOND central-surface-densities relation agrees very well with these results.

  14. Surface oxidation of gold nanoparticles supported on a glassy carbon electrode in sulphuric acid medium: contrasts with the behaviour of 'macro' gold.

    PubMed

    Wang, Ying; Laborda, Eduardo; Crossley, Alison; Compton, Richard G

    2013-03-07

    Consecutive electro-oxidation and reduction cycling of gold macroelectrodes in sulphuric acid medium is a widely-used cleaning and calibration procedure. In this paper this method is applied to electrodeposited nanoparticles revealing significant differences in the electro-oxidation process and the cleaning effectiveness. This suggests a higher density of surface defects on the nanoparticles.

  15. Marine biofilms on artificial surfaces: structure and dynamics.

    PubMed

    Salta, Maria; Wharton, Julian A; Blache, Yves; Stokes, Keith R; Briand, Jean-Francois

    2013-11-01

    The search for new antifouling (AF) coatings that are environmentally benign has led to renewed interest in the ways that micro-organisms colonize substrates in the marine environment. This review covers recently published research on the global species composition and dynamics of marine biofilms, consisting mainly of bacteria and diatoms found on man-made surfaces including AF coatings. Marine biofilms directly interact with larger organisms (macrofoulers) during colonization processes; hence, recent literature on understanding the basis of the biofilm/macrofouling interactions is essential and will also be reviewed here. Overall, differences have been identified in species composition between biofilm and planktonic forms for both diatoms and bacteria at various exposure sites. In most studies, the underlying biofilm was found to induce larval and spore settlement of macrofoulers; however, issues such as reproducibility, differences in exposure sites and biofilm composition (natural multispecies vs. monospecific species) may influence the outcomes.

  16. Fluid dynamics of unsteady separated flow. II - Lifting surfaces

    NASA Technical Reports Server (NTRS)

    Ericsson, L. E.; Reding, J. P.

    1987-01-01

    An analytic method is described which uses static experimental data to predict the separated flow effect on rigid and elastic vehicle dynamics. Key parameters in the analytic relationship between steady and nonsteady aerodynamics are: the time lag occurring before a change of flow conditions can affect the separation-induced aerodynamic loads; the accelerated flow effect (i.e., the pressure gradient lag relative to the static aerodynamic characteristics); and the moving wall effect (i.e., the effect of the nonsteady boundary condition at the vehicle surface). Using the existing experimental data base, an analytic theory is formulated that can predict the separation-induced unsteady aerodynamics if the static characteristics are known from theory or experiment. Reference is made to increased-maneuverability advanced aircraft and to Space Shuttle Orbiter aerodynamics.

  17. Exploring the free energy surface using ab initio molecular dynamics

    SciTech Connect

    Samanta, Amit; Morales, Miguel A.; Schwegler, Eric

    2016-04-22

    Efficient exploration of the configuration space and identification of metastable structures are challenging from both computational as well as algorithmic perspectives. Here, we extend the recently proposed orderparameter aided temperature accelerated sampling schemes to efficiently and systematically explore free energy surfaces, and search for metastable states and reaction pathways within the framework of density functional theory based molecular dynamics. The sampling method is applied to explore the relevant parts of the configuration space in prototypical materials SiO2 and Ti to identify the different metastable structures corresponding to different phases in these materials. In addition, we use the string method in collective variables to study the melting pathways in the high pressure cotunnite phase of SiO2 and the hcp to fcc phase transition in Ti.

  18. Statistical characteristics of topographic surfaces and dynamic smoothing of landscapes

    NASA Astrophysics Data System (ADS)

    Bartlett, M. S.; Laio, F.; Ridolfi, L.; Vico, G.; Porporato, A. M.

    2011-12-01

    We analyze the local statistics of topographic surfaces, including slope and aspect, as a function of scale, and explore their relations with landscape features, such as age, vegetation, and geology. These results build upon the previous work of Vico and Porporato (JGR 114, F01011, 2009), which characterized slope using generalized t-Student distributions. We find that the number of degrees of freedom of such distributions, which determines the heaviness of their tails, is linked to the age of the topographic relief of the considered regions, tending to normal distributions for very old mountain ranges. Based on these findings, and inspired by models of critical phenomena, we develop physically-based, space-time stochastic differential equations that reproduce this dynamic smoothing of rough landscapes.

  19. Exploring the free energy surface using ab initio molecular dynamics

    SciTech Connect

    Samanta, Amit; Morales, Miguel A.; Schwegler, Eric

    2016-04-22

    Efficient exploration of the configuration space and identification of metastable structures are challenging from both computational as well as algorithmic perspectives. Here, we extend the recently proposed orderparameter aided temperature accelerated sampling schemes to efficiently and systematically explore free energy surfaces, and search for metastable states and reaction pathways within the framework of density functional theory based molecular dynamics. The sampling method is applied to explore the relevant parts of the configuration space in prototypical materials SiO2 and Ti to identify the different metastable structures corresponding to different phases in these materials. In addition, we use the string method in collective variables to study the melting pathways in the high pressure cotunnite phase of SiO2 and the hcp to fcc phase transition in Ti.

  20. Exploring the free energy surface using ab initio molecular dynamics

    DOE PAGES

    Samanta, Amit; Morales, Miguel A.; Schwegler, Eric

    2016-04-22

    Efficient exploration of the configuration space and identification of metastable structures are challenging from both computational as well as algorithmic perspectives. Here, we extend the recently proposed orderparameter aided temperature accelerated sampling schemes to efficiently and systematically explore free energy surfaces, and search for metastable states and reaction pathways within the framework of density functional theory based molecular dynamics. The sampling method is applied to explore the relevant parts of the configuration space in prototypical materials SiO2 and Ti to identify the different metastable structures corresponding to different phases in these materials. In addition, we use the string method inmore » collective variables to study the melting pathways in the high pressure cotunnite phase of SiO2 and the hcp to fcc phase transition in Ti.« less

  1. A molecular dynamics investigation of surface reconstruction on magnetite (001)

    NASA Astrophysics Data System (ADS)

    Rustad, J. R.; Wasserman, E.; Felmy, A. R.

    1999-07-01

    Molecular dynamics calculations using analytical potential functions with polarizable oxygen ions have been used to identify a novel mode of reconstruction on the half-occupied tetrahedral layer termination of the magnetite (Fe 3O 4) (001) surface. In the proposed reconstruction, the twofold coordinated iron ion in the top monolayer rotates downward to occupy a vacant half-octahedral site in the plane of the second-layer iron ions. At the same time, half of the tetrahedral iron ions in the third iron layer are pushed upward to occupy an adjacent octahedral vacancy at the level of the second-layer iron ions. The other half of the third-layer iron ions remain roughly in their original positions. The proposed reconstruction is consistent with recent low-energy electron diffraction and X-ray photoelectron spectroscopy results. It also provides a compelling interpretation for the arrangement of atoms suggested by high-resolution scanning-tunneling microscopy studies.

  2. Dynamics of the Si(111) surface phase transition

    SciTech Connect

    HANNON,J.B.; HIBINO,H.; BARTELT,N.C.; SWARTZENTRUBER,BRIAN S.; OGINO,T.; KELLOGG,G.L.

    1999-01-27

    The authors have used low-energy electron microscopy to investigate the dynamics of the Si(111) 7 x 7 {r_arrow} 1 x 1 phase transition. Because the densities of the two phases differ, the phase transformation is analogous to precipitation in bulk systems: additional material must diffuse to the phase boundaries in order for the transformation to occur. By measuring the size evolution of an ensemble of domains, and comparing the results to simulations, they have identified a new mechanism of precipitate growth. The source of material necessary for the transformation is the random creation of atom/vacancy pairs at the surface. This mechanism contrasts sharply with classical theories of precipitation, in which mass transport kinetics determine the rate of transformation.

  3. Surface structure and lattice dynamics of KI(001) studied by high-resolution ion scattering combined with molecular dynamics simulation

    NASA Astrophysics Data System (ADS)

    Okazawa, T.; Nishimura, T.; Kido, Y.

    2002-09-01

    The rumpled surface structure and thermal lattice vibrations of KI(001) were studied by high-resolution medium-energy ion scattering (MEIS) and molecular dynamics (MD) simulation. The relaxation of the interlayer distance between the top and second layer and the rumpling of the top and second layers were measured directly by MEIS with an accuracy of 0.01 Å. From the displaced lattice positions determined above, we derived the dipole moments of the top- and second-layer K+ and I- ions self-consistently using the polalizabilities estimated from the optical refractive index combined with the Clausius-Mossotti relation. The balance between a short-range force and a long-range Coulombic one made it possible to judge the applicability of the short-range pair potentials proposed so far. We also determined the root-mean-square thermal vibration amplitudes of the bulk and top-layer ions together with the correlations between the top- and second-layer ions by means of the ion shadowing effect applied to various kinds of scattering geometries. The results obtained were compared with those calculated from the MD simulations based on a semiclassical model using the dipole moments determined above and a Born-Mayer- or Hellmann-type pair potential. The present results are in overall agreement with the MD simulations employing the pair potential proposed by Catlow et al. [J. Phys. C 10, 1395 (1977)].

  4. Hot electron dynamics and impurity scattering on gold nanoshell surfaces

    NASA Astrophysics Data System (ADS)

    Wolfgang, John Adam

    2000-10-01

    Recent ultrafast pump-probe experiments studying the relaxation rate of an optically excited hot electron distribution on Au/Au2S gold nanoshells indicate that this relaxation rate can be modified by the chemical environment surrounding the shell. This work will begin a theoretical investigation of the effect of chemical adsorbates---solvents and impurities---upon nanoshell hot electron dynamics. The effects of water, polyvinyl alcohol (PVA), sulfur, p-aminobenzoic acid, p-mercaptobenzoic acid and propylamine adsorbates are examined for their electronic interaction with a noble metal surface. p-Aminobenzoic acid is found to have a very large dipole moment when adsorbed to the metal surface, in contrast to p-mercaptobenzoic acid, propylamine and water. This correlates well to the experimentally observed results where nanoshells dispersed in an aqueous soulution with p-aminobenzoic acid display a faster relaxation rate compared to nanoshells dispersed in a pure water, aqueous propylamine or aqueous p-mercaptobenzoic acid environments. This thesis will also introduce a non-equilibrium Green's function approach, based on the formalism developed by Baym and Kadanoff, to model the dynamics of a hot electron distribution. The model will be discussed in terms of a simple potential scattering mechanism, which may in later work be expanded to include more complex electron-electron and electron-phonon interactions. Lastly acoustic oscillation modes are calculated for solid gold spheres and gold-silicon nanoshells. These modes describe an effect of electron-phonon coupling between the hot electron distribution and the nanoshell lattice, whereby the electronic energy is converted into mechanical energy.

  5. Dynamics of free surface perturbations along an annular viscous film.

    PubMed

    Smolka, Linda B; North, Justin; Guerra, Bree K

    2008-03-01

    It is known that the free surface of an axisymmetric viscous film flowing down the outside of a thin vertical fiber under the influence of gravity becomes unstable to interfacial perturbations. We present an experimental study using fluids with different densities, surface tensions, and viscosities to investigate the growth and dynamics of these interfacial perturbations and to test the assumptions made by previous authors. We find that the initial perturbation growth is exponential, followed by a slower phase as the amplitude and wavelength saturate in size. Measurements of the perturbation growth for experiments conducted at low and moderate Reynolds numbers are compared to theoretical predictions developed from linear stability theory. Excellent agreement is found between predictions from a long-wave Stokes flow model [Craster and Matar, J. Fluid Mech. 553, 85 (2006)] and data, while fair to excellent agreement (depending on fiber size) is found between predictions from a moderate-Reynolds-number model [Sisoev, Chem. Eng. Sci. 61, 7279 (2006)] and data. Furthermore, we find that a known transition in the longer-time perturbation dynamics from unsteady to steady behavior at a critical flow rate Q(c) is correlated with a transition in the rate at which perturbations naturally form along the fiber. For QQ(c) (unsteady case), the rate of perturbation formation is modulated. As a result, the position along the fiber where perturbations form oscillates irregularly, and the initial speed and spacing between perturbations varies, resulting in the coalescence of neighboring perturbations further down the fiber.

  6. Dynamics of free surface perturbations along an annular viscous film

    NASA Astrophysics Data System (ADS)

    Smolka, Linda B.; North, Justin; Guerra, Bree K.

    2008-03-01

    It is known that the free surface of an axisymmetric viscous film flowing down the outside of a thin vertical fiber under the influence of gravity becomes unstable to interfacial perturbations. We present an experimental study using fluids with different densities, surface tensions, and viscosities to investigate the growth and dynamics of these interfacial perturbations and to test the assumptions made by previous authors. We find that the initial perturbation growth is exponential, followed by a slower phase as the amplitude and wavelength saturate in size. Measurements of the perturbation growth for experiments conducted at low and moderate Reynolds numbers are compared to theoretical predictions developed from linear stability theory. Excellent agreement is found between predictions from a long-wave Stokes flow model [Craster and Matar, J. Fluid Mech. 553, 85 (2006)] and data, while fair to excellent agreement (depending on fiber size) is found between predictions from a moderate-Reynolds-number model [Sisoev , Chem. Eng. Sci. 61, 7279 (2006)] and data. Furthermore, we find that a known transition in the longer-time perturbation dynamics from unsteady to steady behavior at a critical flow rate Qc is correlated with a transition in the rate at which perturbations naturally form along the fiber. For QQc (unsteady case), the rate of perturbation formation is modulated. As a result, the position along the fiber where perturbations form oscillates irregularly, and the initial speed and spacing between perturbations varies, resulting in the coalescence of neighboring perturbations further down the fiber.

  7. Comparing dynamic surface tilt with velocity using an LDV

    NASA Astrophysics Data System (ADS)

    Bruce, Robert A.

    2004-06-01

    If a laser Doppler vibrometer (LDV) probe beam is normally incident on a resonating metal strip with a mirror-finish, the retro-reflected beam has corresponding dynamic deflections. These lateral beam offsets are proportional to the dynamic surface tilt and can be measured along with the LDV velocity using a separating beam-splitter and a two-dimensional position sensitive detector (PSD). On a thin unbound strip resonating with 'pure mode' deformation, these derivative motions, velocity and tilt, are completely complementary. On a thin unbound plate resonating with 'hybrid mode' deformation, velocity and now two orthogonal tilts are nearly complementary. Maximal tilt has zero velocity, and maximum deformation or velocity has zero tilt. Intermediate values range in complementary fashion except near 'cross-nodes' zones. Here both motion types drop to zero at these cross-node locations. Both velocity and tilt signals are compared simultaneously using a special test fixture. This fixture consists of a stainless steel strip supported on its edges in the center, which can be excited by small speakers at the ends. Two comparison/calibration approaches are demonstrated with a pure 3-0 mode. Significant modal details are also demonstrated by analyzing multiple modes from pulsed excitation, and mapping a 3-1 mode-shape using the combined sensing approaches.

  8. He atom surface scattering: Surface dynamics of insulators, overlayers and crystal growth

    SciTech Connect

    Safron, S. A.; Skofronick, J. G.

    1992-01-01

    Investigations have focused primarily on surface structure and dynamics of ionic insulators, epitaxial growth onto alkali halide crystals and multiphoton studies. The surface dynamics of RbCl has been re-examined. We have developed a simple force constant model which provides insight into the dynamics of KBr overlayers on NaCl(001), a system with a large lattice mismatch. The KBr/NaCl(001) results are compared to Na/Cu(001) and NaCl/Ge(001). We have completed epitaxial growth experiments for KBr onto RbCl(001). Slab dynamics calculations using a shell model for this system with very small lattice mismatch are being carried out in collaboration with Professor Manson of Clemson University and with Professor Schroeder in Regensburg, Germany. Extensive experiments on multiphoton scattering of helium atoms onto NaCl and, particularly, LiF have been carried out and the theory has been developed to a rather advanced stage by Professor Manson. This work will permit the extraction of more information from time-of-flight spectra. It is shown that the theoretical model provides a very good description of the multiphoton scattering from organic films. Work has started on self-assembling organic films on gold (alkyl thiols/Au(111)). We have begun to prepare and characterize the gold crystal; one of the group members has spent two weeks at the Oak Ridge National Laboratory learning the proper Au(111) preparation techniques. One of our students has carried out neutron scattering experiments on NiO, measuring both bulk phonon and magnon dispersion curves.

  9. Holographic otoscope for nanodisplacement measurements of surfaces under dynamic excitation.

    PubMed

    Flores-Moreno, J M; Furlong, Cosme; Rosowski, John J; Harrington, Ellery; Cheng, Jeffrey T; Scarpino, C; Santoyo, F Mendoza

    2011-01-01

    We describe a novel holographic otoscope system for measuring nanodisplacements of objects subjected to dynamic excitation. Such measurements are necessary to quantify the mechanical deformation of surfaces in mechanics, acoustics, electronics, biology, and many other fields. In particular, we are interested in measuring the sound-induced motion of biological samples, such as an eardrum. Our holographic otoscope system consists of laser illumination delivery (IS), optical head (OH), and image processing computer (IP) systems. The IS delivers the object beam (OB) and the reference beam (RB) to the OH. The backscattered light coming from the object illuminated by the OB interferes with the RB at the camera sensor plane to be digitally recorded as a hologram. The hologram is processed by the IP using the Fresnel numerical reconstruction algorithm, where the focal plane can be selected freely. Our holographic otoscope system is currently deployed in a clinic, and is packaged in a custom design. It is mounted in a mechatronic positioning system to increase its maneuverability degrees to be conveniently positioned in front of the object to be measured. We present representative results highlighting the versatility of our system to measure deformations of complex elastic surfaces in the wavelength scale including a copper foil membrane and postmortem tympanic membrane. SCANNING 33: 342-352, 2011. © 2011 Wiley Periodicals, Inc. Copyright © 2011 Wiley Periodicals, Inc.

  10. Ocean surface winds drive dynamics of transoceanic aerial movements.

    PubMed

    Felicísimo, Angel M; Muñoz, Jesús; González-Solis, Jacob

    2008-08-13

    Global wind patterns influence dispersal and migration processes of aerial organisms, propagules and particles, which ultimately could determine the dynamics of colonizations, invasions or spread of pathogens. However, studying how wind-mediated movements actually happen has been hampered so far by the lack of high resolution global wind data as well as the impossibility to track aerial movements. Using concurrent data on winds and actual pathways of a tracked seabird, here we show that oceanic winds define spatiotemporal pathways and barriers for large-scale aerial movements. We obtained wind data from NASA SeaWinds scatterometer to calculate wind cost (impedance) models reflecting the resistance to the aerial movement near the ocean surface. We also tracked the movements of a model organism, the Cory's shearwater (Calonectris diomedea), a pelagic bird known to perform long distance migrations. Cost models revealed that distant areas can be connected through "wind highways" that do not match the shortest great circle routes. Bird routes closely followed the low-cost "wind-highways" linking breeding and wintering areas. In addition, we found that a potential barrier, the near surface westerlies in the Atlantic sector of the Intertropical Convergence Zone (ITCZ), temporally hindered meridional trans-equatorial movements. Once the westerlies vanished, birds crossed the ITCZ to their winter quarters. This study provides a novel approach to investigate wind-mediated movements in oceanic environments and shows that large-scale migration and dispersal processes over the oceans can be largely driven by spatiotemporal wind patterns.

  11. Imaging on the surfaces of an uneven thickness medium based on hybrid phase retrieval with the assistance of off-axis digital holography

    NASA Astrophysics Data System (ADS)

    Wang, Fengpeng; Wang, Dayong; Panezai, Spozmai; Rong, Lu; Wang, Yunxin; Zhao, Jie

    2017-10-01

    A hybrid phase retrieval method with the assistance of off-axis digital holography is proposed for imaging objects on the surfaces of a transparent medium with uneven thickness. The approximate phase distribution is obtained by a constrained optimization approach from the off-axis hologram, and it is used in an iterative procedure for retrieving the complex field of the object from the Gabor hologram. Furthermore, principal component analysis is introduced for compensating for phase aberrations caused by the medium. Numerical simulations and optical experiments were carried out to validate the proposed method. The quality of the reconstructed image is improved remarkably compared to only off-axis digital holography.

  12. The relationship between the surface composition and electrical properties of corrosion films formed on carbon steel in alkaline sour medium: an XPS and EIS study.

    PubMed

    Galicia, Policarpo; Batina, Nikola; González, Ignacio

    2006-07-27

    This work studies the evolution of 1018 carbon steel surfaces during 3-15 day immersion in alkaline sour medium 0.1 M (NH4)2S and 10 ppm CN(-) as (NaCN). During this period of time, surfaces were jointly characterized by electrochemical techniques in situ (electrochemical impedance spectroscopy, EIS) and spectroscopic techniques ex situ (X-ray photoelectron spectroscopy, XPS). The results obtained by these techniques allowed for a description of electrical and chemical properties of the films of corrosion products formed at the 1018 steel surface. There is an interconversion cycle of chemical species that form films of corrosion products whose conversion reactions favor two different types of diffusions inside the films: a chemical diffusion of iron cations and a typical diffusion of atomic hydrogen. These phenomena jointly control the passivity of the interface attacked by the corrosive medium.

  13. Prototropic tautomerism of 4-Methyl 1,2,4-Triazole-3-Thione molecule in solvent water medium: DFT and Car-Parrinello molecular dynamics study

    NASA Astrophysics Data System (ADS)

    Dutta, Bipan; De, Rina; Chowdhury, Joydeep

    2015-12-01

    The ground state prototropic tautomerism of 4-Methyl 1,2,4-Triazole-3-Thione molecule in solvent water medium has been investigated with the aid of DFT and Car-Parrinello molecular dynamics (CPMD) simulation studies. The CPMD simulations envisage the possibility of proton transfer reactions of the molecule through the solvent water medium. Probable proton transfer pathways have been predicted from the DFT calculations which are substantiated by the natural bond orbital analyses. The evolution and breaking of the concerned bonds of the molecule for different proton transfer reaction pathways are also estimated.

  14. On trajectory-based nonadiabatic dynamics: Bohmian dynamics versus trajectory surface hopping

    NASA Astrophysics Data System (ADS)

    Curchod, Basile F. E.; Tavernelli, Ivano

    2013-05-01

    In this work, we present a complete derivation of the NonAdiabatic Bohmian DYnamics (NABDY) equations of motion. This approach naturally emerges from a transformation of the molecular time-dependent Schrödinger equation in the adiabatic representation of the electronic states. The numerical implementation of the method is discussed while simple nonadiabatic models are employed to address the accuracy of NABDY and to reveal its ability to capture nuclear quantum effects that are missed in trajectory surface hopping (TSH) due to the independent trajectory approximation. A careful comparison of the correlated, NABDY, and the uncorrelated, TSH, propagation is also given together with a description of the main approximations and assumptions underlying the "derivation" of a nonadiabatic molecular dynamics scheme based on classical trajectories.

  15. On trajectory-based nonadiabatic dynamics: Bohmian dynamics versus trajectory surface hopping.

    PubMed

    Curchod, Basile F E; Tavernelli, Ivano

    2013-05-14

    In this work, we present a complete derivation of the NonAdiabatic Bohmian DYnamics (NABDY) equations of motion. This approach naturally emerges from a transformation of the molecular time-dependent Schrödinger equation in the adiabatic representation of the electronic states. The numerical implementation of the method is discussed while simple nonadiabatic models are employed to address the accuracy of NABDY and to reveal its ability to capture nuclear quantum effects that are missed in trajectory surface hopping (TSH) due to the independent trajectory approximation. A careful comparison of the correlated, NABDY, and the uncorrelated, TSH, propagation is also given together with a description of the main approximations and assumptions underlying the "derivation" of a nonadiabatic molecular dynamics scheme based on classical trajectories.

  16. He atom-surface scattering: Surface dynamics of insulators, overlayers and crystal growth

    SciTech Connect

    Not Available

    1992-01-01

    Investigations in this laboratory have focused on the surface structure and dynamics of ionic insulators and on epitaxial growth onto alkali halide crystals. In the later the homoepitaxial growth of NaCl/NaCl(001) and the heteroepitaxial growth of KBr/NaCl(001), NaCl/KBr(001) and KBr/RbCl(001) have been studied by monitoring the specular He scattering as a function of the coverage and by measuring the angular and energy distributions of the scattered He atoms. These data provide information on the surface structure, defect densities, island sizes and surface strain during the layer-by-layer growth. The temperature dependence of these measurements also provides information on the mobilities of the admolecules. He atom scattering is unique among surface probes because the low-energy, inert atoms are sensitive only to the electronic structure of the topmost surface layer and are equally applicable to all crystalline materials. It is proposed for the next year to exploit further the variety of combinations possible with the alkali halides in order to carry out a definitive study of epitaxial growth in the ionic insulators. The work completed so far, including measurements of the Bragg diffraction and surface dispersion at various stages of growth, appears to be exceptionally rich in detail, which is particularly promising for theoretical modeling. In addition, because epitaxial growth conditions over a wide range of lattice mismatches is possible with these materials, size effects in growth processes can be explored in great depth. Further, as some of the alkali halides have the CsCl structure instead of the NaCl structure, we can investigate the effects of the heteroepitaxy with materials having different lattice preferences. Finally, by using co-deposition of different alkali halides, one can investigate the formation and stability of alloys and even alkali halide superlattices.

  17. Zinc Adsorption on Fe(II)/Fe(III) Substates Produced by Microbial Reduction of High-Surface-Area Goethite, Medium-Surface-Area Goethite and Lepidocrocite