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Sample records for medium dynamics surface

  1. 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.

  2. 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.

  3. 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. PMID:26800434

  4. 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.

  5. Simulation of Free Surface Dynamic in a Random Heterogeneous Porous Medium by the Method Based on Mapping the Regular Domain on the Flow Domain.

    NASA Astrophysics Data System (ADS)

    Lazarev, Y.; Petrov, P.; Tartakovsky, D. M.

    2002-12-01

    In this paper the problem of vacuum-incompressible fluid interface moving in a porous medium by treating conductivity of a medium as a random field with known statistics is considered. The flow is described by a combination of mass conservation and Darcy' law. The use of a coordinate system tied with the moving fluid allows reducing the problem to the well-explored class of problems with fixed boundaries and an effective conductivity tensor instead of the initial scalar conductivity. The hydraulic head is represented as a series in powers of effective conductivity fluctuations. The applied procedure is close to the perturbation theory procedure in the amplitude of the hydraulic conductivity fluctuations ˜ K when searching the solution with accuracy up to ˜ K2 . In both cases physical quantity variance is considered to be proportional to its reason: ˜ V = A ṡ ˜ K ( A is a linear operator). Yet unlike perturbation theory, where it is considered that A depends only on undisturbed flow parameters A = A(¯ K), in the approach being used A is considered to be dependent on averaged flow parameters A = A( ¯ K,< ˜ K2 > ). Equations of the mean hydraulic head and mean flux and expressions for respective variances as well are derived in the 2-D case. For 1-D flow the derived solution agrees with the exact one within terms of σ K2 -order at any free surface fluctuations. Within this approach the free surface moving, evolution in time of the mean hydraulic head spatial distribution, mean flux and relative correlation functions are described by the set of first-order partial differential equations. The conjugate gradient method with preconditioning is proposed to be used as the general method of equation numerical solving to find hydraulic head statistic moments. The problem matrix symmetry and its positive definiteness serve the foundation of the method applicability. RFLOW code has been elaborated to solve this set of equations numerically. Testing data of the

  6. 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.

  7. Dynamics of surface melting

    SciTech Connect

    Elsayed-Ali, H.E.

    1990-08-01

    The objectives of this program is to study the phenomenon of surface melting of single crystals of metals, to test for its existence, and to investigate its dynamics. Both conventional static electron diffraction and dynamic ultrafast electron diffraction are used in our study. This year, the ultrahigh vacuum facility containing the picosecond electron reflection high-energy electron diffraction system was equipped with a cylindrical mirror analyzer and a static electron gum for Auger spectroscopy. An image analysis system capable of acquiring the pulsed diffraction patterns was assembled and used in analysis of picosecond laser heated surfaces. A large set of time-resolved experiments were conducted to study the thermal response of Pb(110) to picosecond laser heating. The surface Debye-Waller effect was used to time-resolve the evolution of surface temperature. This provided us with a picosecond time-resolved surface lattice temperature probe. Results for laser fluences below surface melting show agreement with a heat-diffusion model. The temperature dependence of the Pb(100) along the (110) and the (001) azimuths using x-ray photoelectron forward scattering of the 4f{sub 7/2} core-level photoelectrons confirmed, for the first time, surface melting of Pb(100) at temperatures as low as 560 K.

  8. Collective dynamics in strongly coupled dusty plasma medium

    NASA Astrophysics Data System (ADS)

    Das, Amita; Dharodi, Vikram; Tiwari, Sanat; Tiwari

    2014-12-01

    A simplified description of dynamical response of strongly coupled medium is desirable in many contexts of physics. The dusty plasma medium can play an important role in this regard due to its uniqueness, as its dynamical response typically falls within the perceptible grasp of human senses. Furthermore, even at room temperature and normal densities it can be easily prepared to be in a strongly coupled regime. A simplified phenomenological fluid model based on the visco - elastic behaviour of the medium is often invoked to represent the collective dynamical response of a strongly coupled dusty plasma medium. The manuscript reviews the role of this particular Generalized Hydrodynamic (GHD) fluid model in capturing the collective properties exhibited by the medium. In addition the paper also provides new insights on the collective behaviour predicted by the model for the medium, in terms of coherent structures, instabilities, transport and mixing properties.

  9. Dynamics of osmosis in a porous medium.

    PubMed

    Cardoso, Silvana S S; Cartwright, Julyan H E

    2014-11-01

    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.

  10. Fluid Dynamics with Free Surfaces

    1992-02-01

    RIPPLE is a two-dimensional, transient, free surface incompressible fluid dynamics program. It allows multiple free surfaces with surface tension and wall adhesion forces and has a partial cell treatment which allows curved boundaries and interior obstacles.

  11. 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

  12. 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.

  13. Nanomotor dynamics in a chemically oscillating medium

    NASA Astrophysics Data System (ADS)

    Robertson, Bryan; Kapral, Raymond

    2015-04-01

    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.

  14. 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.

  15. 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.

  16. 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.

  17. 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.

  18. 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.

  19. Dynamic response of elastic layered medium to moving loads

    NASA Astrophysics Data System (ADS)

    Zafir, Zia; Siddharthan, Raj

    A new method of analysis to study the response of horizontally layered elastic medium to moving surface pressure loads under plane strain conditions has been developed. Important factors such as the two dimensional nature of wave propagation, inertia, and damping effects of the medium are accounted for. The proposed method can handle single loads or multiple loads. In the case of fast moving loads, it has been found that the inertia and damping considerations are important. An increase of about 35 percent in the vertical displacement of the surface was noted when the speed of the load was increased from 20 m/s to 100 m/s. For truck loads with tandem axle configuration on flexible pavements, it has been found that the two important strains, E(t) (major principal) at the bottom of the asphalt concrete (AC) layer and E(p) (minor principal) at the top of the subgrade layer are cyclic and not unidirectional as often assumed.

  20. Dynamics of rising bubble inside a viscosity-stratified medium

    NASA Astrophysics Data System (ADS)

    Tripathi, Manoj; Premlata, A. R.; Sahu, Kirti

    2015-11-01

    The rising bubble dynamics in an unconfined quiescent viscosity-stratified medium has been numerically investigated. This is frequently encountered in industrial as well as natural phenomena. In spite of the large number of studies carried out on bubbles and drops, very few studies have examined the influence of viscosity stratification on bubble rise dynamics. To the best of our knowledge, none of them have isolated the effects of viscosity-stratification alone, even though it is known to influence the dynamics extensively, which is the main objective of the present study. By conducting time-dependent simulations, we present a library of bubble shapes in the Gallilei and the Eötvös numbers plane. Our results demonstrate some counter-intuitive phenomena for certain range of parameters due to the presence of viscosity stratification in the surrounding fluid. We found that in a linearly increasing viscosity medium, for certain values of parameters, bubble undergoes large deformation by forming an elongated skirt, while the skirt tends to physically separate the wake region from the rest of the surrounding fluid. This peculiar dynamics is attributed to the migration of less viscous fluid that is carried in the wake of the bubble as it rises, and thereby creating an increase.

  1. 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

  2. Dynamics of rising bubble inside a viscosity-stratified medium

    NASA Astrophysics Data System (ADS)

    Premlata, A. R.; Tripathi, Manoj Kumar; Sahu, Kirti Chandra

    2015-07-01

    The rising bubble dynamics in an unconfined quiescent viscosity-stratified medium has been numerically investigated. This is frequently encountered in industrial as well as natural phenomena. In spite of the large number of studies carried out on bubbles and drops, very few studies have examined the influence of viscosity stratification on bubble rise dynamics. To the best of our knowledge, none of them have isolated the effects of viscosity-stratification alone, even though it is known to influence the dynamics extensively, which is the main objective of the present study. By conducting time-dependent simulations, we present a library of bubble shapes in the Galilei and the Eötvös numbers plane. Our results demonstrate some counter-intuitive phenomena for certain range of parameters due to the presence of viscosity stratification in the surrounding fluid. We found that in a linearly increasing viscosity medium, for certain values of parameters, bubble undergoes large deformation by forming an elongated skirt, while the skirt tends to physically separate the wake region from the rest of the surrounding fluid. This peculiar dynamics is attributed to the migration of less viscous fluid that is carried in the wake of the bubble as it rises, and thereby creating an increasingly larger viscosity contrast between the fluid occupied in the wake region and the surrounding fluid, unlike that observed in a constant viscosity medium. It is also observed that the effect of viscosity stratification is qualitatively different for different regimes of the dimensionless parameters. In future, it will be interesting to investigate this problem in three-dimensions.

  3. Dynamics of a supernova envelope in a cloudy interstellar medium

    NASA Astrophysics Data System (ADS)

    Korolev, V. V.; Vasiliev, E. O.; Kovalenko, I. G.; Shchekinov, Yu. A.

    2015-07-01

    The evolution of a supernova remnant in a cloudy medium as a function of the volume filling factor of the clouds is studied in a three-dimensional axially symmetrical model. The model includes the mixing of heavy elements (metals) ejected by the supernova and their contribution to radiative losses. The interaction of the supernova envelope with the cloudy phase of the interstellar medium leads to nonsimultaneous, and on average earlier, onsets of the radiative phase in different parts of the supernova envelope. Growth in the volume filling factor f leads to a decrease in the time for the transition of the envelope to the radiative phase and a decrease in the envelope's mean radius, due to the increased energy losses by the envelope in the cloudy medium. When the development of hydrodynamical instabilities in the supernova envelope is efficient, the thermal energy falls as E t ~ t -2.3, for the propagation of the supernova remnant through either a homogeneous or a cloudy medium. When the volume filling factor is f ≳ 0.1, a layer with excess kinetic energy andmomentumforms far behind the global shock front from the supernova, which traps the hot gas of the cavity in the central part of the supernova remnant. Metals ejected by the supernova are also enclosed in the central region of the remnant, where the initial (high) metallicity is essentially preserved. Thus, the interaction of the supernova envelope with the cloudy interstellar medium appreciably changes the dynamics and structure of the distribution of the gas in the remnant. This affects the observational characteristics of the remnant, in particularly, leading to substantial fluctuations of the emissionmeasure of the gas with T > 105 K and the velocity dispersion of the ionized gas.

  4. 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

  5. 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

  6. Surface structure determines dynamic wetting

    NASA Astrophysics Data System (ADS)

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

    2014-11-01

    Dynamic wetting, the spontaneous spreading process after droplet contacts a solid surface, is important in various engineering processes, such as in printing, coating, and lubrication. In the recent years, experiments and numerical simulations have greatly progressed the understanding in the dynamic wetting particularly on ``flat'' substrates. To gain further insight into the governing physics of the dynamic wetting, we perform droplet-wetting experiments on microstructured surfaces, just a few micrometers in size, with complementary numerical simulations, and investigate the dependence of the spreading rate on the microstructure geometries and fluid properties. We reveal that the influence of microstructures 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. The systematic study is also of practical importance since structures and roughness are omnipresent and their influence on spreading rate would give us additional degrees of freedom to control the dynamic wetting. This work was financially supported in part by, the Japan Society for the Promotion of Science (J.W., J.C., and J.S) and Swedish Governmental Agency for Innovation Systems (M.D.-Q. and G.A.).

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

    NASA Astrophysics Data System (ADS)

    Sun, Fei; He, Sailing

    2015-10-01

    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.

  8. 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

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

    PubMed

    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.

  10. 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.

  11. 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.

  12. 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.

  13. 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

  14. AN ATTRACTOR FOR THE DYNAMICAL STATE OF THE INTRACLUSTER MEDIUM

    SciTech Connect

    Juncher, Diana; Hansen, Steen H.; Maccio, Andrea V.

    2012-02-20

    Galaxy clusters provide us with important information about the cosmology of our universe. Observations of the X-ray radiation or of the Sunyaev-Zel'dovich effect allow us to measure the density and temperature of the hot intergalactic medium between the galaxies in a cluster, which then allow us to calculate the total mass of the galaxy cluster. However, no simple connection between the density and the temperature profiles has been identified. Here, we use controlled high-resolution numerical simulations to identify a relation between the density and temperature of the gas in equilibrated galaxy clusters. We demonstrate that the temperature-density relation is a real attractor, by showing that a wide range of equilibrated structures all move toward the attractor when perturbed and subsequently allowed to relax. For structures that have undergone sufficient perturbations for this connection to hold, one can therefore extract the mass profile directly from the X-ray intensity profile.

  15. 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.

  16. Dynamics of Wetting of Ultra Hydrophobic Surfaces

    NASA Astrophysics Data System (ADS)

    Mohammad Karim, Alireza; Kim, Jeong-Hyun; Rothstein, Jonathan; Kavehpour, Pirouz; Mechanical and Industrial Engineering, University of Massachusetts, Amherst Collaboration

    2013-11-01

    Controlling the surface wettability of hydrophobic and super hydrophobic surfaces has extensive industrial applications ranging from coating, painting and printing technology and waterproof clothing to efficiency increase in power and water plants. This requires enhancing the knowledge about the dynamics of wetting on these hydrophobic surfaces. We have done experimental investigation on the dynamics of wetting on hydrophobic surfaces by looking deeply in to the dependency of the dynamic contact angles both advancing and receding on the velocity of the three-phase boundary (Solid/Liquid/Gas interface) using the Wilhelmy plate method with different ultra-hydrophobic surfaces. Several fluids with different surface tension and viscosity are used to study the effect of physical properties of liquids on the governing laws.

  17. 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.

  18. 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.

  19. DYNAMICALLY DRIVEN EVOLUTION OF THE INTERSTELLAR MEDIUM IN M51

    SciTech Connect

    Koda, Jin; Scoville, Nick; Potts, Ashley E.; Carpenter, John M.; Corder, Stuartt A.; Patience, Jenny; Sargent, Anneila I.; Sawada, Tsuyoshi; La Vigne, Misty A.; Vogel, Stuart N.; White, Stephen M.; Zauderer, B. Ashley; Pound, Marc W.; Wright, Melvyn C. H.; Plambeck, Richard L.; Bock, Douglas C. J.; Hawkins, David; Hodges, Mark; Lamb, James W.; Kemball, Athol

    2009-08-01

    Massive star formation occurs in giant molecular clouds (GMCs); an understanding of the evolution of GMCs is a prerequisite to develop theories of star formation and galaxy evolution. We report the highest-fidelity observations of the grand-design spiral galaxy M51 in carbon monoxide (CO) emission, revealing the evolution of GMCs vis-a-vis the large-scale galactic structure and dynamics. The most massive GMCs (giant molecular associations (GMAs)) are first assembled and then broken up as the gas flow through the spiral arms. The GMAs and their H{sub 2} molecules are not fully dissociated into atomic gas as predicted in stellar feedback scenarios, but are fragmented into smaller GMCs upon leaving the spiral arms. The remnants of GMAs are detected as the chains of GMCs that emerge from the spiral arms into interarm regions. The kinematic shear within the spiral arms is sufficient to unbind the GMAs against self-gravity. We conclude that the evolution of GMCs is driven by large-scale galactic dynamics-their coagulation into GMAs is due to spiral arm streaming motions upon entering the arms, followed by fragmentation due to shear as they leave the arms on the downstream side. In M51, the majority of the gas remains molecular from arm entry through the interarm region and into the next spiral arm passage.

  20. 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.

  1. On the Rupture Dynamics of Shallow Dip-Slip Faulting in a Stratified Medium

    NASA Astrophysics Data System (ADS)

    Uenishi, Koji

    2015-04-01

    One significant feature of a shallow dip-slip earthquake is the broken symmetry of seismic motion in the proximity of the rupturing fault plane. In general, the strong motion is much larger on the hanging wall than on the footwall, but the mechanics behind this asymmetry has not been wholly understood yet. Therefore, in this contribution, based on finite difference calculations and dynamic photoelasticity, we try to deepen our understanding on the rupture dynamics of a shallow dip-slip fault plane numerically as well as experimentally. In our two-dimensional crack-like rupture models, a flat vertical or inclined fault plane is prepared in a monolithic (first model) or stratified (second model) linear elastic medium. In the basic first model, as predicted numerically by Uenishi and Madariaga (Eos 2005), the primary fault rupture approaching the horizontal free surface may induce four Rayleigh-type waves, two Rayleigh waves propagating along the free surface to the far field and the other two interface waves travelling back downwards along the ruptured fault plane. In the case of the inclined fault plane, the interaction of the interface and Rayleigh waves may generate a strong shear wave (corner wave) and cause stronger disturbances in the hanging wall. The corner wave may exist only when the fault plane is asymmetrically inclined. On the contrary, in the second model, symmetry of seismic motion may be broken even in geometrically symmetric cases if the secondary rupture is allowed at an interface between geological layers. For instance, if primary vertical fault rupture propagates from depth and interferes with a horizontal interface obeying a tensile fracture criterion, the interface segments on which the primary fault rupture produces dynamic compression (in the relatively rising hanging wall) may remain unbroken and only some interface segments in the subsiding footwall may be fractured in tension. That is, in the hanging wall, the dynamic disturbances in the

  2. 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. PMID:26764828

  3. Gas dynamics of the active medium of a supersonic cw HF chemical laser

    SciTech Connect

    Fedorov, Igor' A; Rotinyan, Mikhail A; Krivitskii, A M

    2000-12-31

    Gas-dynamic characteristics of a 5-kW supersonic cw HF chemical laser with a nozzle array of size 25 cm x 2.8 cm and the nozzle - nozzle mixing scheme were experimentally studied. The distributions of Mach numbers, static pressure, total pressure behind the normal shock, and the loss of total pressure were measured in the flow of an active medium in wide ranges of variation of the flow rate of secondary fuel (hydrogen) and pressure in the atomic-fluorine generator. The energy parameters of the laser were found to be interrelated with the gas dynamics and the optical quality of the active laser medium. (lasers)

  4. 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.

  5. 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.

  6. Dynamic aspects of the Southern-Hemisphere medium-scale waves during the southern summer season

    NASA Technical Reports Server (NTRS)

    Chen, Tsing-Chang; Yen, Ming-Cheng; Nune, Durga P.

    1987-01-01

    The role of medium-scale waves on three dynamic aspects of the Southern-Hemisphere general circulation is examined using data generated by the FGGE analyses of the ECMWF. The momentum and sensible heat transports by the medium-scale waves are discussed. The effects of medium-scale waves on atmospheric circulation of the Southern Hemisphere during the summer, in particular the vacillation of atmospheric energetics, are investigated. The horizontal and vertical structures and the transport properties of this wave regime and their relation to downstream development in the Southern Hemisphere are analyzed. It is observed that medium-scale waves supply about a half of the total eddy transport of sensible heat and momentum; the wave regime contributes to the time average of various energy contents and energetic components of atmospheric motion during the southern summer; and the wave regime is amplified during the developing stages of downstream development.

  7. 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.

  8. Rank 0 invariant solutions of dynamics of two-phase medium

    NASA Astrophysics Data System (ADS)

    Panov, Alexandr

    2016-08-01

    A system of partial differential equations which describes dynamics of two-phase medium is considered. Lie algebra of symmetry group of this system was found. For some 4-dimensional subalgebras of invariant solutions is found. All other 4-dimensional subalgebras will give only partial invariant solutions of this system.

  9. 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.

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

    Technology Transfer Automated Retrieval System (TEKTRAN)

    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...

  11. 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

  12. 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.

  13. A dynamical model of supernova feedback: gas outflows from the interstellar medium

    NASA Astrophysics Data System (ADS)

    Lagos, Claudia del P.; Lacey, Cedric G.; Baugh, Carlton M.

    2013-12-01

    We present a dynamical model of supernova feedback which follows the evolution of pressurized bubbles driven by supernovae in a multiphase interstellar medium (ISM). The bubbles are followed until the point of break-out into the halo, starting from an initial adiabatic phase to a radiative phase. We show that a key property which sets the fate of bubbles in the ISM is the gas surface density, through the work done by the expansion of bubbles and its role in setting the gas scaleheight. The multiphase description of the ISM is essential, and neglecting it leads to order-of-magnitude differences in the predicted outflow rates. We compare our predicted mass loading and outflow velocities to observations of local and high-redshift galaxies and find good agreement over a wide range of stellar masses and velocities. With the aim of analysing the dependence of the mass loading of the outflow, β (i.e. the ratio between the outflow and star formation rates), on galaxy properties, we embed our model in the galaxy formation simulation, GALFORM, set in the Λ cold dark matter framework. We find that a dependence of β solely on the circular velocity, as is widely assumed in the literature, is actually a poor description of the outflow rate, as large variations with redshift and galaxy properties are obtained. Moreover, we find that below a circular velocity of ≈80 km s-1, the mass loading saturates. A more fundamental relation is that between β and the gas scaleheight of the disc, hg, and the gas fraction, fgas, as β ∝ h^{1.1}_g f^{0.4}_gas, or the gas surface density, Σg, and the gas fraction, as β ∝ Σ ^{-0.6}_g f^{0.8}_gas. We find that using the new mass loading model leads to a shallower faint-end slope in the predicted optical and near-IR galaxy luminosity functions.

  14. Effective Medium Theory for Drag Reducing Micro-patterned Surfaces in Turbulent Flows

    NASA Astrophysics Data System (ADS)

    Battiato, I.

    2013-12-01

    Inspired by the lotus effect, many studies in the last decade have focused on micro- and nano-patterned surfaces. They revealed that patterns at the micro-scale combined with high contact angles can significantly reduce skin drag. However, the mechanisms and parameters that control drag reduction, e.g. Reynolds number and pattern geometry, are still unclear. We propose an effective medium representation of the micro-features, that treats the latter as a porous medium, and provides a framework to model flow over patterned surfaces in both Cassie and Wenzel states. Our key result is a closed-form expression for the skin friction coefficient in terms of frictional Reynolds (or Karman) number in turbulent regime, the viscosity ratio between the fluid in and above the features, and their geometrical properties. We apply the proposed model to turbulent flows over superhydrophobic ridged surfaces. The model predictions agree with laboratory experiments for Reynolds numbers ranging from 3000 to 10000.

  15. Effective Medium Theory for Drag Reducing Micro-patterned Surfaces in Turbulent Flows

    NASA Astrophysics Data System (ADS)

    Battiato, Ilenia

    2013-11-01

    Inspired by the lotus effect, many studies in the last decade have focused on micro- and nano-patterned surfaces. They revealed that patterns at the micro-scale combined with high contact angles can significantly reduce skin drag. However, the mechanisms and parameters that control drag reduction, e.g. Reynolds number and pattern geometry, are still unclear. We propose an effective medium representation of the micro-features that treats the latter as a porous medium, and provides a framework to model flows over patterned surfaces in both Cassie and Wenzel states. Our key result is a closed-form expression for the skin friction coefficient in terms of frictional Reynolds (or Karman) number in turbulent regime. We apply the proposed model to turbulent flow over superhydrophobic ridged surfaces. The model predictions agree with laboratory experiments for Reynolds numbers ranging from 3000 to 10000.

  16. Dynamic analogues of Green and Gauss's formulas for unsteady dynamics of anisotropic elastic medium at antiplane deformation

    NASA Astrophysics Data System (ADS)

    Zakir'yanova, Gulmira

    2016-08-01

    The paper is devoted to the solution of non-stationary boundary value problems (BVP) for an anisotropic elastic medium at antiplane deformation. The solutions in class of shock wave are considered for strong hyperbolic equation which describes the motion of the considered medium. The statement of two initial boundary problems are given. The conditions on the wave fronts are obtained. The energy conservation law and questions of the uniqueness of the solutions in the class of shock waves are considered. Dynamic analogues of Green and Gauss's formulas constructed and their integral representations obtained.

  17. 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.

  18. Level set methods to compute minimal surfaces in a medium with exclusions (voids).

    SciTech Connect

    Walsh, Timothy Francis; Chopp, David; Torres, Monica

    2003-06-01

    In T1, periodic minimal surfaces in a medium with exclusions (voids) are constructed and in this paper we present two algorithms for computing these minimal surfaces. The two algorithms use evolution of level sets by mean curvature. The first algorithm solves the governing nonlinear PDE directly and enforces numerically an orthogonality condition that the surfaces satisfy when they meet the boundaries of the exclusions. The second algorithm involves h-adaptive finite element approximations of a linear convection-diffusion equation, which has been shown to linearize the governing nonlinear PDE for weighted mean curvature flow.

  19. Lateral plume spreading in a medium size river plume using surface Lagrangian drifters

    NASA Astrophysics Data System (ADS)

    Kakoulaki, Georgia; MacDonald, Daniel; Cole, Kelly

    2016-04-01

    Groups of 27 Lagrangian drifters deployed in the Merrimack River plume over twelve tides, with river discharges ranging between 150-800 m3/s, are used to understand the external forcing mechanisms responsible for the extent of spreading in river plumes. The transition of buoyant flow from a confined estuary to an unconfined coastal ocean introduces the complicated phenomenon of lateral spreading, which occurs preferentially near the surface and results in a flow that spreads laterally as plume water propagates forward in the direction of mean flow. In this work, the temporal and spatial scales of the active spreading region are estimated in the sampled plumes and related to environmental parameters at the river mouth such as inflow river discharge, initial drifter velocity at the point of release, initial reduced gravity and initial internal wave speed. The initial wave speed was found to be the environmental parameter that best predicts the magnitude of the spatial and temporal scales of the active spreading region. Previous studies have asserted the importance of initial plume parameters in near-field plume evolution and here we extrapolate this idea to the mid-field. Interestingly, we find that that lateral plume spreading is arrested at approximately one inertial radius from the river mouth. We therefore propose that the shutdown of spreading is controlled almost exclusively by Coriolis force and it is responsible for converting spreading motion to spinning motion after the mid field region. The outcomes of this research are widely applicable to other energetic, medium size river plume systems and to the author's knowledge this is the first study to estimate lateral plume expansion using observations beyond the immediate near field region of a river plume. This work will provide further development in understanding plume dynamics and the fundamental physical processes that influence coastal ecosystems.

  20. Dynamic wetting on anisotropic patterned surfaces

    NASA Astrophysics Data System (ADS)

    Do-Quang, Minh; Wang, Jiayu; Nita, Satoshi; Shiomi, Junichiro; Amberg, Gustav; Physiochemical fluid mechanics Team; Maruyama-Chiashi Laboratory Team

    2014-11-01

    Dynamic wetting, as occurs when a droplet of a wetting liquid is brought in contact with a dry solid, is important in various engineering processes, such as printing, coating, and lubrication. Our overall aim is to investigate if and how the detailed properties of the solid surface influence the dynamics of wetting. We have recently quantified the hindering effect of fairly isotropic micron-sized patterns on the substrate. Here we will study highly anisotropic surfaces, such as parallel grooves, either perpendicular or parallel to an advancing contact line. This is done by detailed phase field simulations and experiments on structured silicon surfaces. The dynamic wetting behavior of drops on the grooved surfaces is governed by the combined interplay of the wetting line friction and the internal viscous dissipation. Influence of roughness is quantified in terms of the energy dissipation rate at the contact line using the experiment-simulation combined analysis. The energy dissipation of the contact line at the different part of the groove will be discussed. The performance of the model is assessed by comparing its predictions with the experimental data. This work was financially supported in part by, the Japan Society for the Promotion of Science (J.W., S.N., and J.S) and Swedish Governmental Agency for Innovation Systems (M.D.-Q. and G.A).

  1. 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. PMID:15680283

  2. Dynamic analysis of a surface towed riser

    SciTech Connect

    Garrett, D.L.; Watters, A.J.

    1995-12-31

    An investigation of the dynamic response of a slightly buoyant, surface towed riser (or pipeline) to waves is presented. A time domain numerical model is described. Analysis results for response to regular and random waves are discussed and compared to published experimental data. Response is examined in some detail for a 2m diameter riser. The dynamic response to waves is described in terms of the response to regular waves. Analysis results for random waves are presented and compared to the regular wave response. Fatigue damage estimates are calculated for a riser subjected to a severe summer storm and found to be acceptable for a tow of several days duration.

  3. Laser-induced surface modification of metals and alloys in liquid argon medium

    NASA Astrophysics Data System (ADS)

    Kazakevich, V. S.; Kazakevich, P. V.; Yaresko, P. S.; Kamynina, D. A.

    2016-08-01

    Micro and nanostructuring of metals and alloys surfaces (Ti, Mo, Ni, T30K4) was considered by subnanocosecond laser radiation in stationary and dynamic mode in the liquid argon, ethanol and air. Depending of structures size on the samples surface from the energy density and the number of pulses were built. Non-periodic (NSS) and periodic (PSS) surface structures with periods about λ-λ/2 were obtained. PSS formation took place as at the target surface so at the NSS surface.

  4. 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.

  5. Effective medium theory for drag-reducing micro-patterned surfaces in turbulent flows

    NASA Astrophysics Data System (ADS)

    Battiato, Ilenia

    2014-11-01

    Many studies in the last decade have revealed that patterns at the microscale can reduce skin drag. Yet, the mechanisms and parameters that control drag reduction, e.g. Reynolds number and pattern geometry, are still unclear. We propose an effective medium representation of the micro-features, that treats the latter as a porous medium, and provides a framework to model turbulent flow over patterned surfaces. Our key result is a closed-form expression for the skin friction coefficient in terms of frictional Reynolds (or Karman) number in turbulent regime, the viscosity ratio between the fluid in and above the features, and their geometrical properties. We apply the proposed model to turbulent flows over superhydrophobic ridged surfaces. The model predictions agree with laboratory experiments for Reynolds numbers ranging from 3000 to 10000.

  6. 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.

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

    PubMed

    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. PMID:26026327

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

    PubMed

    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.

  9. 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.

  10. Influence of static and dynamic internal actions on elastic nonlinear properties of a granulated unconsolidated medium

    NASA Astrophysics Data System (ADS)

    Shirgina, N. V.; Korobov, A. I.; Kokshaiskii, A. I.

    2013-09-01

    We have studied the influence of external static (pressure) and dynamic (caused by an elastic wave with a finite amplitude) actions on the linear and nonlinear elastic properties of a granulated unconsolidated medium, which was simulated by steel spheres with diameters of 2 and 4 mm. We have analyzed the equation of state for such a medium taking into account the presence of weakly and strongly deformed contacts between individual spheres. We have obtained expressions for the elasticity coefficient and second- and third-order nonlinear elastic parameters, and we have experimentally studied the influence of external static pressure on their values. We have measured the dependence of the velocity of elastic waves on external static pressure and the probing signal amplitude. In the studied medium, a number of structural phase transitions were observed, related to rearrangement of the packing of spheres, which were caused by both static and dynamic actions. The structural phase transition was accompanied by an anomalous change in the nonlinear elastic parameters of the medium and the velocity of elastic waves. We have analyzed the results based on the Hertz theory of contact interaction.

  11. 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.

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

    DOE PAGES

    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 resultsmore » demonstrate the application of the typical medium dynamical cluster approximation method to study Anderson localization in real materials.« less

  13. 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.

  14. Classical 2d dynamics simulations of metallic spheres in highly viscous medium

    NASA Astrophysics Data System (ADS)

    Fleck, Peter; Hubler, Alfred

    2007-03-01

    We study the classical dynamics computations of metallic spheres immersed in highly viscous, but weakly conducting medium while exposed to the electro-static field of external electrodes of varying geometries. We represent the system's charge dynamics by the spheres' multipole moments as induced by the electrodes. We theoretically derive the force contributions on an individual sphere including feedback effects, and compare these with results from finite-element computations. We find an individual sphere to oscillate between opposite electrodes only if sufficient charge is retained on the sphere on its path for given material parameters of the medium and distance between the electrodes. We discuss the system's parameter ranges necessary for line arrangements of multiple spheres to emerge. Finally, we compare our computations with an experiment of ballbearings in castor oil.

  15. [Oligoglycine surface structures: molecular dynamics simulation].

    PubMed

    Gus'kova, O A; Khalatur, P G; Khokhlov, A R; Chinarev, A A; Tsygankova, S V; Bovin, N V

    2010-01-01

    The full-atomic molecular dynamics (MD) simulation of adsorption mode for diantennary oligoglycines [H-Gly4-NH(CH2)5]2 onto graphite and mica surface is described. The resulting structure of adsorption layers is analyzed. The peptide second structure motives have been studied by both STRIDE (structural identification) and DSSP (dictionary of secondary structure of proteins) methods. The obtained results confirm the possibility of polyglycine II (PGII) structure formation in diantennary oligoglycine (DAOG) monolayers deposited onto graphite surface, which was earlier estimated based on atomic-force microscopy measurements.

  16. Computer simulations of particle-surface dynamics

    SciTech Connect

    Karo, A.M.; Hiskes, J.R.; DeBoni, T.M.

    1986-10-01

    Our simulations of particle-surface dynamics use the molecular dynamics codes that we have developed over the past several years. The initial state of a molecule and the parameters defining the incoming trajectory can be specifically described or randomly selected. Statistical analyses of the states of the particles and their trajectories following wall collisions are carried out by the code. We have carried out calculations at high center-of-mass energies and low incidence angles and have examined the survival fraction of molecules and the dependence upon the incoming trajectory. We report also on preliminary efforts that are being made to simulate sputtering and recombinant desorption processes, since the recombinant desorption of hydrogen from typical wall materials may be an important source for vibrationally-excited hydrogen in volume sources; for surface sources the presence of occluded hydrogen may affect the concentration of atomic species.

  17. DYNAMICAL FRICTION IN A GASEOUS MEDIUM WITH A LARGE-SCALE MAGNETIC FIELD

    SciTech Connect

    Sanchez-Salcedo, F. J.

    2012-02-01

    The dynamical friction force experienced by a massive gravitating body moving through a gaseous medium is modified by sufficiently strong large-scale magnetic fields. Using linear perturbation theory, we calculate the structure of the wake generated by, and the gravitational drag force on, a body traveling in a straight-line trajectory in a uniformly magnetized medium. The functional form of the drag force as a function of the Mach number ({identical_to} V{sub 0}/c{sub s} , where V{sub 0} is the velocity of the body and c{sub s} is the sound speed) depends on the strength of the magnetic field and on the angle between the velocity of the perturber and the direction of the magnetic field. In particular, the peak value of the drag force is not near Mach number {approx}1 for a perturber moving in a sufficiently magnetized medium. As a rule of thumb, we may state that for supersonic motion, magnetic fields act to suppress dynamical friction; for subsonic motion, they tend to enhance dynamical friction. For perturbers moving along the magnetic field lines, the drag force at some subsonic Mach numbers may be stronger than at supersonic velocities. We also mention the relevance of our findings to black hole coalescence in galactic nuclei.

  18. 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.

  19. 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

  20. 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.

  1. 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. PMID:17914859

  2. 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. PMID:27612817

  3. 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

  4. Molecular Dynamics Studies of Gold Surfaces

    NASA Astrophysics Data System (ADS)

    Ercolessi, F.; Bartolini, A.; Garofalo, M.; Parrinello, M.; Tosatti, E.

    1987-01-01

    In the glue model the total cohesion of a metal is determined by a pairwise atom-atom effective interaction plus a many-body force (the "glue") which is introduced to ensure optimal coordination. Using parameters optimized for gold, we have studied the structural behaviour of the low index surfaces Au(100), Au(110) and Au(111). We have used a simulated annealing strategy based on molecular dynamics to search the lowest surface energy configuration. In all cases the optimal structures are found to be reconstructed, and remarkably similar to some experimentally suggested reconstruction models. The main driving mechanism is the formation of close-packed triangular surface layers favoured by the glue term.

  5. Optimization of a natural medium for cellulase by a marine Aspergillus niger using response surface methodology.

    PubMed

    Xue, Dong-Sheng; Chen, Hui-Yin; Lin, Dong-Qiang; Guan, Yi-Xin; Yao, Shan-Jing

    2012-08-01

    The components of a natural medium were optimized to produce cellulase from a marine Aspergillus niger under solid state fermentation conditions by response surface methodology. Eichhornia crassipes and natural seawater were used as a major substrate and a source of mineral salts, respectively. Mineral salts of natural seawater could increase cellulase production. Raw corn cob and raw rice straw showed a significant positive effect on cellulase production. The optimum natural medium consisted of 76.9 % E. crassipes (w/w), 8.9 % raw corn cob (w/w), 3.5 % raw rice straw (w/w), 10.7 % raw wheat bran (w/w), and natural seawater (2.33 times the weight of the dry substrates). Incubation for 96 h in the natural medium increased the biomass to the maximum. The cellulase production was 17.80 U/g the dry weight of substrates after incubation for 144 h. The natural medium avoided supplying chemicals and pretreating substrates. It is promising for future practical fermentation of environment-friendly producing cellulase. PMID:22644643

  6. Stability and surface dynamics of metal nanowires

    NASA Astrophysics Data System (ADS)

    Zhang, Chang-Hua

    In this thesis, we have systematically investigated the stability, surface dynamics, electronic transport, and growth of metal nanowires using a semiclassical free energy functional based on the mean-field interacting electron model, which is simple and general enough. In this model, the ionic degrees of freedom of the wire are modeled as an incompressible fluid, and the conducting electrons are treated as a Fermi gas confined within the wire with Dirichlet boundary conditions. In equilibrium, we prove that the electron-electron interaction is a second-order effect to the total grand canonical free energy, while the shell-correction to the noninteracting grand canonical free energy is a first-order effect. To leading order, the electron-electron interactions just renormalize the Weyl parameters, such as the average energy density, surface tension and mean curvature energy, but not the mesoscopic shell effect. This finding for open mesoscopic systems is a generalization of the well-known Strutinsky theorem for finite-Fermion systems. It is for this reason that self-consistent jellium calculations obtain essentially identical equilibrium mesoscopic effects as calculations based on the free-electron model. However, for systems out of equilibrium, the electron-electron interaction plays important roles. First of all, the Strutinsky theorem breaks down in the non-equilibrium case. Secondly, the gauge invariance condition is violated if the electron-electron interaction is not adequately included. We first derive a thermodynamic phase diagram for jellium nanowires, which predicts that cylindrical wires with certain "magic" conductance values are stable with respect to small perturbations up to remarkably high temperatures and high applied voltage. We have shown that Jahn-Teller-distorted wires can be stable. The derived sequence of stable cylindrical and elliptical geometries explains the experimentally observed shell and supershell structures for alkali metals. Highly

  7. Surface-mitigated lipid organization and dynamics

    NASA Astrophysics Data System (ADS)

    Sanii, Babak

    Supported bilayers, fluid phospholipid films of molecular thicknesses, have been of considerable interest as model biological membranes both for fundamental studies of cell surface mechanisms and for designing biosensors and assays for membrane-targets. Beyond biology, interfacial organization of amphiphiles and lipids into a discrete number of molecular layers provides arguably one of the most pristine experimental realizations of a self-organized, two-dimensional system. Consequently the construct of a supported membrane is an experimental test-bed for the study of a rich variety of interface-dominated processes including surface melting, low-dimensional phase transitions, surface dynamics, and phase coexistence/separation. A central hypothesis of this dissertation is that by controlling the spatial and temporal variations of solid surface properties we manipulate the adherent membrane's organization. Such control over structural organization provides a means to tune a variety of membrane physical properties including lateral tension, spatial contiguity, local curvature, and membrane spreadability. Chapter 1 introduces the reader to static patterning of fluids and elastomers, and summarizes my specific contributions. The following two chapters are each divided into a pair of themed inquiries, each of which is associated with a publication. Chapter 2 introduces two ways to dynamically pattern lipid films using substrates. One is a top-down, switchable imposition of membrane structure based on elastomer substrate deformation. The other approach uses patterns of surface-energy to manipulate the kinetics and morphology of membrane self-assembly. Chapter 3 consists of two inquiries into surface-mitigated dynamic phenomena that occur between the leaflets of a lipid bilayer. Namely, a novel means of producing and detecting lateral interleaflet slip, and a means to localize a transverse lipid interdigitation that accompanies a phase-change. The final chapter is a review

  8. 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.

  9. Dynamical surface affinity of diphasic liquids as a probe of wettability of multimodal porous media.

    PubMed

    Korb, J-P; Freiman, G; Nicot, B; Ligneul, P

    2009-12-01

    We introduce a method for estimating the wettability of rock/oil/brine systems using noninvasive in situ nuclear magnetic relaxation dispersion. This technique scans over a large range of applied magnetic fields and yields unique information about the extent to which a fluid is dynamically correlated with a solid rock surface. Unlike conventional transverse relaxation studies, this approach is a direct probe of the dynamical surface affinity of fluids. To quantify these features we introduce a microscopic dynamical surface affinity index which measures the dynamical correlation (i.e., the microscopic wettability) between the diffusive fluid and the fixed paramagnetic relaxation sources at the pore surfaces. We apply this method to carbonate reservoir rocks which are known to hold about two thirds of the world's oil reserves. Although this nondestructive method concerns here an application to rocks, it could be generalized as an in situ liquid/surface affinity indicator for any multimodal porous medium including porous biological media. PMID:20365175

  10. On NaCl efflorescence formation and growth at the surface of a porous medium

    NASA Astrophysics Data System (ADS)

    Veran-Tissoires, S.; Marcoux, M.; Prat, M.

    2012-04-01

    Rocks or building materials are often altered by the presence of dissolved salts. Salt precipitation is one of the main processes damaging the porous matrix. In this context, our study focuses on salt crystallization which results from evaporation at the surface of porous media. These crystallized salt structures are called efflorescence. Efflorescence is an important issue for the conservation of old paintings and frescoes. The challenge is to understand why these structures do not form everywhere at the porous medium surface but at some specific locations and why there exists an exclusion distance around an efflorescence structure where no new efflorescence forms. These behaviours are explained from a visualization experiment, pore-network simulations and a simple efflorescence growth model. A wicking/evaporating experiment is conducted on packings of glass beads (~1mm diameter) contained in a hollow cylinder. The porous sample is open at the bottom where it is in contact with a brine solution. The upper surface is open to external dry air. In this configuration, the sample remains fully saturated and salt precipitation takes place at the sample surface. This setup is set in an enclosure where temperature is kept constant and dry air is maintained, which imposes a nearly uniform evaporation flux over the sample surface. After a few days of evaporation, efflorescence structures appear, grow and remain discrete, i.e. continue to form individual halite structures. Simulations with a 3D pore network model enable us to show that discrete location of efflorescence results from small scale heterogeneities of the beads packing. Locally some menisci are connected to smaller pores which enhance salt transport by advection. The second objective of the study is to understand the mechanism which makes the efflorescence to growth under the form of a set of individual structures. By studying numerically the growth of one efflorescence structure, we observe a global increase of

  11. Surface acoustic wave resonators on a ZnO-on-Si layered medium

    NASA Astrophysics Data System (ADS)

    Martin, S. J.; Schwartz, S. S.; Gunshor, R. L.; Pierret, R. F.

    1983-02-01

    The adaptation of surface acoustic wave resonator technology to a ZnO-on-Si layered medium is presented. Several distributed reflector schemes are considered, including shorted and isolated metallic strips, as well as grooves etched in the ZnO layer. In the case of etched groove reflectors, a first-order velocity perturbation arises due to the dispersive nature of the layered medium. Unique resonator design considerations result from the reflector array velocity and reflectivity characteristics. Transverse mode resonances are characterized and their effect on resonator response eliminated by a novel transducer design. A technique for temperature compensating the devices by use of a thermal SiO2 layer is discussed.

  12. Electromagnetic Field of Surface Waves Propagation in Fiber-Reinforced Generalized Thermoelastic Medium

    NASA Astrophysics Data System (ADS)

    Lotfy, Kh.; Salem, Al. M.; Al-Sayed, A.

    2015-05-01

    The objective of this paper is to investigate the surface waves in fiber-reinforced anisotropic elastic medium subjected to magnetic and thermal fields. We introduce the coupled theory (CD), Lord-Shulman (LS) theory and Green-Lindsay (GL) theory to study the influence of magnetic field on 2D problem of a fiber-reinforced thermoelastic. The analytical expressions for displacement components and force stress are obtained in the physical domain by using the harmonic vibrations. The wave velocity equations have been obtained in different cases. Numerical results for the temperature, displacement, and thermal stress components are given and illustrated graphically in the presence and absence of the magnetic field of the material medium. A comparison is also made between the three theories in the case of presence and absence of fiber-reinforced parameters.

  13. Chemical force microscopy study of adhesive properties of polypropylene films: influence of surface polarity and medium.

    PubMed

    Gourianova, Svetlana; Willenbacher, Norbert; Kutschera, Michael

    2005-06-01

    The adhesive properties of untreated and corona treated polypropylene (PP) films were studied in polar (water) and nonpolar (hexadecane) liquid medium by using chemical force microscopy. A gold-coated colloidal probe was sequentially modified with self-assembled monolayers (SAMs) of omega-functionalized alkanethiols. The same colloidal probe was used for the force measurements, to avoid influence of determination accuracy of the spring constant and sphere radius on the obtained results. The thermodynamic work of adhesion was determined from the measured pull-off force using the Johnson-Kendall-Roberts (JKR) adhesion theory. Rabinovich's model was applied for the consideration of an effect of roughness when calculating the work of adhesion. It was found that the work of adhesion correlates with the hydrophilic properties of the PP surface and SAMs as well as with the polarity of the liquid medium. The observed correlations agree well with those found for the work of adhesion calculated from contact angle measurement.

  14. Surface Integrity in Grinding Medium Carbon Steel with Miniature Electroplated Monolayer cBN Wheel

    NASA Astrophysics Data System (ADS)

    Vashista, Meghanshu; Kumar, Shobhit; Ghosh, Amitava; Paul, Soumitra

    2010-12-01

    An experimental study was undertaken to investigate the role of process parameters on grindability of medium carbon steel with particular emphasis on surface integrity. Grinding with miniature monolayer electroplated cBN wheels provided compressive residual stress throughout the experimental domain unlike conventional grinding. This can be attributed to desirable temperature control as the wheel takes away substantial part of grinding heat flux owing to its better thermal conductivity. Micromagnetic or Barkhausen Noise (BN) parameters correlated linearly with the residual stress indicating its applicability in assessing surface integrity of cBN ground products. Increase in maximum grit depth of cut ( h m) provided more grain elongation and surface hardness due to more chip load during chip formation.

  15. Medium effects on the surface tension of strangelets in the extended quasiparticle model

    SciTech Connect

    Wen, X. J.; Li, J. Y.; Liang, J. Q.; Peng, G. X.

    2010-08-15

    We propose a modification of the finite size effects due to the effective bag function in the extended quark quasiparticle model with a running coupling constant. The bag function is associated with the quark chemical potential and the radius of strangelets. Considering the medium effects, the surface tension should be redefined with an additional term described by the surface term of the bag function. With the increasing baryon number of stable strangelets, it is found that the coupling strength becomes stronger while the surface tension decreases in the vicinity of 35 MeV fm{sup -2} for strangelets of the baryon number greater than 10{sup 3}. The comparison with the bag model is shown and the distinction for smaller strangelets is very clear.

  16. Dynamic nuclear polarization surface enhanced NMR spectroscopy.

    PubMed

    Rossini, Aaron J; Zagdoun, Alexandre; Lelli, Moreno; Lesage, Anne; Copéret, Christophe; Emsley, Lyndon

    2013-09-17

    Many of the functions and applications of advanced materials result from their interfacial structures and properties. However, the difficulty in characterizing the surface structure of these materials at an atomic level can often slow their further development. Solid-state NMR can probe surface structure and complement established surface science techniques, but its low sensitivity often limits its application. Many materials have low surface areas and/or low concentrations of active/surface sites. Dynamic nuclear polarization (DNP) is one intriguing method to enhance the sensitivity of solid-state NMR experiments by several orders of magnitude. In a DNP experiment, the large polarization of unpaired electrons is transferred to surrounding nuclei, which provides a maximum theoretical DNP enhancement of ∼658 for (1)H NMR. In this Account, we discuss the application of DNP to enhance surface NMR signals, an approach known as DNP surface enhanced NMR spectroscopy (DNP SENS). Enabling DNP for these systems requires bringing an exogeneous radical solution into contact with surfaces without diluting the sample. We proposed the incipient wetness impregnation technique (IWI), a well-known method in materials science, to impregnate porous and particulate materials with just enough radical containing solution to fill the porous volume. IWI offers several advantages: it is extremely simple, provides a uniform wetting of the surface, and does not increase the sample volume or substantially reduce the concentration of the sample. This Account describes the basic principles behind DNP SENS through results obtained for mesoporous and nanoparticulate samples impregnated with radical solutions. We also discuss the quantification of the overall sensitivity enhancements obtained with DNP SENS and compare that with ordinary room temperature NMR spectroscopy. We then review the development of radicals and solvents that give the best possible enhancements today. With the best

  17. Influence of Kerr-like medium on the dynamics of a two-mode Raman coupled model

    NASA Astrophysics Data System (ADS)

    Singh, Sudha; Gilhare, Karuna

    2016-08-01

    We study the quantum dynamics of an effective two-level atom interacting with two modes via Raman process inside an ideal cavity in the presence of Kerr non-linearity. The cavity modes interact both with the atom as well as the Kerr-like medium. The unitary transformation method presented here, not only solves the time-dependent problem, but also provides the eigensolutions of the interacting Hamiltonian at the same time. We study the atomic-population dynamics and the dynamics of the photon statistics in the two cavity modes. The influence of the Kerr-like medium on the statistics of the field is explored and it is observed that Kerr medium introduces antibunching in mode 1 and this effect is enhanced by a stronger interaction with the non-linear medium. In the high non-linear coupling regime anticorrelated beam become correlated. Kerr medium also introduces non-classical correlation between the two modes.

  18. Experimental investigations of heat transport dynamics in a 1D porous medium column

    NASA Astrophysics Data System (ADS)

    Cherubini, Claudia; Pastore, Nicola; Giasi, Concetta I.; Allegretti, Nicoletta M.

    2016-04-01

    A laboratory physical model has been set up to analyse the forced convective flow and the related heat transport dynamics through a 1d porous medium column. In particular, the experiments regard the observation of thermal breakthrough curves obtained through a continuous flow injection in correspondence of eight thermocouple positioned uniformly along a thermally isolated column of porous medium. The experiment has been conducted for different flow rates in order to investigate the critical issues regarding heat transport phenomena such as the influence of non-linear flow regime, the relationship between the thermal dispersion with the flow velocity and the validity of the local thermal equilibrium assumption between the fluid and solid phase. The results emphasize the magnitude of the errors of the commonly used assumptions in the numerical modelling of heat transport.

  19. The Surface Wave Dynamics Experiment (SWADE)

    NASA Technical Reports Server (NTRS)

    Mollo-Christensen, Erik; Oberholtzer, J. David

    1991-01-01

    The Surface Wave Dynamics Experiment is designed to provide the basic data needed to understand the wind-wave interactions in the open ocean. During the period of October 1990 through March 1991 two discus, four meteorological buoys, and several other specialized buoys will collect continuous in-situ data. During three intensive periods of study, several aircraft and an airship will collect synoptic data from the study area in the Atlantic east of the Wallops Flight Facility. Data from the buoys will be collected by aircraft and ARGOS data links. Instrumentation descriptions as well as preliminary data from the first intensive study period are presented.

  20. Surface response of a viscoelastic medium to subsurface acoustic sources with application to medical diagnosis

    NASA Astrophysics Data System (ADS)

    Royston, Thomas J.; Yazicioglu, Yigit; Loth, Francis

    2003-02-01

    The response at the surface of an isotropic viscoelastic medium to buried fundamental acoustic sources is studied theoretically, computationally and experimentally. Finite and infinitesimal monopole and dipole sources within the low audible frequency range (40-400 Hz) are considered. Analytical and numerical integral solutions that account for compression, shear and surface wave response to the buried sources are formulated and compared with numerical finite element simulations and experimental studies on finite dimension phantom models. It is found that at low audible frequencies, compression and shear wave propagation from point sources can both be significant, with shear wave effects becoming less significant as frequency increases. Additionally, it is shown that simple closed-form analytical approximations based on an infinite medium model agree well with numerically obtained ``exact'' half-space solutions for the frequency range and material of interest in this study. The focus here is on developing a better understanding of how biological soft tissue affects the transmission of vibro-acoustic energy from biological acoustic sources below the skin surface, whose typical spectral content is in the low audible frequency range. Examples include sound radiated from pulmonary, gastro-intestinal and cardiovascular system functions, such as breath sounds, bowel sounds and vascular bruits, respectively.

  1. 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. PMID:26034679

  2. Optimization of medium composition for lipase production by Candida rugosa NCIM 3462 using response surface methodology.

    PubMed

    Rajendran, Aravindan; Thangavelu, Viruthagiri

    2007-05-01

    A sequential optimization approach using statistical design of experiments was employed to enhance the lipase production by Candida rugosa in submerged batch fermentation. Twelve medium components were evaluated initially using the Plackett-Burman 2-level factorial design. The significant variables affecting lipase production were found to be glucose, olive oil, peptone, (NH4)2SO4, and FeCl3.6H2O. Various vegetable oils were tested in the second step, and among them, groundnut oil was found to be the best inducer for lipase production by C. rugosa. The third step was to identify the optimal values of the significant medium components with groundnut oil as the inducer using response surface methodology. The regression equation obtained from the experimental data designed using a central composite design was solved, and analyzing the response surface contour plots, the optimal concentrations of the significant variables were determined. A maximum lipase activity of 5.95 U.mL-1, which is 1.64 times the maximum activity obtained in the Plackett-Burman experimental trials, was observed. The optimum combination of medium constituents contained 19.604 g.L-1 glucose, 13.065 mL.L-1 groundnut oil, 7.473 g.L-1 peptone, 0.962 g.L-1 (NH4)2SO4, 0.0019 g.L-1 FeCl3.6H2O, and other insignificant components at the fixed level. A predictive model of the combined effects of the independent variables using response surface methodology and an artificial neural network was proposed. The unstructured kinetic models, logistic model, and Luedeking-Piret model were used to describe cell mass and lipase production. The parameters of the models were evaluated and the lipase production by C. rugosa was found to be growth associated.

  3. 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

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

    NASA Astrophysics Data System (ADS)

    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 (110 m wide and 50 m 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.

  6. Optimization of medium using response surface methodology for lipid production by Scenedesmus sp.

    PubMed

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

    2014-03-01

    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.

  7. 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. PMID:26683462

  8. 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.

  9. Surface Tectonics and Internal Dynamics of Mars

    NASA Astrophysics Data System (ADS)

    Loddoch, A.; Hansen, U.

    2003-12-01

    Lacking the possibility of direct examination of Mars' interior at least in the present days, mathematical models -- so-called thermal evolution models -- are of key importance for the understanding of the planet's history and its present structure. However, due to the complexity of the corresponding processes and the enormous computer power needed to study these processes, thermal evolution models often investigate the internal dynamics of a planet by the use of appropriate scaling laws. While these scaling laws imply crucial simplifications they cannot provide information about the dynamics of internal processes like the actual planform of mantle convection or its effects on the tectonics of the planetary surface. In order to take a step beyond present models and to study especially the interplay of internal dynamics and surface tectonics, we apply a three-dimensional (fluiddynamical) mantle convection model to study the internal evolution of Mars. Particularly to investigate the plausibility and the circumstances of an early plate-tectonic episode on Mars without introducing it artificially, i.e. by the means of boundary conditions. In order to study the thermal evolution of the planet we consider thermally driven convection in an incompressible boussinesq fluid with infinite Prandtl number. The fluid is both heated from below and from within applying a variable core temperature (depending on the temperature at the CMB) and a temporally declining heatproduction rate. The governing equations are solved on a 3D Cartesian domain using a Finite Volume technique. The model has proven to be well suited to study mantle convection under consideration of strongly temperature- and depth-dependent viscosity and to investigate the coupling of mantle convection and plate tectonics. Calculations that model the so-called stagnant lid mode of convection, which is the present state of the martian mantle, yield results that are in good agreement with those acquired by models

  10. 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}

  11. 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

  12. 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.}

  13. Surface preparation methods to enhance dynamic surface property measurements of shocked metal surfaces

    NASA Astrophysics Data System (ADS)

    Zellner, M. B.; Vogan McNeil, W.; Gray, G. T.; Huerta, D. C.; King, N. S. P.; Neal, G. E.; Valentine, S. J.; Payton, J. R.; Rubin, J.; Stevens, G. D.; Turley, W. D.; Buttler, W. T.

    2008-04-01

    This effort investigates surface-preparation methods to enhance dynamic surface-property measurements of shocked metal surfaces. To assess the ability of making reliable and consistent dynamic surface-property measurements, the amount of material ejected from the free surface upon shock release to vacuum (ejecta) was monitored for shocked Al-1100 and Sn targets. Four surface-preparation methods were considered: Fly-cut machine finish, diamond-turned machine finish, polished finish, and ball rolled. The samples were shock loaded by in-contact detonation of HE PBX-9501 on the front side of the metal coupons. Ejecta production at the back side or free side of the metal coupons was monitored using piezoelectric pins, optical shadowgraphy, and x-ray attenuation radiography.

  14. 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.

  15. 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. PMID:24782218

  16. 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).

  17. Bubble Dynamics on a Heated Surface

    NASA Technical Reports Server (NTRS)

    Kassemi, M.; Rashidnia, N.

    1999-01-01

    In this work, we study steady and oscillatory thermocapillary and natural convective flows 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. A combined numerical-experimental approach is adopted here. The temperature field is visualized using Mach-Zehnder and/or Wollaston Prism Interferometry and the flow field is observed by a laser sheet flow visualization technique. A finite element numerical model is developed which solves the transient two-dimensional continuity, momentum, and energy equations and includes the effects of temperature-dependent surface tension and bubble surface deformation. Below the critical Marangoni number, the steady state low-g and 1-g temperature and velocity fields predicted by the finite element model are in excellent agreement with both the visualization experiments in our laboratory and recently published experimental results in the literature. Above the critical Marangoni number, the model predicts an oscillatory flow which is also closely confirmed by experiments. It is shown that the dynamics of the oscillatory flow are directly controlled by the thermal and hydrodynamic interactions brought about by combined natural and thermocapillary convection. Therefore, as numerical simulations show, there are considerable differences between the 1-g and low-g temperature and flow fields at both low and high Marangoni numbers. This has serious implications for both materials processing and fluid management in space.

  18. Optically Transparent Porous Medium for Nondestructive Studies of Microbial Biofilm Architecture and Transport Dynamics

    PubMed Central

    Leis, Andrew P.; Schlicher, Sven; Franke, Hilmar; Strathmann, Martin

    2005-01-01

    We describe a novel and noninvasive, microscopy-based method for visualizing the structure and dynamics of microbial biofilms, individual fluorescent microbial cells, and inorganic colloids within a model porous medium. Biofilms growing in flow cells packed with granules of an amorphous fluoropolymer could be visualized as a consequence of refractive index matching between the solid fluoropolymer grains and the aqueous immersion medium. In conjunction with the capabilities of confocal microscopy for nondestructive optical sectioning, the use of amorphous fluoropolymers as a solid matrix permits observation of organisms and dynamic processes to a depth of 2 to 3 mm, whereas sediment biofilms growing in sand-filled flow cells can only be visualized in the region adjacent to the flow cell wall. This method differs fundamentally from other refractive index-matching applications in that optical transparency was achieved by matching a solid phase to water (and not vice versa), thereby permitting real-time microscopic studies of particulate-containing, low-refractive-index media such as biological and chromatographic systems. PMID:16085878

  19. 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.

  20. Dynamics of shear layers at the interface of a highly porous medium and a pure fluid

    NASA Astrophysics Data System (ADS)

    Antoniadis, P. D.; Papalexandris, M. V.

    2015-01-01

    In this paper, we report on shear flows in domains that contain a macroscopic interface between a highly porous medium and a pure fluid. Our study is based on the single-domain approach, according to which, the same set of governing equations is employed for both inside the porous medium and in the pure-fluid domain. In particular, we introduce a mathematical model for the flows of interest that is derived directly from a continuum theory for fluid-saturated granular materials. The resulting set of equations is a variation of the well-known unsteady Darcy-Brinkman model. First, we employ this model to perform a linear stability analysis of inviscid shear layers over a highly porous medium. Our analysis shows that such layers are unconditionally unstable. Next, we present results from numerical simulations of temporally evolving shear layers in both two and three dimensions. The simulations are performed via a recently designed algorithm that employs a predictor-corrector time-marching scheme and a projection method for the computation of the pressure field on a collocated grid. According to our numerical predictions, the onset of the Kelvin-Helmholtz instability leads to the formation of vortices that extend to both sides of the material interface, thus producing substantial recirculation inside the porous medium. These vortices eventually merge, leading to significant growth of the shear layer and, in three dimensional flows, transition to turbulence. The dynamics of the shear layers, including growth rate and self-similarity, is presented and analysed. Finally, the structure of these layers is described in detail and compared to the one of plain mixing layers.

  1. The stochastic dynamics of a Brownian particle in a viscoelastic (VE) medium

    NASA Astrophysics Data System (ADS)

    Azese, Martin; Bhattacharya, Sukalyan

    2012-02-01

    The stochastic dynamics of a Brownian particle in a viscoelastic (VE) medium is an important phenomenon from micro-rheological perspective. In micro-rheology, the main question is how to predict the rheological properties by observing the Brownian motion in the it without using a rheometer, as the sample is too precious to be structurally destroyed in a macro-scale experiment. Thus, several theoretical studies tried to relate the features of the stochastic motion to the VE property. However, it seems that none of these theories is complete because their formulations invariably involve heuristic assumptions inherited from the classical results for purely viscous fluid. In this talk, we will present a theory which is devoid of any such arbitrary assumption. Accordingly, we will first generalize the fluctuation-dissipation theorem for VE medium to obtain the velocity correlation function (VCF) for given velocity-response function (VRF) which describes the temporal dependence of velocity of the particle initially driven by an impulse. Our generalized theorem proves VCF and VRF to be unequal, and shows the corresponding equality in classical result for purely viscous fluid as a special case. We will re-examine the validity of Green-Kubo relation so that mean square displacement(MSD) can be associated with VCF. Finally, the linearized hydrodynamic equation for general VE medium will be solved to provide the required VRF. As a result, the property of the medium which is represented by VRF would be revealed by both time-dependence of the VCF and MSD.

  2. 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

  3. 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.

  4. Chain dynamics near surfaces: an unconventional approach

    NASA Astrophysics Data System (ADS)

    Masson, Jean-Loup; Green, Peter

    2001-03-01

    Chain dynamics near surfaces: an unconventional approach Jean-Loup Masson and Peter F. Green Graduate Program in Materials Science and Department of Chemical Engineering The University of Texas at Austin When the thickness of a polymer film is comparable to the radius of gyration, or a few radii of gyration, of the polymer chains, the properties of the film can differ appreciably from the bulk. Indeed, recent studies have documented the existence of changes of the glass transition, translational chain diffusion and the viscosity, with decreasing film thickness. For liquid films, a few tens of nanometers thick, on substrates, the disjoining pressure has a significant effect on the stability of the film. This can result on the formation of patterns reflecting fluctuations in the local film thickness. The structural, time-dependent, evolution of the film is a reflection of the effects of the disjoining pressure together with the translational dynamics of the chains. This presentation discusses the structural evolution of a thin polymer film in light of theoretical models to gain insight into the manner in which the diffusion and viscosity of the polymer changes with decreasing film thickness.

  5. 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.

  6. [Dynamic contrast medium studies with flash sequences in nuclear magnetic resonance tomography of the breast].

    PubMed

    Heywang, S H; Hilbertz, T; Pruss, E; Wolf, A; Permanetter, W; Eiermann, W; Lissner, J

    1988-03-01

    In this study the dynamic contrast behavior after Gd-DTPA of different breast tissues and tumors has been investigated with a series of T1-weighted FLASH-sequences during the first 5 minutes after the application of Gd-DTPA. The results of these dynamic FLASH-measurements have been compared to the results of the SE-sequences 6-10 and 11-15 minutes after Gd-DTPA in 40 patients with 54 different breast tissues. It could be shown that in a number of cases a better differentiation (e.g. DD between carcinomas and proliferative dysplasia) was possible on FLASH-scans early after contrast medium than on the late SE-scans. Only the distinction between non-proliferative and proliferative dysplasia was better on the late SE-scans. Evaluation of the enhancement dynamics may be helpful in some cases as an additional information. Further investigations are necessary to confirm these findings and to assess their value.

  7. Dynamic modeling of mass-flowing linear medium with large amplitude displacement and rotation

    NASA Astrophysics Data System (ADS)

    Hong, Difeng; Tang, Jiali; Ren, Gexue

    2011-11-01

    In this paper, a dynamic model of a linear medium with mass flow, such as traveling strings, cables, belts, beams or pipes conveying fluids, is proposed, in the framework of Arbitrary-Lagrange-Euler (ALE) description. The material coordinate is introduced to characterize the mass-flow of the medium, and the Absolute Nodal Coordinate Formulation (ANCF) is employed to capture geometric nonlinearity of the linear media under large displacement and rotation. The governing equations are derived in terms of d'Alembert's principle. When using an ALE description, complex mass-flowing boundary conditions can be easily enforced. Numerical examples are presented to validate the proposed method by comparison with analytical results of simplified models. The computed critical fluid velocity for the stability of a cantilevered pipe conveying fluid is correlated with the available theory in literature. The large amplitude limit-cycle oscillations of flexible pipes conveying fluid are presented, and the effect of the velocity of the fluid on the static equilibrium of the pipe under gravity is investigated.

  8. 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.

  9. 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.

  10. Pulsed laser stereophotography of plasmas and dynamically moving surfaces

    SciTech Connect

    Paisley, D.L.

    1987-01-01

    A pulsed laser is used as a light source for illuminating the surface of a dynamic event of less than or equal to1 mm/sup 2/ moving at >3 mm/..mu..s. At a predetermined time during the dynamic action, a stereo camera is used to record a pair of images of the dynamically moving surface. The stereoimage pair can be quantified for surface contour. 3 refs., 8 figs.

  11. 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.

  12. Measurement and modeling of engineered nanoparticle transport and aging dynamics in a reactive porous medium

    NASA Astrophysics Data System (ADS)

    Naftaly, Aviv; Dror, Ishai; Berkowitz, Brian

    2016-07-01

    A continuous time random walk particle tracking (CTRW-PT) method was employed to model flow cell experiments that measured transport of engineered nanoparticles (ENPs) in a reactive porous medium. The experiments involved a water-saturated medium containing negatively charged, polyacrylamide beads, resembling many natural soils and aquifer materials, and having the same refraction index as water. Negatively and positively charged ENPs were injected into a uniform flow field in a 3-D horizontal flow cell, and the spatial and temporal concentrations of the evolving ENP plumes were obtained via image analysis. As a benchmark, and to calibrate the model, Congo red tracer was employed in 1-D column and 3-D flow cell experiments, containing the same beads. Negatively charged Au and Ag ENPs demonstrated migration patterns resembling those of the tracer but were slightly more dispersive; the transport was well represented by the CTRW-PT model. In contrast, positively charged AgNPs displayed an unusual behavior: establishment of an initial plume of essentially immobilized ENPs, followed by development of a secondary, freely migrating plume. The mobile plume was found to contain ENPs that, with aging, exhibited aggregation and charge inversion, becoming negatively charged and mobile. In this case, the CTRW-PT model was modified to include a probabilistic law for particle immobilization, to account for the decreasing tendency (over distance and time) of the positively charged AgNPs to attach to the porous medium. The agreement between experimental results and modeling suggests that the CTRW-PT framework can account for the non-Fickian and surface-charge-dependent transport and aging exhibited by ENPs in porous media.

  13. 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

  14. 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.

  15. 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.

  16. 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.

  17. 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.

  18. 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.

  19. 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.

  20. Consideration for the dynamic depolarization in the effective-medium model for description of optical properties for anisotropic nanostructured semiconductors

    SciTech Connect

    Golovan, L. A.; Zabotnov, S. V. Timoshenko, V. Yu.; Kashkarov, P. K.

    2009-02-15

    The effective-medium model has been generalized within the dipole approximation, with allowance for the shape anisotropy and dynamic depolarization of semiconductor nanoparticles. The calculations revealed nonmonotonic dependences for the birefringence and dichroism on the nanoparticle size. Comparison of the measured and calculated refractive index dispersion of birefringent porous silicon layers in the near-IR region indicates that consideration for the dynamic depolarization gives a better description of the optical properties for this material in comparison with the generally used effective-medium electrostatic approximation.

  1. 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

  2. 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

  3. 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.

  4. 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.

  5. 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

  6. 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.

  7. Dynamics of inelastic and reactive gas-surface collisions

    SciTech Connect

    Smoliar, L.A.

    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.

  8. Response surface methodology for the optimization of keratinase production in culture medium containing feathers produced by Kocuria rosea.

    PubMed

    Bernal, C; Diaz, I; Coello, N

    2006-05-01

    A 43-fold increase in keratinase production by Kocuria rosea was achieved in batch fermentation using response surface methodology. Factorial designs were used to select the components of a culture medium that showed a significant effect on keratinase production. An orthogonal-central composite experimental design was performed, with only two (feathers and magnesium) from nine initial compounds being further analyzed by response surface methodology. An optimum keratinase production of 14 886.9 U/mg was obtained with the following medium composition (per litre): NH4Cl, 0.3 g; NaCl, 0.3 g; K2HPO4, 3.2 g; KH2PO4, 4.0 g; MgSO4.6H2O, 0.5 g; yeast extract, 0.1 g; and finely milled feathers, 30 g. The medium was shaken at 400 r/min with an incubation period of 14 h at 40 degrees C. PMID:16699569

  9. Measurement and characteristic analysis of refractive index of biological medium adsorption on two-dimensional photonic crystal surface

    NASA Astrophysics Data System (ADS)

    Tong, Kai; Lu, Jianru; Zhang, Zhenguo; Wang, Hui-bo; Chen, Ying

    2014-07-01

    The two-dimensional (2D) SiO2 photonic crystal (PC) is constructed with the substrate of polyester film. The PC period is 800nm, and the duty cycle is 0.5.The high refractive index coating is deposited on the surface of PC. Rigorous coupled-wave (RCWA) theory is used to analyze 2D PC narrowband reflection spectrum characteristic. A relationship model between reflection peak wavelength and medium refractive index adsorption on surface of 2D PC is established. The conclusion shows that there is a linear relationship between reflection wavelength of the PC and the refractive index of adsorption medium, with the refractive index of adsorption medium in the range of 1.3-1.8. The effects of the refractive index of deposited coating on the sensitivity of the PC biosensor are analyzed. With the increase of the refractive index of the deposited coating, the sensitivity of the sensor is increasing.

  10. 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.

  11. 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.

  12. Convection and reaction in a diffusive boundary layer in a porous medium: Nonlinear dynamics

    NASA Astrophysics Data System (ADS)

    Andres, Jeanne Therese H.; Cardoso, Silvana S. S.

    2012-09-01

    We study numerically the nonlinear interactions between chemical reaction and convective fingering in a diffusive boundary layer in a porous medium. The reaction enhances stability by consuming a solute that is unstably distributed in a gravitational field. We show that chemical reaction profoundly changes the dynamics of the system, by introducing a steady state, shortening the evolution time, and altering the spatial patterns of velocity and concentration of solute. In the presence of weak reaction, finger growth and merger occur effectively, driving strong convective currents in a thick layer of solute. However, as the reaction becomes stronger, finger growth is inhibited, tip-splitting is enhanced and the layer of solute becomes much thinner. Convection enhances the mass flux of solute consumed by reaction in the boundary layer but has a diminishing effect as reaction strength increases. This nonlinear behavior has striking differences to the density fingering of traveling reaction fronts, for which stronger chemical kinetics result in more effective finger merger owing to an increase in the speed of the front. In a boundary layer, a strong stabilizing effect of reaction can maintain a long-term state of convection in isolated fingers of wavelength comparable to that at onset of instability.

  13. 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.

  14. Co-GISAXS technique for investigating surface growth dynamics

    SciTech Connect

    Rainville, Meliha G.; Hoskin, Christa; Ulbrandt, Jeffrey G.; Narayanan, Suresh; Sandy, Alec R.; Zhou, Hua; Headrick, Randall L.; Ludwig, Jr., Karl F.

    2015-12-08

    Detailed quantitative measurement of surface dynamics during thin film growth is a major experimental challenge. Here X-ray Photon Correlation Spectroscopy with coherent hard X-rays is used in a Grazing-Incidence Small-Angle X-ray Scattering (i.e. Co-GISAXS) geometry as a new tool to investigate nanoscale surface dynamics during sputter deposition of a-Si and a-WSi2 thin films. For both films, kinetic roughening during surface growth reaches a dynamic steady state at late times in which the intensity autocorrelation function g2(q,t) becomes stationary. The g2(q,t) functions exhibit compressed exponential behavior at all wavenumbers studied. The overall dynamics are complex, but the most surface sensitive sections of the structure factor and correlation time exhibit power law behaviors consistent with dynamical scaling.

  15. Dynamics of the flame surface area in turbulent nonpremixed combustion

    SciTech Connect

    Kollmann, W.; Chen, J.H.

    1994-01-01

    The dynamic equation for the total surface area of level surfaces is developed based on a theorem of geometric measure theory and its relation to other versions of the equation is established. The mixture fraction, a quantity which is relevant to non-premixed combustion, is used to define the level surfaces. The level surface corresponding to its stoichiometric value is defined as the flame surface. It is shown that the evolution of the surface properties is determined by the rate-of-strain generated by the motion of the fluid, coupled with molecular diffusion and source terms of the scalar variable defining the level surface. DNS results obtained for a low-Reynolds number turbulent non-premixed flame are used to evaluate the effects of strain rate and scalar dynamics on the surface area of level surfaces.

  16. Atomistic spin dynamics and surface magnons.

    PubMed

    Etz, Corina; Bergqvist, Lars; Bergman, Anders; Taroni, Andrea; Eriksson, Olle

    2015-06-24

    Atomistic spin dynamics simulations have evolved to become a powerful and versatile tool for simulating dynamic properties of magnetic materials. It has a wide range of applications, for instance switching of magnetic states in bulk and nano-magnets, dynamics of topological magnets, such as skyrmions and vortices and domain wall motion. In this review, after a brief summary of the existing investigation tools for the study of magnons, we focus on calculations of spin-wave excitations in low-dimensional magnets and the effect of relativistic and temperature effects in such structures. In general, we find a good agreement between our results and the experimental values. For material specific studies, the atomistic spin dynamics is combined with electronic structure calculations within the density functional theory from which the required parameters are calculated, such as magnetic exchange interactions, magnetocrystalline anisotropy, and Dzyaloshinskii-Moriya vectors. PMID:26030259

  17. Dynamics of condensation on lubricant impregnated surfaces

    NASA Astrophysics Data System (ADS)

    Anand, Sushant; Paxson, Adam; Rykaczewski, Konrad; Beysens, Daniel; Varanasi, Kripa

    2013-03-01

    Replacing the filmwise condensation mode with dropwise condensation promises large improvements in heat transfer that will lead to large cost savings in material, water consumption and decreased size of the systems. In this regards, use of superhydrophobic surfaces fabricated by texturing surfaces with nano/microstructures has been shown to lead decrease in contact line pinning of millimetric drops resulting in fast shedding. However, these useful properties are lost during condensation where droplets that nucleate within texture grow by virtue of condensation to large sized droplets while still adhering to the surface. Recently we have shown that liquid impregnated surfaces can overcome many limitations of conventional superhydrophobic surfaces during condensation. Here we discuss aspects related to condensation on lubricant surfaces, such as behavior of growing droplets. We compare the characteristics of droplets condensing on these surfaces with their behavior on conventional un-impregnated superhydrophobic surfaces and show how use of lubricant impregnated surfaces may lead to large enhancement in heat transfer and energy efficiencies.

  18. 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.

  19. Effect of nanoconfinement on polymer dynamics: surface layers and interphases.

    PubMed

    Krutyeva, M; Wischnewski, A; Monkenbusch, M; Willner, L; Maiz, J; Mijangos, C; Arbe, A; Colmenero, J; Radulescu, A; Holderer, O; Ohl, M; Richter, D

    2013-03-01

    We present neutron spin echo experiments that address the much debated topic of dynamic phenomena in polymer melts that are induced by interacting with a confining surface. We find an anchored surface layer that internally is highly mobile and not glassy as heavily promoted in the literature. The polymer dynamics in confinement is, rather, determined by two phases, one fully equal to the bulk polymer and another that is partly anchored at the surface. By strong topological interaction, this phase confines further chains with no direct contact to the surface. These form the often invoked interphase, where the full chain relaxation is impeded through the interaction with the anchored chains. PMID:23521308

  20. Nonlinear dynamics in the perceptual grouping of connected surfaces.

    PubMed

    Hock, Howard S; Schöner, Gregor

    2016-09-01

    Evidence obtained using the dynamic grouping method has shown that the grouping of an object's connected surfaces has properties characteristic of a nonlinear dynamical system. When a surface's luminance changes, one of its boundaries is perceived moving across the surface. The direction of this dynamic grouping (DG) motion indicates which of two flanking surfaces has been grouped with the changing surface. A quantitative measure of overall grouping strength (affinity) for adjacent surfaces is provided by the frequency of DG motion perception in directions promoted by the grouping variables. It was found that: (1) variables affecting surface grouping for three-surface objects evolve over time, settling at stable levels within a single fixation, (2) how often DG motion is perceived when a surface's luminance is perturbed (changed) depends on the pre-perturbation affinity state of the surface grouping, (3) grouping variables promoting the same surface grouping combine cooperatively and nonlinearly (super-additively) in determining the surface grouping's affinity, (4) different DG motion directions during different trials indicate that surface grouping can be bistable, which implies that inhibitory interactions have stabilized one of two alternative surface groupings, and (5) when alternative surface groupings have identical affinity, stochastic fluctuations can break the symmetry and inhibitory interactions can then stabilize one of the surface groupings, providing affinity levels are not too high (which results in bidirectional DG motion). A surface-grouping network is proposed within which boundaries vary in salience. Low salience or suppressed boundaries instantiate surface grouping, and DG motion results from changes in boundary salience. PMID:26235970

  1. Input dependent cell assembly dynamics in a model of the striatal medium spiny neuron network.

    PubMed

    Ponzi, Adam; Wickens, Jeff

    2012-01-01

    The striatal medium spiny neuron (MSN) network is sparsely connected with fairly weak GABAergic collaterals receiving an excitatory glutamatergic cortical projection. Peri-stimulus time histograms (PSTH) of MSN population response investigated in various experimental studies display strong firing rate modulations distributed throughout behavioral task epochs. In previous work we have shown by numerical simulation that sparse random networks of inhibitory spiking neurons with characteristics appropriate for UP state MSNs form cell assemblies which fire together coherently in sequences on long behaviorally relevant timescales when the network receives a fixed pattern of constant input excitation. Here we first extend that model to the case where cortical excitation is composed of many independent noisy Poisson processes and demonstrate that cell assembly dynamics is still observed when the input is sufficiently weak. However if cortical excitation strength is increased more regularly firing and completely quiescent cells are found, which depend on the cortical stimulation. Subsequently we further extend previous work to consider what happens when the excitatory input varies as it would when the animal is engaged in behavior. We investigate how sudden switches in excitation interact with network generated patterned activity. We show that sequences of cell assembly activations can be locked to the excitatory input sequence and outline the range of parameters where this behavior is shown. Model cell population PSTH display both stimulus and temporal specificity, with large population firing rate modulations locked to elapsed time from task events. Thus the random network can generate a large diversity of temporally evolving stimulus dependent responses even though the input is fixed between switches. We suggest the MSN network is well suited to the generation of such slow coherent task dependent response which could be utilized by the animal in behavior.

  2. Input Dependent Cell Assembly Dynamics in a Model of the Striatal Medium Spiny Neuron Network

    PubMed Central

    Ponzi, Adam; Wickens, Jeff

    2012-01-01

    The striatal medium spiny neuron (MSN) network is sparsely connected with fairly weak GABAergic collaterals receiving an excitatory glutamatergic cortical projection. Peri-stimulus time histograms (PSTH) of MSN population response investigated in various experimental studies display strong firing rate modulations distributed throughout behavioral task epochs. In previous work we have shown by numerical simulation that sparse random networks of inhibitory spiking neurons with characteristics appropriate for UP state MSNs form cell assemblies which fire together coherently in sequences on long behaviorally relevant timescales when the network receives a fixed pattern of constant input excitation. Here we first extend that model to the case where cortical excitation is composed of many independent noisy Poisson processes and demonstrate that cell assembly dynamics is still observed when the input is sufficiently weak. However if cortical excitation strength is increased more regularly firing and completely quiescent cells are found, which depend on the cortical stimulation. Subsequently we further extend previous work to consider what happens when the excitatory input varies as it would when the animal is engaged in behavior. We investigate how sudden switches in excitation interact with network generated patterned activity. We show that sequences of cell assembly activations can be locked to the excitatory input sequence and outline the range of parameters where this behavior is shown. Model cell population PSTH display both stimulus and temporal specificity, with large population firing rate modulations locked to elapsed time from task events. Thus the random network can generate a large diversity of temporally evolving stimulus dependent responses even though the input is fixed between switches. We suggest the MSN network is well suited to the generation of such slow coherent task dependent response which could be utilized by the animal in behavior. PMID:22438838

  3. 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

  4. 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. PMID:27039367

  5. Numerical implementation of mathematical model of the dynamics of a porous medium on supercomputers of cluster architecture

    NASA Astrophysics Data System (ADS)

    Sadovskaya, O. V.; Sadovskii, V. M.

    2015-10-01

    The parallel computational algorithm for analysis of the processes of elastic-plastic deformation of a porous medium under the action of external dynamic loads is developed. This algorithm is based on the mathematical model taking into account threshold nature of change in the strength of a material under the collapse of pores. The algorithm is implemented in Fortran by means of functions of the MPI library. The parallel program system has been tested on clusters in computations of the propagation of plane longitudinal shock waves of the compression and in computations of the expansion of a cylindrical cavity in an infinite porous medium. The comparison of numerical results and exact solutions has shown their good qualitative and quantitative correspondence. Using the obtained algorithm, the process of propagation of elastic-plastic waves of the compression in a homogenous porous medium, accompanied by the deformation of a skeleton and the collapse of pores, is analyzed.

  6. Invariant algebraic surfaces for a virus dynamics

    NASA Astrophysics Data System (ADS)

    Valls, Claudia

    2015-08-01

    In this paper, we provide a complete classification of the invariant algebraic surfaces and of the rational first integrals for a well-known virus system. In the proofs, we use the weight-homogeneous polynomials and the method of characteristic curves for solving linear partial differential equations.

  7. 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.

  8. 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.

  9. Dynamic behavior of interfacila water at the silica surface

    SciTech Connect

    Argyris, Dr. Dimitrios; Cole, David R; Striolo, Alberto

    2009-01-01

    Molecular dynamics simulations were employed to study the dynamics properties of water at the silica-liquid interface at ambient temperature. Three different degrees of hydroxylation of a crystalline silica surface were used. To assess the water dynamic properties we calculated the residence probability and in-plane mean square displacement as a function of distance from the surface. The data indicate that water molecules at the fully hydroxylated surface remain longer, on average, in the interfacial region than in the other cases. By assessing the dynamics of molecular dipole moment and hydrogen-hydrogen vector an anisotropic reorientation was discovered for interfacial water in contact with any of the surfaces considered. However, the features of the anisotropic reorientation observed for water molecules depend strongly on the relative orientation of interfacial water molecules and their interactions with surface hydroxyl groups. On the partially hydroxylated surface, where water molecules with hydrogen-down and hydrogen-up orientation are both found, those water molecules associated with surface hydroxyl groups remain at the adsorbed locations longer and reorient slower than the other water molecules. A number of equilibrium properties, including density profiles, hydrogen bond networks, charge densities, and dipole moment densities are also reported to explain the dynamics results.

  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. 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.

  12. 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.

  13. 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.

  14. About efficiency of identification of materials using spectrum dynamics of medium response under the action of THz radiation

    NASA Astrophysics Data System (ADS)

    Trofimov, Vyacheslav A.; Varentsova, Svetlana A.

    2009-05-01

    A method, suggested by us earlier for identification of materials with close spectra in terahertz range of frequencies and based on the analysis of medium response spectral lines dynamics, is verified experimentally. The temporal dynamics of spectral lines allows to determine relaxation time of rotational transitions as well. A question about measurement time, that is sufficient for determining of material response characteristic time, is discussed. To demonstrate the efficiency of proposed method, we treat the response of soap and chocolate under the action of terahertz pulse with a few cycles. Our investigation shows that it is possible to identify these materials with high probability.

  15. Review of the methodology for the inversion of surface-wave phase velocities in a slightly anisotropic medium

    NASA Astrophysics Data System (ADS)

    Corchete, V.

    2012-04-01

    In this paper, a new inversion scheme for surface-wave velocities in a slightly anisotropic medium will be presented, revisiting the inversion method performed by Corchete and Badal (2004). Tecnociencia 6(2), 23-41). An extension of the Smith-Dahlen formulation will be examined and revised. The surface-wave propagation in a slightly anisotropic medium will be considered, and the inversion of the azimuthal dependence of the surface-wave dispersion will be performed. The new inversion scheme proposed in this paper will be verified by numerical matrix inversion in two examples: hexagonal symmetry and 13 nonzero canonical harmonic components. Also, two additional experiments with observed data will be performed. The new method will be shown as more efficient than the method previously used by Corchete and Badal. This new method should be a useful tool for studying the slightly anisotropic structure of wide areas of the Earth, if sufficient high-quality dispersion data are collected and the isotropic properties of the medium are well known.

  16. 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.

  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. Effects of surface trapped excess electrons on the dynamics of HCl adsorbed ice surfaces

    NASA Astrophysics Data System (ADS)

    Yoon, Yeohoon; Shin, Seokmin

    2007-05-01

    We report results of Car-Parrinello molecular dynamics simulations showing the effect of surface trapped electrons on the dynamics of HCl adsorbed ice surfaces. It is found that the existence of excess electrons can lead to extensive changes in structural and electronic properties of ice surfaces, which provide better environments for proton transfer. The results of simulations show rapid exchanging mechanism of the proton under such environment, suggesting the importance of interlayer proton transfer in the heterogeneous reaction of HCl adsorbed ice surfaces.

  19. The Diffusion Eigenstates in a Periodic Porous Medium with a Strong Surface Absorption

    NASA Astrophysics Data System (ADS)

    Bergman, D. J.; Dunn, K. J.; Latorraca, G. A.

    1997-03-01

    The Bloch diffusion eigenstates of a periodic porous medium, but with an otherwise arbitrary microstructure, and with strong absorption at the pore/matrix interface, have been calculated by expanding them in a series of eigenfunctions of an unphysical porous medium which has the same microstructure but no interface absorption, and where the diffusion also takes place inside the matrix with a diffusion coefficient that approaches infinity. The results are especially simple in the case where the interface absorption coefficient is infinite and for the q=0 eigenstates, but are very accurate also for large but finite rho and arbitrary q-vectors. The results of such calculations are compared with previous calculations that were limited to the regime of low interface absorption.

  20. 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. PMID:26366414

  1. 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

  2. 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.

  3. 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

  4. 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.

  5. 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.

  6. 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.

  7. 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.

  8. 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…

  9. 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…

  10. Surface detection, meshing and analysis during large molecular dynamics simulations

    SciTech Connect

    Dupuy, L M; Rudd, R E

    2005-08-01

    New techniques are presented for the detection and analysis of surfaces and interfaces in atomistic simulations of solids. Atomistic and other particle-based simulations have no inherent notion of a surface, only atomic positions and interactions. The algorithms we introduce here provide an unambiguous means to determine which atoms constitute the surface, and the list of surface atoms and a tessellation (meshing) of the surface are determined simultaneously. The algorithms have been implemented and demonstrated to run automatically (on the fly) in a large-scale parallel molecular dynamics (MD) code on a supercomputer. We demonstrate the validity of the method in three applications in which the surfaces and interfaces evolve: void surfaces in ductile fracture, the surface morphology due to significant plastic deformation of a nanoscale metal plate, and the interfaces (grain boundaries) and void surfaces in a nanoscale polycrystalline system undergoing ductile failure. The technique is found to be quite robust, even when the topology of the surfaces changes as in the case of void coalescence where two surfaces merge into one. It is found to add negligible computational overhead to an MD code, and is much less expensive than other techniques such as the solvent-accessible surface.

  11. 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.

  12. 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.

  13. 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.

  14. Nonlinear Actuation Dynamics of Driven Casimir Oscillators with Rough Surfaces

    NASA Astrophysics Data System (ADS)

    Broer, Wijnand; Waalkens, Holger; Svetovoy, Vitaly B.; Knoester, Jasper; Palasantzas, George

    2015-11-01

    At separations below 100 nm, Casimir-Lifshitz forces strongly influence the actuation dynamics of microelectromechanical systems (MEMS) in dry vacuum conditions. For a micron-size plate oscillating near a surface, which mimics a frequently used setup in experiments with MEMS, we show that the roughness of the surfaces significantly influences the qualitative dynamics of the oscillator. Via a combination of analytical and numerical methods, it is shown that surface roughness leads to a clear increase of initial conditions associated with chaotic motion, that eventually lead to stiction between the surfaces. Since stiction leads to a malfunction of MEMS oscillators, our results are of central interest for the design of microdevices. Moreover, stiction is of significance for fundamentally motivated experiments performed with MEMS.

  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. 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. PMID:27315235

  17. Spectral Modulation of the IBEX Ribbon Flux by the Dynamic Draping of the Interstellar Medium over the Heliosphere

    NASA Astrophysics Data System (ADS)

    Funsten, H. O.; Pittman, K. T.; Frisch, P. C.; Heerikhuisen, J.; Janzen, P. H.; McComas, D. J.; Reisenfeld, D. B.; Schwadron, N.; Zirnstein, E.

    2015-12-01

    The bright energetic neutral atom (ENA) emission in the circular ribbon observed by the Interstellar Boundary Explorer (IBEX) ribbon is a key ordering parameter of the interaction region between the heliosphere and the insterstellar medium. The ribbon is hypothesized to result from the condition in which the interstellar magnetic field, which is draped over the heliosphere and is the emission location in the "secondary" reibbon hypothesis, is oriented perpendicular to the line-of-sight view from IBEX. Here, we consider the relative motion of the draped magnetic field line for modulating ribbon intensity. Using the 0.7 keV and 1.1 keV ENA maps from the IBEX-Hi instrument, we find that this relative motion may significantly contribute to the variation of ribbon flux around the ribbon. We discuss the implications of this relative motion on our understanding the global structure and dynamics of the heliosphere-insterstellar medium interaction.

  18. 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.

  19. 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.

  20. Sub-nanometer glass surface dynamics induced by illumination

    NASA Astrophysics Data System (ADS)

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

    2015-06-01

    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 × 104 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.

  1. Annihilation of craters: Molecular dynamic simulations on a silver surface

    SciTech Connect

    Henriksson, K. O. E.; Nordlund, K.; Keinonen, J.

    2007-12-15

    The ability of silver cluster ions containing 13 atoms to fill in a preexisting crater with a radius of about 28 A ring on a silver (001) target has been investigated using molecular dynamics simulations and the molecular-dynamics-Monte Carlo corrected effective medium potential. The largest lateral distance r between crater and ion was about three times the radius of the preexisting crater, namely, 75 A ring . The results reveal that when r<20 A ring and r>60 A ring the preexisting crater is partially filled in, and for other distances there is a net growth of the crater. The lattice damage created by the cluster ions, the total sputtering yield, the cluster sputtering yield, and simulated transmission electron microscopy images of the irradiated targets are also presented.

  2. Surface dynamics as part of the European Plate Observing System

    NASA Astrophysics Data System (ADS)

    Ludden, John

    2010-05-01

    The European Plate Observing System proposal includes a "surface dynamics" part to its objectives. EPOS will create and integrate "Dedicated observatories for multidisciplinary local data acquisition (volcanoes, in-situ fault-zone monitoring experiments, geothermal and deep drilling experiments, including the application of geophysics to Earth's surface dynamics and environmental changes)". As geologists and geophysicists we have a good idea how to measure ground motions related to earth quakes, volcanoes, landslides etc. We also know that through integration of these measurements in large arrays we gain resolution and general background information that allows a much better understanding of ground motion, rates of deformation and the driving forces. How can these geophysical measurements be applied to other environmental geoscience problems? What sorts of observations might one include in EPOS? Surface dynamic processes that can be measured by geophysical techniques include permafrost changes, coastline retreat, catchment morphology, post-glacial ice rebound, groundwater variation etc.. Some of these processes are driven by factors inherent to the deep Earth (lithosphere, mantle) interaction with surface processes (erosion, climate, sea level) which control the development of topography and are the focus of the TopoEurope project an ILP and an ESF-sponsored multidisciplinary research addresses within EPOS. Others processes are driven by climate change, population dynamics and people living on and interacting with the Earth's surface and subsurface. Where should the EPOS role focus? When do these problems become global in impact? When does geological engineering become a focus for EPOS - should it? The aim of this paper is to stimulate discussion on how surface dynamics should be integrated into EPOS.

  3. 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.

  4. 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…

  5. Experimental evidence of dynamical propagation for solitary waves in ultra slow stochastic non-local Kerr medium.

    PubMed

    Louis, H; Tlidi, M; Louvergneaux, E

    2016-07-11

    We perform a statistical analysis of the optical solitary wave propagation in an ultra-slow stochastic non-local focusing Kerr medium such as liquid crystals. Our experimental results show that the localized beam trajectory presents a dynamical random walk whose beam position versus the propagation distance z depicts two different kind of evolutions A power law is found for the beam position standard deviation during the first stage of propagation. It obeys approximately z3/2 up to ten times the power threshold for solitary wave generation. PMID:27410886

  6. Experimental evidence of dynamical propagation for solitary waves in ultra slow stochastic non-local Kerr medium.

    PubMed

    Louis, H; Tlidi, M; Louvergneaux, E

    2016-07-11

    We perform a statistical analysis of the optical solitary wave propagation in an ultra-slow stochastic non-local focusing Kerr medium such as liquid crystals. Our experimental results show that the localized beam trajectory presents a dynamical random walk whose beam position versus the propagation distance z depicts two different kind of evolutions A power law is found for the beam position standard deviation during the first stage of propagation. It obeys approximately z3/2 up to ten times the power threshold for solitary wave generation. PMID:27410887

  7. 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.

  8. Nonlinear dynamics of a ball rolling on a surface

    NASA Astrophysics Data System (ADS)

    Virgin, L. N.; Lyman, T. C.; Davis, R. B.

    2010-03-01

    An underlying potential energy function can provide visual and intuitive insight into a system's stability and overall behavior. In particular, the motion of a ball moving along a curve or surface in a gravitational field provides a macroscale demonstration of interesting dynamics. We investigate the motion of a small ball rolling along a smooth two-dimensional potential surface. A direct experimental realization of this situation is suitable for demonstrating some classic features of nonlinear dynamics. The results of numerical simulations are directly compared with experimental data. To better characterize the dynamical behavior of the ball, especially when it is undergoing chaotic motion, several descriptive measures are discussed, including time-lag embedding, initial condition maps, power spectra, Lyapunov exponents, and fractal dimensions.

  9. 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. PMID:26657931

  10. 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.

  11. 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

  12. Statistical optimization of the medium composition by response surface methodology to enhance schizophyllan production by Schizophyllum commune.

    PubMed

    Li, Wenbing; Zhou, Pengpeng; Yu, Longjiang

    2011-01-01

    The response surface methodology (RSM) involving central composite design (CCD) was employed to optimize the fermentation medium for the cell growth and schizophllan production by Schizophyllum commune CGMCC 5.113 in submerged culture at pH 6.5 and 26 degrees C. The four variables involved in this study were glucose, yeast extract, ammonium nitrate, and magnesium sulfate. The statistical analysis of the results showed that, in the range studied, glucose and yeast extract had a highly significant effect on schizophyllan production. The optimal medium for schizophyllan production calculated from the regression model of RSM was as follows: glucose, 18 g/l; yeast extract, 0.5 g/l; NH4NO3, 0.48 g/l; and MgSO4, 0.05 g/l, with a predicted maximum schizophyllan production of 11.74 g/l. These predicted values were experimentally validated. The excellent correlation between predicted and measured values justifies the validity of the response model. The results of bioreactor fermentation also show that the optimized medium enhanced schizophyllan production (12.80 g/l) by S. commune in a 5-1 fermenter. PMID:21630592

  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. Anomalously rapid hydration water diffusion dynamics near DNA surfaces

    PubMed Central

    Franck, John M.; Ding, Yuan; Stone, Katherine

    2015-01-01

    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 a network of surface hydration water. 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. PMID:26256693

  15. 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.

  16. 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

  17. Constitutive Analysis of Dynamic Recrystallization and Flow Behavior of a Medium Carbon Nb-V Microalloyed Steel

    NASA Astrophysics Data System (ADS)

    Shen, Wen-fei; Zhang, Li-wen; Zhang, Chi; Xu, Yi-feng; Shi, Xin-hua

    2016-05-01

    The dynamic recrystallization (DRX) and flow behavior of a medium carbon Nb-V microalloyed steel was investigated using hot isothermal compression experiments in a wide range of temperatures (1123-1473 K) and strain rates (0.01-10 s-1). The flow stress curves were analyzed comprehensively, and it was found that the flow stress of this steel is higher than C-Mn steel and V microalloyed steel. All the curves obtained can be ranged into three principal types: work hardening, dynamic recovery, and DRX. The DRX behavior of this steel was investigated, including critical strain, kinetics of DRX, and microstructure. The constitutive equation to predict the flow stress of the tested steel was also developed, and the analysis result indicates that the developed model has a high accuracy in predicting the flow stress during hot deformation.

  18. 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.

  19. 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

  20. 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.

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

    DOE PAGES

    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 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

  2. Medium optimization for the production of a novel bioflocculant from Halomonas sp. V3a' using response surface methodology.

    PubMed

    He, Jin; Zhen, Quanwei; Qiu, Ning; Liu, Ziduo; Wang, Baojiang; Shao, Zongze; Yu, Ziniu

    2009-12-01

    The novel exopolysaccharide bioflocculant HBF-3 is produced by Halomonas sp. V3a', which is a mutant strain of the deep-sea bacterium Halomonas sp. V3a. Response surface methodology (RSM) was employed to optimize the production medium for increasing HBF-3 production. Using a Plackett-Burman experimental design to aid in the first step of optimization, edible glucose, MgSO(4) x 7 H(2)O, and NH(4)Cl were found to be significant factors affecting HBF-3 production. To determine the optimal concentration of each significant variable, a central composite design was employed. Based on response surface and canonical analysis, the optimum concentrations of the critical components were obtained as follows: edible glucose, 16.14 g/l; MgSO(4) x 7 H(2)O, 2.73 g/l; and NH(4)Cl, 1.97 g/l. HBF-3 production obtained by using the optimized medium was 4.52 g/l, which was in close agreement with the predicted value of 4.55 g/l. By scaling up fermentation from flask to fermenter, HBF-3 production was further increased to 5.58 g/l. PMID:19632109

  3. 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.

  4. Characterization of treated porcelain surfaces via dynamic contact angle analysis.

    PubMed

    Phoenix, R D; Shen, C

    1995-01-01

    Successful porcelain repair requires conditioning of porcelain surfaces. Conditioning is intended to facilitate wetting by repair materials and improve interfacial bonding. The objective of this investigation was to determine the effects of selected surface treatments upon the wettability of a representative feldspathic porcelain. Dynamic contact angle analysis and scanning electron microscopy were used to characterize the effects of such treatments. Standardized porcelain specimens were subjected to the following five treatment regimens: (1) control (no treatment); (2) airborne particle abrasion using 50 microns aluminum oxide; (3) etching with ammonium bifluoride gel; (4) etching with acidulated phosphate fluoride gel; and (5) etching with hydrofluoric acid gel. Following treatment, specimens were cleansed and dried. Advancing contact angles were quantified using dynamic contact angle analysis. Mean values and 95% confidence intervals were (in degrees): control, 63.8 +/- 2.7; ammonium bifluoride, 39.4 +/- 2.0; airborne particle abrading, 29.1 +/- 2.9; acidulated phosphate fluoride, 24.9 +/- 1.7; and hydrofluoric acid, 16.5 +/- 1.2. Significant differences were found between all treatment groups (P = .05). Subsequent scanning electron microscopy examination of treated surfaces indicated lesser contact angles were associated with surfaces displaying deeper and wider grooves. Apparently, the resultant increase in surface area produces increased wettability. It is inferred that an increase in surface area may correspond to enhanced resin-porcelain bonding.

  5. 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.

  6. 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

  7. Investigating the dynamics of surface-immobilized DNA nanomachines.

    PubMed

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

    2016-07-08

    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.

  8. 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.

  9. Efficient modelling of droplet dynamics on complex surfaces.

    PubMed

    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. PMID:26828706

  10. Molecular dynamics simulations of water droplets on polymer surfaces.

    PubMed

    Hirvi, Janne T; Pakkanen, Tapani A

    2006-10-14

    Molecular dynamics simulations were used to study the wetting of polymer surfaces with water. Contact angles of water droplets on crystalline and two amorphous polyethylene (PE) and poly(vinyl chloride) (PVC) surfaces were extracted from atomistic simulations. Crystalline surfaces were produced by duplicating the unit cell of an experimental crystal structure, and amorphous surfaces by pressing the bulk polymer step by step at elevated temperature between two repulsive grid surfaces to a target density. Different-sized water droplets on the crystalline PE surface revealed a slightly positive line tension on the order of 10(-12)-10(-11) N, whereas droplets on crystalline PVC did not yield a definite line tension. Microscopic contact angles produced by the simple point charge (SPC) water model were mostly a few degrees smaller than those produced by the extended SPC model, which, as the model with lowest bulk energy, presents an upper boundary for contact angles. The macroscopic contact angle for the SPC model was 94 degrees on crystalline PVC and 113 degrees on crystalline PE. Amorphicity of the surface increased the water contact angle on PE but decreased it on PVC, for both water models. If the simulated contact angles on crystalline and amorphous surfaces are combined in proportion to the crystallinity of the polymer in question, simulated values in relatively good agreement with measured values are obtained.

  11. 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.

  12. 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.

  13. Surface morphology study of Zr-based amorphous alloys after immersion in boiling nitric acid medium

    NASA Astrophysics Data System (ADS)

    Sharma, Poonam; Dhawan, Anil; Sharma, S. K.

    2016-05-01

    Weight loss studies have been performed to determine the corrosion resistance of amorphous Zr60Nb2Al10Ni8Cu20 and Zr59Nb3Al10Ni8Cu20 alloys in aqueous HNO3 media at boiling temperature. The FESEM micrographs has been obtained to know the surface morphology of specimens after immersion in 11.5M boiling aqueous HNO3 media. Zr59Nb3Al10Ni8Cu20 alloy shows better corrosion resistance in nitric acid media than Zr60Nb2Al10Ni8Cu20 alloy.

  14. Modeling apple surface temperature dynamics based on weather data.

    PubMed

    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

  15. Ultrafast surface dynamics probed with time resolved photoemission

    NASA Astrophysics Data System (ADS)

    Dell'Angela, M.; Hieke, F.; Sorgenfrei, F.; Gerken, N.; Beye, M.; Gerasimova, N.; Redlin, H.; Wurth, W.

    2016-01-01

    Time resolved core level photoemission (trXPS) allows real-time atom-specific investigation of ultrafast surface dynamics. Core levels contain information on the chemical state and the structure of the surface as well as the local charge distribution around specific atoms. Monitoring their evolution after optically exciting the surface, can give valuable information on the electronic (few picosecond time scale) and lattice dynamics (several picosecond timescale). We have performed a trXPS experiment at the free-electron laser FLASH at DESY in Hamburg on a clean Ir(111) surface measuring the temporal evolution of the 4f core levels of Ir(111) after optically exciting the sample. The spectral changes due to X-ray and optical laser induced space charge effects which occur in trXPS experiments with high fluence pump and probe pulses have been fully characterized and controlled during the measurements. At early time scales after the optical excitation we observe time-dependent energy shifts and intensity changes which can be partially attributed to the formation of sidebands. Furthermore, we can clearly identify contributions which result from a change in the surface electron density which then relaxes on a time scale on the order of 2 ps.

  16. Modeling apple surface temperature dynamics based on weather data.

    PubMed

    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.

  17. Dynamics of the contact between a ruthenium surface with a single nanoasperity and a flat ruthenium surface: Molecular dynamics simulations

    SciTech Connect

    Barros de Oliveira, Alan; Fortini, Andrea; Buldyrev, Sergey V.; Srolovitz, David

    2011-04-01

    We study the dynamics of the contact between a pair of surfaces (with properties designed to mimic ruthenium) via molecular dynamics simulations. In particular, we study the contact between a ruthenium surface with a single nanoasperity and a flat ruthenium surface. The results of such simulations suggest that contact behavior is highly variable. The goal of this study is to investigate the source and degree of this variability. We find that during compression, the behavior of the contact force displacement curves is reproducible, while during contact separation, the behavior is highly variable. Examination of the contact surfaces suggests that two separation mechanisms are in operation and give rise to this variability. One mechanism corresponds to the formation of a bridge between the two surfaces that plastically stretches as the surfaces are drawn apart and eventually separate in shear. This leads to a morphology after separation in which there are opposing asperities on the two surfaces. This plastic separation/bridge formation mechanism leads to a large work of separation. The other mechanism is a more brittle-like mode in which a crack propagates across the base of the asperity (slightly below the asperity/substrate junction) leading to most of the asperity on one surface or the other after separation and a slight depression facing this asperity on the opposing surface. This failure mode corresponds to a smaller work of separation. This failure mode corresponds to a smaller work of separation. Furthermore, contacts made from materials that exhibit predominantly brittle-like behavior will tend to require lower work of separation than those made from ductile-like contact materials.

  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. Ultrafast Electron-Ion Dynamics Near Aluminum Surfaces

    NASA Astrophysics Data System (ADS)

    Schleife, Andre; Wells, Kai; Knewstub, Sam

    Computational physics and materials research have greatly benefited from high-performance computing; modern first-principles simulations allow insight with unprecedented accuracy and detail. Here we use a recent highly parallel implementation of Ehrenfest molecular dynamics based on real-time time-dependent density functional theory to describe non-adiabatic ultrafast electron-ion dynamics using accurate first-principles calculations. We investigate aluminum subject to highly energetic particle radiation (hydrogen projectile) and study energy deposition due to the fast projectiles. Their high velocity makes it necessary to overcome the Born-Oppenheimer approximation. Using our first-principles calculations we study the behavior of fast ions near the surface of aluminum slabs and investigate, for instance, the influence of velocity and impact angle of the projectile ion. From the emerging non-adiabatic electron-ion dynamics we gain insight into the material on an atto-second time scale.

  20. 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.

  1. Modeling of surface cleaning by cavitation bubble dynamics and collapse.

    PubMed

    Chahine, Georges L; Kapahi, Anil; Choi, Jin-Keun; Hsiao, Chao-Tsung

    2016-03-01

    Surface cleaning using cavitation bubble dynamics is investigated numerically through modeling of bubble dynamics, dirt particle motion, and fluid material interaction. Three fluid dynamics models; a potential flow model, a viscous model, and a compressible model, are used to describe the flow field generated by the bubble all showing the strong effects bubble explosive growth and collapse have on a dirt particle and on a layer of material to remove. Bubble deformation and reentrant jet formation are seen to be responsible for generating concentrated pressures, shear, and lift forces on the dirt particle and high impulsive loads on a layer of material to remove. Bubble explosive growth is also an important mechanism for removal of dirt particles, since strong suction forces in addition to shear are generated around the explosively growing bubble and can exert strong forces lifting the particles from the surface to clean and sucking them toward the bubble. To model material failure and removal, a finite element structure code is used and enables simulation of full fluid-structure interaction and investigation of the effects of various parameters. High impulsive pressures are generated during bubble collapse due to the impact of the bubble reentrant jet on the material surface and the subsequent collapse of the resulting toroidal bubble. Pits and material removal develop on the material surface when the impulsive pressure is large enough to result in high equivalent stresses exceeding the material yield stress or its ultimate strain. Cleaning depends on parameters such as the relative size between the bubble at its maximum volume and the particle size, the bubble standoff distance from the particle and from the material wall, and the excitation pressure field driving the bubble dynamics. These effects are discussed in this contribution.

  2. Labyrinthine phase and slow dynamics in a driven magnetic granular medium

    NASA Astrophysics Data System (ADS)

    Merminod, Simon; Jamin, Timothee; Falcon, Eric; Berhanu, Michael; Division of Non-equilibrium Physics Team

    Labyrinthine patterns arise in two-dimensional physical systems submitted to competing interactions, ranging from the fields of solid-state physics to hydrodynamics. Here we experimentally investigate a labyrinthine phase in an out-of-equilibrium system constituted of vibrated granular particles. Once sufficiently magnetized, they self-organize into short chains of particles in contact and randomly orientated. We quantitatively characterize the transition from a granular gas state to a labyrinthine phase, and we explain the formation of these chains using a simple model. Interestingly, the labyrinthine phase does not display any steady state: its morphology evolves with the aging time on very long timescales. Experiments suggest that here, slow dynamics involves strong structural rearrangements and therefore is comparable to slow dynamics in structural glasses. We characterize this aging process and evaluate to what extent this analogy holds.

  3. 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.

  4. Theoretical microbubble dynamics in a viscoelastic medium at capillary breaching thresholds.

    PubMed

    Patterson, Brandon; Miller, Douglas L; Johnsen, Eric

    2012-12-01

    In order to predict bioeffects in contrast-enhanced diagnostic and therapeutic ultrasound procedures, the dynamics of cavitation microbubbles in viscoelastic media must be determined. For this theoretical study, measured 1.5 to 7.5 MHz pulse pressure waveforms, which were used in experimental determinations of capillary breaching thresholds for contrast-enhanced diagnostic ultrasound in a rat kidney, were used to calculate cavitation nucleated from contrast agent microbubbles. A numerical model for cavitation in tissue was developed based on the Keller-Miksis equation (a compressible extension of the Rayleigh-Plesset equation for spherical bubble dynamics), with a Kelvin-Voigt constitutive relation. From this model, the bubble dynamics corresponding to the experimentally obtained capillary breaching thresholds were determined. Values of the maximum radius and temperature corresponding to previously determined bioeffect thresholds were computed for a range of ultrasound pulses and bubble sizes for comparison to inertial cavitation threshold criteria. The results were dependent on frequency, the gas contents, and the tissue elastic properties. The bioeffects thresholds were above previously determined inertial cavitation thresholds, even for the tissue models, suggesting the possibility of a more complex dosimetry for capillary injury in tissue. PMID:23231107

  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. Structure, dynamics, and surface reactions of bioactive glasses

    NASA Astrophysics Data System (ADS)

    Zeitler, Todd R.

    Three bioactive glasses (45S5, 55S4.3, and 60S3.8) have been investigated using atomic-scale molecular dynamics simulations in attempt to explain differences in observed macroscopic bioactivity. Bulk and surface structures and bulk dynamics have been characterized. Ion exchange and hydrolysis reactions, the first two stages in Hench's model describing the reactions of bioactive glass surfaces in vivo, have been investigated in detail. The 45S5 composition shows a much greater network fragmentation: it is suggested that this fragmentation can play a role in at least the first two stages of Hench's model for HCA formation on the surfaces of bioactive glasses. In terms of dynamic behavior, long-range diffusion was only observed for sodium. Calcium showed only jumps between adjacent sites, while phosphorus showed only local vibrations. Surface simulations show the distinct accumulation of sodium at the immediate surface for each composition. Surface channels are also shown to exist and are most evident for 45S5 glass. Results for a single ion exchange showed that the ion-exchange reaction is preferred (more exothermic) for Na+ ions near Si, rather than P. A range of reaction energies were found, due to a range of local environments, as expected for a glass surface. The average reaction energies are not significantly different among the three glass compositions. The results for bond hydrolysis on as-created surfaces show no significant differences among the three compositions for simulations involving Si-O-Si or Si-O-P. All average values are greater than zero, indicating endothermic reactions that are not favorable by themselves. However, it is shown that the hydrolysis reactions became more favorable (in fact, exothermic for 45S5 and 55S4.3) when simulated on surfaces that had already been ion-exchanged. This is significant because it gives evidence supporting Hench's proposed reaction sequence. Perhaps even more significantly, the reaction energies for hydrolysis

  7. 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.

  8. 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.

  9. Interactions between surface roughness and airflow turbulence affecting drying dynamics of rough porous surfaces

    NASA Astrophysics Data System (ADS)

    Haghighi, Erfan; Kirchner, James; Or, Dani

    2016-04-01

    Evaporative drying of porous surfaces interacting with turbulent airflows is common in various industrial and natural applications. The intrinsic relief and roughness of natural porous surfaces are likely to influence the structure of interacting turbulent airflow boundary layers, and thus affect rates and patterns of heat and vapor fluxes from the surface. These links have been formalized in new mechanistic models that consider intermittent and localized turbulence-induced boundary layers, resulting in rich surface evaporation and energy exchange dynamics. The models were evaluated experimentally by systematically varying surface roughness elements in drying experiments of wavy and bluff-body covered sand surfaces in a wind tunnel. Thermal infrared signatures of localized evaporative fluxes as well as mean evaporative mass losses were recorded. The resulting patterns were in good agreement with model predictions for local and surface averaged turbulent exchange rates. Experimental and theoretical results suggest that evaporative water losses from wavy sand surfaces can be either enhanced or suppressed (relative to a flat surface), due to the complex interplay between the local boundary layer thickness and internal limitations on water flow to the evaporating surface. For sand surfaces covered by isolated cylindrical elements (bluff bodies), model predictions and measurements show persistent enhancement of evaporative fluxes from bluff-rough surfaces compared to a flat surface under similar conditions. This enhancement is attributed to the formation of vortices that thin the boundary layer over part of the interacting surface footprint. The implications of this study for interpreting and upscaling evapotranspiration rates from terrestrial surfaces will be discussed.

  10. Rigorous theoretical analysis of a surface-plasmon nanolaser with monolayer MoS2 gain medium.

    PubMed

    Meng, Xiang; Grote, Richard R; Jin, Wencan; Dadap, Jerry I; Panoiu, Nicolae C; Osgood, Richard M

    2016-06-01

    Lasers based on monolayer (ML) transition-metal dichalcogenide semiconductor crystals have the potential for low threshold operation and a small device footprint; however, nanophotonic engineering is required to maximize the interaction between the optical fields and the three-atom-thick gain medium. Here, we develop a theoretical model to design a direct bandgap optically pumped nanophotonic integrated laser. Our device utilizes a gap-surface-plasmon optical mode to achieve subwavelength optical confinement and consists of a high-index GaP nanowire atop an ML MoS2 film on an Ag substrate. The optical field and material medium are analyzed using a three dimensional finite-difference time-domain method and a first-principles calculation based on the density functional theory, respectively. The nanolaser is designed to have a threshold of ∼0.6  μW under quasi-continuous wave operation on an excitonic transition at room temperature. PMID:27244433

  11. 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.

  12. 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.

  13. Diffuse gas in the interstellar medium: Studies involving coupled ionization, radiation and dynamics

    SciTech Connect

    Slavin, J.D.

    1990-01-01

    A study is presented of the consequences of a conductive boundary on the Local Cloud, the warm low density region immediately surrounding the Sun. The evaporation of the cloud is modeled assuming steady flow. The soft x ray and EUV emission from the interface are calculated and compared with observations. It is found that the emission in the softest x ray band, the Be band, is harder than that of an equilibrium, normal abundance, 10(exp 6)K plasma. The results are also presented of a 1-D (spherical symmetry) numerical simulation of the evolution of a supernova remnant in a homogeneous medium with a 5 micro-G magnetic field and density of 0.2/cu cm. The remnant evolution was followed from the early Sedov-Taylor phase through the final collapse of the hot bubble after 5.5 x 10(exp 6) years. It was found that the evolution of the remnant, once it has become radiative, differs substantially from the equivalent field-free case, having a smaller interior hot bubble and thicker cold shell. Examples of calculated EUV and FUV emission spectra from the hot bubble are presented and their observability discussed.

  14. Multi-Scale Dynamics From Earth's Surface into the Thermosphere

    NASA Astrophysics Data System (ADS)

    Fritts, David

    2016-07-01

    Atmospheric structures ranging from very small scales near Earth's surface to much larger scales in the mesosphere and lower thermosphere (MLT) appear to exhibit common features and underlying dynamics. Above the turbopause at ~110 km, kinematic viscosity and thermal diffusivity largely suppress flow instabilities leading to turbulence. Below the turbopause, however, multi-scale dynamics appear to drive systematic transfers of energy both among quasi-two-dimensional (2D) motions at larger scales and to three-dimensional (3D) instabilities and turbulence at smaller scales. Such multi-scale dynamics arise due to superposed GWs and background wind shears and readily drive local layered structures comprising thinner, strongly stratified and sheared "sheets" and thicker, weakly stratified and sheared "layers". These environments initiate various types of instabilities that yield local turbulence and mixing that contribute to maintenance of the "sheet and layer" (S&L) structures. Idealized modeling of these dynamics describe many S&L flow, instability, and turbulence features that are confirmed by observations from the stable boundary layer into the mesosphere. Similar dynamics accompany larger-scale gravity waves that encounter variable stratification and shear, and that induce strong local body forces, throughout the atmosphere.

  15. 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.

  16. 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.

  17. Atmospheric aerosol impacts on sea surface temperatures and medium range forecast.

    NASA Astrophysics Data System (ADS)

    Oyola, M. I.; Joseph, E.; Lu, C. H.; Nalli, N. R.

    2014-12-01

    This work proposes a series of experiments to analyze the impact of dust aerosols on numerical weather prediction (NWP) and the global data assimilation system. We strive to accomplish this by the application of the NOAA Environmental Modeling System/Global Forecasting System (NEMS/GFS) aerosol component (NGAC), which corresponds to the first global interactive atmosphere-aerosol forecast system ever implemented at NOAA's National Center for Environmental Prediction (NCEP) and which has been operational since September 2012. Specifically, our approach will include the implementation of an improved satellite sea surface temperature (SST) retrieval methodology, that allows for better representation of the atmospheric state under dust-laden conditions. Specifically, the new algorithm will be included within the NGAC aerosol product to improve the accuracy of the SST analysis and examine the impact on NWP, particularly in tropical cyclone genesis regions in the eastern Atlantic. The results of these corrections are validated against observed measurements from the eastern Atlantic Ocean, which is dominated by Saharan dust throughout most of the year and that is also a genesis region for Atlantic tropical cyclones. These observations are obtained from the NOAA Aerosols and Ocean Science Expeditions (AEROSE) and PIRATA Northeast Extension (PNE) buoys network. We believe that the improved physical SST methodology has the potential to allow for improved representation of the geophysical state under dust-laden conditions

  18. Microscopic analysis of non-equilibrium dynamics in the semiconductor-laser gain medium

    SciTech Connect

    Hader, J.; Moloney, J. V.; Koch, S. W.

    2014-04-14

    Fully microscopic many-body calculations are used to analyze the carrier dynamics in situations where a strong sub-picosecond pulse interacts with an inverted semiconductor quantum well. Electron-electron and electron-phonon scatterings are calculated on a second Born-Markov level. Intra-subband scatterings on a scale of tens of femtoseconds are shown to quickly re-fill the kinetic holes created in the carrier distributions during the pulse amplification. Even for sub-100 fs pulses, this significantly influences the pulse amplification as well as its spectral dependence. Interband scatterings on a few picosecond timescale limit the possibly achievable repetition rate in pulsed semiconductor lasers.

  19. Dynamics of a liquid drop in porous medium saturated by another liquid under gravity

    NASA Astrophysics Data System (ADS)

    Ivantsov, A. O.; Lyubimova, T. P.

    2016-02-01

    The work deals with numerical simulations of settling or ascension process of a liquid drop in porous media saturated by another liquid. The calculations were carried out using the Darcy model by Level set method with adaptive mesh refinement algorithm that dynamically refines computational mesh near interface. It is shown that the drop is unstable and the finger instability develops at the forefront of moving drop for any ratio of the viscosities of liquids. Under modulated pressure gradient small-scale perturbations of interface are suppressed and in the case of modulation with large enough intensity drop becomes stable.

  20. Manipulating dynamic drops using a hybrid superhydrophobic/hydrophilic surface

    NASA Astrophysics Data System (ADS)

    Guo, Yunhe; Song, Dong; Song, Baowei; Hu, Haibao

    2016-11-01

    A hybrid surface composed of superhydrophobic patterns on hydrophilic substrate was fabricated by selective painting. The impingement of a water drop on this surface was investigated using lattice Boltzmann simulation. When a drop impinged on the boundary line between the superhydrophobic and hydrophilic area, the drop would spread preferentially to the hydrophilic area while the spreading at the superhydrophobic area was highly impeded. The maximum spreading diameters as well as the spreading time, which are extremely important for the heat transfer on solid surfaces, were analyzed in detail. By adjusting the distance between the landing point and the boundary line of the superhydrophobic/hydrophilic area, the maximum spreading diameter and spreading time could be altered precisely. The impinging velocity has been found to be important on the manipulation of the dynamic droplet as well.

  1. Surface Dynamics of Segregation Layer in Blockcopolymer Films

    NASA Astrophysics Data System (ADS)

    Song, Sanghoon; Cha, Wonsuk; Jiang, Zhang; Narayanan, Suresh; Ruehm, Adrian; Sinha, Sunil K.; Kim, Hyunjung

    2009-03-01

    We have investigated the surface dynamics of supported block copolymer films of poly(styrene)-b-poly(dimethylsiloxane) (PS-b- PDMS) in the spherical phase, i.e., PDMS cores surrounded by PS shells by x-ray photon correlation spectroscopy (XPCS) in grazing angle geometry. The experiment was performed at the beamline 8ID-I in Advanced Photon Source. We found that the PDMS-rich layer near the surface appears at the temperature higher than the glass transition temperature. We applied the modified theory for bilayer model with surface capillary waves on simple viscoelastic liquid films. The viscosity obtained in this study is compared with that from the rheology measurement for bulk.

  2. 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.

  3. Molecular Dynamics Simulations of Glycerol Monooleate Confined between Mica Surfaces.

    PubMed

    Bradley-Shaw, Joshua L; Camp, Philip J; Dowding, Peter J; Lewtas, Ken

    2016-08-01

    The structure and frictional properties of glycerol monooleate (GMO) in organic solvents, with and without water impurity, confined and sheared between two mica surfaces are examined using molecular dynamics simulations. The structure of the fluid is characterized in various ways, and the differences between systems with nonaggregated GMO and with preformed GMO reverse micelles are examined. Preformed reverse micelles are metastable under static conditions in all systems. In n-heptane under shear conditions, with or without water, preformed GMO reverse micelles remain intact and adsorb onto one surface or another, becoming surface micelles. In dry toluene, preformed reverse micelles break apart under shear, while in the presence of water, the reverse micelles survive and become surface micelles. In all systems under static and shear conditions, nonaggregated GMO adsorbs onto both surfaces with roughly equal probability. Added water is strongly associated with the GMO, irrespective of shear or the form of the added GMO. In all cases, with increasing shear rate, the GMO molecules flatten on the surface, and the kinetic friction coefficient increases. Under low-shear conditions, the friction is insensitive to the form of the GMO added, whereas the presence of water is found to lead to a small reduction in friction. Under high-shear conditions, the presence of reverse micelles leads to a significant reduction in friction, whereas the presence of water increases the friction in n-heptane and decreases the friction in toluene. PMID:27429247

  4. Molecular Dynamics Simulations of Glycerol Monooleate Confined between Mica Surfaces.

    PubMed

    Bradley-Shaw, Joshua L; Camp, Philip J; Dowding, Peter J; Lewtas, Ken

    2016-08-01

    The structure and frictional properties of glycerol monooleate (GMO) in organic solvents, with and without water impurity, confined and sheared between two mica surfaces are examined using molecular dynamics simulations. The structure of the fluid is characterized in various ways, and the differences between systems with nonaggregated GMO and with preformed GMO reverse micelles are examined. Preformed reverse micelles are metastable under static conditions in all systems. In n-heptane under shear conditions, with or without water, preformed GMO reverse micelles remain intact and adsorb onto one surface or another, becoming surface micelles. In dry toluene, preformed reverse micelles break apart under shear, while in the presence of water, the reverse micelles survive and become surface micelles. In all systems under static and shear conditions, nonaggregated GMO adsorbs onto both surfaces with roughly equal probability. Added water is strongly associated with the GMO, irrespective of shear or the form of the added GMO. In all cases, with increasing shear rate, the GMO molecules flatten on the surface, and the kinetic friction coefficient increases. Under low-shear conditions, the friction is insensitive to the form of the GMO added, whereas the presence of water is found to lead to a small reduction in friction. Under high-shear conditions, the presence of reverse micelles leads to a significant reduction in friction, whereas the presence of water increases the friction in n-heptane and decreases the friction in toluene.

  5. ACTIVE MEDIA: Pump and amplification dynamics of gamma rays in a nuclear medium with the hidden population inversion

    NASA Astrophysics Data System (ADS)

    Rivlin, Lev A.

    2009-12-01

    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.

  6. 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.

  7. 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.

  8. 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).

  9. 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). PMID:26574348

  10. 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.

  11. 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.

  12. 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.

  13. 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

  14. 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

  15. Cooling rate and size effects on the medium-range structure of multicomponent oxide glasses simulated by molecular dynamics.

    PubMed

    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(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 application

  16. 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

  17. 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. PMID:22540716

  18. Sliding bubble dynamics and the effects on surface heat transfer

    NASA Astrophysics Data System (ADS)

    Donnelly, B.; Robinson, A. J.; Delauré, Y. M. C.; Murray, D. B.

    2012-11-01

    An investigation into the effects of a single sliding air bubble on heat transfer from a submerged, inclined surface has been undertaken. Existing literature has shown that both vapour and gas bubbles can increase heat transfer rates from adjacent heated surfaces. However, the mechanisms involved are complex and dynamic and in some cases poorly understood. The present study utilises high speed, high resolution, infrared thermography and video photography to measure two dimensional surface heat transfer and three dimensional bubble position and shape. This provides a unique insight into the complex interactions at the heated surface. Bubbles of volume 0.05, 0.1, 0.2 and 0.4 ml were released onto a surface inclined at 30 degrees to horizontal. Results confirmed that sliding bubbles can enhance heat transfer rates up to a factor of 9 and further insight was gained about the mechanisms behind this phenomenon. The enhancement effects were observed over large areas and persisted for a long duration with the bubble exhibiting complex shape and path oscillations. It is believed that the periodic wake structure present behind the sliding bubble affects the bubble motion and is responsible for the heat transfer effects observed. The nature of this wake is proposed to be that of a chain of horseshoe vortices.

  19. Rare event molecular dynamics simulations of plasma induced surface ablation

    SciTech Connect

    Sharia, Onise; Holzgrafe, Jeffrey; Park, Nayoung; Henkelman, Graeme

    2014-08-21

    The interaction of thermal Ar plasma particles with Si and W surfaces is modeled using classical molecular dynamics (MD) simulations. At plasma energies above the threshold for ablation, the ablation yield can be calculated directly from MD. For plasma energies below threshold, the ablation yield becomes exponentially low, and direct MD simulations are inefficient. Instead, we propose an integration method where the yield is calculated as a function of the Ar incident kinetic energy. Subsequent integration with a Boltzmann distribution at the temperature of interest gives the thermal ablation yield. At low plasma temperatures, the ablation yield follows an Arrhenius form in which the activation energy is shown to be the threshold energy for ablation. Interestingly, equilibrium material properties, including the surface and bulk cohesive energy, are not good predictors of the threshold energy for ablation. The surface vacancy formation energy is better, but is still not a quantitative predictor. An analysis of the trajectories near threshold shows that ablation occurs by different mechanisms on different material surfaces, and both the mechanism and the binding of surface atoms determine the threshold energy.

  20. Rare event molecular dynamics simulations of plasma induced surface ablation.

    PubMed

    Sharia, Onise; Holzgrafe, Jeffrey; Park, Nayoung; Henkelman, Graeme

    2014-08-21

    The interaction of thermal Ar plasma particles with Si and W surfaces is modeled using classical molecular dynamics (MD) simulations. At plasma energies above the threshold for ablation, the ablation yield can be calculated directly from MD. For plasma energies below threshold, the ablation yield becomes exponentially low, and direct MD simulations are inefficient. Instead, we propose an integration method where the yield is calculated as a function of the Ar incident kinetic energy. Subsequent integration with a Boltzmann distribution at the temperature of interest gives the thermal ablation yield. At low plasma temperatures, the ablation yield follows an Arrhenius form in which the activation energy is shown to be the threshold energy for ablation. Interestingly, equilibrium material properties, including the surface and bulk cohesive energy, are not good predictors of the threshold energy for ablation. The surface vacancy formation energy is better, but is still not a quantitative predictor. An analysis of the trajectories near threshold shows that ablation occurs by different mechanisms on different material surfaces, and both the mechanism and the binding of surface atoms determine the threshold energy. PMID:25149805

  1. 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.

  2. 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.

  3. 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. PMID:24819433

  4. Application of response surface methodology in medium optimization for protease production by the new strain of Serratia marcescens SB08.

    PubMed

    Venil, Chidambaram Kulandaisamy; Lakshmanaperumalsamy, Perumalsamy

    2009-01-01

    For production of protease by a new strain, Serratia marcescens SB08, optimization of the fermentation medium and environmental conditions, were carried out by applying factorial design and response surface methodology. The results of factorial design showed that pH, agitation, incubation time and yeast extract were the key factors affecting protease production. The optimal cultural conditions for protease production obtained with response surface methodology were pH 6.0, agitation 100 rpm, incubation time 51.0 h and yeast extract 3.0 g/l. This model was also validated by repeating the experiments under the optimized conditions, which resulted in the maximum protease production of 281.23 U/ml (Predicted response 275.66 U/ml), thus proving the validity of the model. Unexplored Serratia marcescens SB08 strain isolated from enteric gut of sulphur butterfly (Kricogonia lyside) was taken up for this study. This study demonstrates the ability of the new strain, Serratia marcescens SB08, for protease production and also that smaller and less time consuming statistical experimental designs are adequate for the optimization of fermentation processes for maximum protease production.

  5. 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

  6. 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.

  7. 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.

  8. 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.

  9. A particle-in-cell mode beam dynamics simulation of medium energy beam transport for the SSC-Linac

    NASA Astrophysics Data System (ADS)

    Xiao, Chen; He, Yuan; Yuan, You-Jin; Lu, Yuan-Rong; Liu, Yong; Wang, Zhi-Jun; Du, Xiao-Nan; Yao, Qing-Gao; Liu, Ge; Xu, Meng-Xin; He, Shou-Bo; Xia, Jia-Wen

    2012-01-01

    A new linear accelerator system, called the SSC-Linac injector, is being designed at HIRFL (the heavy ion research facility of Lanzhou). As part of the SSC-Linac, the medium energy beam transport (MEBT) consists of seven magnetic quadrupoles, a re-buncher and a diagnose box. The total length of this segment is about 1.75 m. The beam dynamics simulation in MEBT has been studied using the TRACK 3D particle-in-cell code, and the simulation result shows that the beam accelerated from the radio frequency quadrupole (RFQ) matches well with the acceptance of the following drift tube linac (DTL) in both the transverse and longitudinal phase spaces, and that most of the particles can be captured by the final sector focusing cyclotron for further acceleration. The longitudinal emittance of the RFQ and the longitudinal acceptance of the DTL was calculated in detail, and a multi-particle beam dynamics simulation from the ion source to the end of the DTL was done to verify the original design.

  10. Dynamics of radiation from a wide-aperture laser under conditions of coherent interaction of the radiation with a medium

    SciTech Connect

    Zaikin, A P

    1999-11-30

    The dynamics of the radiation from a wide-aperture laser is investigated taking account of the finite response time of the polarisation of the active medium. This radiation is described by the Maxwell - Bloch equations, which are simplified for the case of fast relaxation of the polarisation. The methods of a qualitative theory of nonlinear dynamics systems are used to find the conditions for instability of the steady-state homogeneous laser radiation field in a Fabry - Perot cavity. It is shown that, as a rule, the system becomes unstable via an Andronov - Hopf bifurcation and the transverse profile of the optical field is modulated by a travelling self-wave. The main parameters of these self-waves are determined and their growth increment is found. It is shown that each of the roots of the characteristic equation of the system can be used to estimate the stability range of the self-wave solutions. The laser equations are also solved numerically and the results obtained are in good agreement with the conclusions of the qualitative theory. The numerical results predict harmonic and quasi-harmonic self-waves (with multiplication of their period) and also behaviour resembling chaos. (lasers)

  11. 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

  12. 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

  13. 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.

  14. 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

  15. 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. PMID:17782145

  16. Fluorescence decay dynamics of surface-functionalized nanoparticles

    NASA Astrophysics Data System (ADS)

    Ajimo, Jacob; Ma, Lun; Yao, Mingzhen; Zhang, Xing; Como, John; Hope-Weeks, Louisa; Huang, Juyang; Chen, Wei; Cheng, Kwan

    2008-10-01

    We report the fluorescence decay dynamics of surface-functionalized nanoparticles (NPs), poly(ethylene glycol) bis(carboxymethyl) ether coated LaF3: Ce,Tb and thioglycolic acid coated ZnS:Mn, in solution and also in the surface-bound phase. The NPs exhibited high quantum yield and multi-component decays, and of average lifetime of 20-130 microseconds in solution, but 10-60 microseconds in the bound phase depending on the solid substrates. Our results suggest that the coated ZnS:Mn nanoparticles hold great promise as a non-toxic labeling agent for ultra-sensitive, time-gated, trace biomaterials detections in nano-forensic applications.

  17. Pseudospectral Gaussian quantum dynamics: Efficient sampling of potential energy surfaces

    NASA Astrophysics Data System (ADS)

    Heaps, Charles W.; Mazziotti, David A.

    2016-04-01

    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.

  18. 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

  19. 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.

  20. 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. PMID:27131532

  1. 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.

  2. Dynamic Stereo Display And Interaction With Surfaces Of Medical Objects

    NASA Astrophysics Data System (ADS)

    Herman, Gabor T.

    1986-01-01

    Three-dimensional (3D) surface display is an alternate way of presenting to the physician information that is available in a sequence of two-dimensional CT or MRI scans. The aim is to present organs (or parts of organs) as they would appear if they were removed from the body, possibly cut open, and viewed from user-selected directions. In recent years there have been a number of papers discussing the clinical utility of this approach. In nearly all these papers the presentation of the surface consists of single images of the objects of interest. In these monoscopic images, depth perception is conveyed by the differential shading that is computed as if light were shining on the surface. This is augmented by the silhouette of the external features. Since shading is dependent on the distance from the light source and the angle of the surface to the light rays, these two effects may oppose each other, especially with perception of details in depths of cavities. In addition, the detail inside a cavity cannot be silhouetted at any viewing angle. Since many anatomical surfaces have significant information in the depths of cavities (e.g., orbits, neural foramina, cardiac cavities), the addition of stereoscopic depth perception and motion should be clinically useful. In a recent article, we presented 3D surface displays in stereo, thereby providing an important additional cue for correct 3D depth perception. Here we discuss issues of software and hardware for dynamic stereo display and for 3D interaction with the stereoscopic images.

  3. 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.

  4. 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. PMID:27085047

  5. Dynamical Monte Carlo methods for plasma-surface reactions

    NASA Astrophysics Data System (ADS)

    Guerra, Vasco; Marinov, Daniil

    2016-08-01

    Different dynamical Monte Carlo algorithms to investigate molecule formation on surfaces are developed, evaluated and compared with the deterministic approach based on reaction-rate equations. These include a null event algorithm, the n-fold way/BKL algorithm and an ‘hybrid’ variant of the latter. NO2 formation by NO oxidation on Pyrex and O recombination on silica with the formation of O2 are taken as case studies. The influence of the grid size on the CPU calculation time and the accuracy of the results is analysed. The role of Langmuir–Hinsehlwood recombination involving two physisorbed atoms and the effect of back diffusion and its inclusion in a deterministic formulation are investigated and discussed. It is shown that dynamical Monte Carlo schemes are flexible, simple to implement, describe easily elementary processes that are not straightforward to include in deterministic simulations, can run very efficiently if appropriately chosen and give highly reliable results. Moreover, the present approach provides a relatively simple procedure to describe fully coupled surface and gas phase chemistries.

  6. Dynamical Monte Carlo methods for plasma-surface reactions

    NASA Astrophysics Data System (ADS)

    Guerra, Vasco; Marinov, Daniil

    2016-08-01

    Different dynamical Monte Carlo algorithms to investigate molecule formation on surfaces are developed, evaluated and compared with the deterministic approach based on reaction-rate equations. These include a null event algorithm, the n-fold way/BKL algorithm and an ‘hybrid’ variant of the latter. NO2 formation by NO oxidation on Pyrex and O recombination on silica with the formation of O2 are taken as case studies. The influence of the grid size on the CPU calculation time and the accuracy of the results is analysed. The role of Langmuir-Hinsehlwood recombination involving two physisorbed atoms and the effect of back diffusion and its inclusion in a deterministic formulation are investigated and discussed. It is shown that dynamical Monte Carlo schemes are flexible, simple to implement, describe easily elementary processes that are not straightforward to include in deterministic simulations, can run very efficiently if appropriately chosen and give highly reliable results. Moreover, the present approach provides a relatively simple procedure to describe fully coupled surface and gas phase chemistries.

  7. 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.

  8. Arctic Dynamic Topography and Surface Currents from Cryosat-2

    NASA Astrophysics Data System (ADS)

    Thomas, S. F.; Ridout, A.

    2015-12-01

    The Arctic Ocean is known to be a region of significance in global climate, and has been observed to undergo drastic changes in recent decades. As research continues to understand the Arctic and the interaction of atmosphere, ice & ocean, a key area of study is ocean circulation - the investigation of which has traditionally been hampered by the region's harsh and ice-covered nature. However with the advent of polar altimetry and the development of lead retracking, we may draw back the veil of sea ice and study the ocean beneath. We use UCL's well-developed sea ice retracking techniques to acquire sea surface height (SSH) measurements at leads across the Arctic. These data are used to produce a sea surface field, which is combined with the geoid to calculate dynamic topography and associated geostrophic currents. By adjusting the processing of SSH measurements we may examine surface currents on different time scales, from the multi-year mean state to annual and monthly variations. We demonstrate the major improvement in coverage and resolution offered by Cryosat-2, as well as comparison against in-situ data. We show the variations in currents visible on different time scales, and discuss the considerations of processing data on these time scales with reference to Cryosat's ground track/sampling pattern. We examine the potential effect of irregular distributions of leads, and the significance of any bias introduced by melt ponds in summer. We also show the improvements offered by using a combined (rather than satellite-only) geoid solution, and the caveats thereof. Finally, we look to methods of improving Arctic dynamic topography products in the future.

  9. 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

  10. 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.

  11. Molecular dynamics simulation of the adsorption of a fibronectin module on a graphite surface.

    PubMed

    Raffaini, Giuseppina; Ganazzoli, Fabio

    2004-04-13

    We report atomistic simulations of the adsorption of a fibronectin type I module on a hydrophobic graphite surface. This module comprises only beta-sheets, unlike the albumin fragments previously investigated by us which contained only alpha-helices (Raffaini, G.; Ganazzoli, F. Langmuir 2003, 19, 3403-3412). As done in the latter case, most simulations are carried out in an effective dielectric medium by energy minimizations and molecular dynamics (MD). Further optimizations and MD runs in the explicit presence of water are also performed to assess the stability of the geometries found and to describe the solvation of the adsorbed fibronectin module. The initial adsorption is accompanied by local rearrangements of the strands in contact with the surface, but the overall molecular structure is largely preserved. Much larger rearrangements take place at longer times as found through the MD runs, with the molecule spreading as much as possible so as to maximize the surface coverage, hence the interaction energy, despite a significant strain energy. Energetic aspects of adsorption together with the concomitant size change are discussed in comparison with our previous results for two albumin fragments.

  12. 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.

  13. 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.

  14. Dynamic modeling of contaminant transport with surface runoff and sediment

    SciTech Connect

    Ashraf, M.S.

    1992-01-01

    Non-point source pollution in surface runoff due to agricultural activities presents one of the principal problems in the U.S. Solution to the problem of delivering pollutants is crucial to a non-point abatement program. Mathematical models can serve as tools to relate hydrologic conditions and soil properties to the processes of pollutant transport, and can be used to evaluate the effectiveness of best management practices in reducing non-point source pollutant load in surface waters. In this study, a dynamic model component is developed to simulate transport of non-point source pollutants, mostly agricultural chemicals, with surface runoff and sediment in agricultural watersheds. Algorithms are developed to route chemicals and infiltrating water through different soil increments assuming complete mixing until time of ponding or initiation of runoff. Once runoff starts, the runoff interacts with a mixing soil layer in a non-uniform fashion and exchange of chemicals takes place between runoff and the mixing soil layer. When runoff storage builds up, it is assumed that a relatively stagnant depth of runoff interacts with the mixing soil layer. This stagnant depth is obtained by applying boundary layer theory. Mass balance equations are used to route chemicals associated with runoff and sediment along the slope lengths for overland and channel flow. Model algorithms are coupled with the hydrologic and sediment transport model RUNOFF to simulate transport of contaminants with surface runoff and sediments in agricultural watersheds. The model performance is evaluated with data ranging from controlled laboratory experiments to watershed scale. The concept of non-uniform mixing is tested with a laboratory data set found in the literature. A total of fifteen runs are made, five for each of the chemicals, nitrate, phosphate, and cyanazine. The model results show good agreements with the observed yields of runoff, sediment, orthophosphate, and ammonium.

  15. 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

  16. Comparison of actin and cell surface dynamics in motile fibroblasts

    PubMed Central

    1992-01-01

    We have investigated the dynamic behavior of actin in fibroblast lamellipodia using photoactivation of fluorescence. Activated regions of caged resorufin (CR)-labeled actin in lamellipodia of IMR 90 and MC7 3T3 fibroblasts were observed to move centripetally over time. Thus in these cells, actin filaments move centripetally relative to the substrate. Rates were characteristic for each cell type; 0.66 +/- 0.27 microns/min in IMR 90 and 0.36 +/- 0.16 microns/min in MC7 3T3 cells. In neither case was there any correlation between the rate of actin movement and the rate of lamellipodial protrusion. The half-life of the activated CR-actin filaments was approximately 1 min in IMR 90 lamellipodia, and approximately 3 min in MC7 3T3 lamellipodia. Thus continuous filament turnover accompanies centripetal movement. In both cell types, the length of time required for a section of the actin meshwork to traverse the lamellipodium was several times longer than the filament half-life. The dynamic behavior of the dorsal surface of the cell was also observed by tracking lectin-coated beads on the surface and phase-dense features within lamellipodia of MC7 3T3 cells. The movement of these dorsal features occurred at rates approximately three times faster than the rate of movement of the underlying bulk actin cytoskeleton, even when measured in the same individual cells. Thus the transport of these dorsal features must occur by some mechanism other than simple attachment to the moving bulk actin cytoskeleton. PMID:1400580

  17. Analysis of AFM cantilever dynamics close to sample surface

    NASA Astrophysics Data System (ADS)

    Habibnejad Korayem, A.; Habibnejad Korayem, Moharam; Ghaderi, Reza

    2013-07-01

    For imaging and manipulation of biological specimens application of atomic force microscopy (AFM) in liquid is necessary. In this paper, tapping-mode AFM cantilever dynamics in liquid close to sample surface is modeled and simulated by well defining the contact forces. The effect of cantilever tilting angle has been accounted carefully. Contact forces have some differences in liquid in comparison to air or vacuum in magnitude or formulation. Hydrodynamic forces are also applied on the cantilever due to the motion in liquid. A continuous beam model is used with its first mode and forward-time simulation method for simulation of its hybrid dynamics and the frequency response and amplitude versus separation diagrams are extracted. The simulation results show a good agreement with experimental results. The resonance frequency in liquid is so small in comparison to air due to additional mass and also additional damping due to the viscosity of the liquid around. The results show that the effect of separation on free vibration amplitude is great. Its effect on resonance frequency is considerable too.

  18. Medium optimization for the production of cyclic adenosine 3',5'-monophosphate by Microbacterium sp. no. 205 using response surface methodology.

    PubMed

    Chen, Xiao-Chun; Bai, Jian-Xin; Cao, Jia-Ming; Li, Zhen-Jiang; Xiong, Jian; Zhang, Lei; Hong, Yuan; Ying, Han-Jie

    2009-01-01

    Response surface methodology was employed to optimize medium composition for the production of cyclic adenosine 3',5'-monophosphate (cAMP) with Microbacterium sp. no. 205. A fractional factorial design (2(11-7)) was applied to evaluate the effects of different components in the medium. K(2)HPO(4), MgSO(4) and NaF were found to significantly influence on the cAMP production. The steepest ascent method was used to access the optimal region of the medium composition. The concentrations of the three factors were optimized subsequently using central composite design and response surface methodology. The optimal medium composition to achieve the optimal cAMP production was determined (g/L): K(2)HPO(4), 12.78; MgSO(4), 3.53 and NaF, 0.18. The corresponding cAMP concentration was 8.50 g/L, which was about 1.8-fold increase compared with that using the original medium. Validation experiments were also carried out to prove the adequacy and the accuracy of the model obtained. The cAMP fermentation in 5L fermenter reached 9.87 g/L. PMID:18778935

  19. 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.

  20. Surface-Induced Dissociation of Peptide Ions: Kinetics and Dynamics

    SciTech Connect

    Laskin, Julia; Futrell, Jean H.; Shukla, Anil K.

    2003-12-01

    Kinetics and dynamics studies have been carried out for the surface-induced dissociation (SID) of a set of model peptides utilizing a specially designed electrospray ionization Fourier Transform ion cyclotron resonance mass spectrometer in which mass-selected and vibrationally relaxed ions are collided on a orthogonally-mounted fluorinated self-assembled monolayer on Au{l_brace}111{r_brace} crystal. The sampling time in this apparatus can be varied from hundreds of microseconds to tens of seconds, enabling the investigation of kinetics of ion decomposition over an extended range of decomposition rates. RRKM-based modeling of these reactions for a set of polyalanines demonstrates that SID kinetics of these simple peptides is very similar to slow, multiple-collision activation and that the distribution of internal energies following collisional activation is indistinguishable from a thermal distribution. For more complex peptides comprised of several amino acids and with internal degrees of freedom ( DOF) of the order of 350 there is a dramatic change in kinetics in which RRKM kinetics is no longer capable of describing the decomposition of these complex ions. A combination of RRKM kinetics and the sudden death approximation, according to which decomposition occurs instantaneously, is a satisfactory description. This implies that a population of ions-which is dependant on the nature of the peptide, kinetic energy and sampling time-decomposes on or very near the surface. The shattering transition is described quantitatively for the limited set of molecules examined to date

  1. Surface-Induced Dissociation of Peptide Ions: Kinetics and Dynamics

    SciTech Connect

    Laskin, Julia; Futrell, Jean H.

    2003-12-01

    Kinetics and dynamics studies have been carried out for the surface-induced dissociation (SID) of a set of model peptides utilizing a specially designed electro spray ionization Fourier Transform Ion cyclotron resonance mass spectrometer in which mass-selected and vibrationally relaxed ions are collided on an orthogonally-mounted fluorinated self-assembled monolayer on Au {111} crystal. The sampling time in this apparatus can be varied from hundreds of microseconds to tens of seconds, enabling the investigation of kinetics of ion decomposition over an extended range of decomposition rates. RRKM-based modeling of these reactions for a set of polyalanines demonstrates that kinetics of these simple peptides is very similar to slow, multiple-collision activation and that the distribution of internal energies following collisional activation is indistinguishable from a thermal distribution. For more complex peptides comprised of several amino acids and with internal degrees of freedom (DOF) of the order of 350 there is a dramatic change in kinetics in which RRKM kinetics is no longer capable of describing the decomposition of these complex ions. A combination of RRKM kinetics and the “sudden death” approximation, according to which decomposition occurs instantaneously, is a satisfactory description. This implies that a population of ions – which is dependant on the nature of the peptide, kinetic energy and sampling time – decomposes on or very near the surface. The shattering transition is described quantitatively for the limited set of molecules examined to date.

  2. Surface hopping investigation of benzophenone excited state dynamics.

    PubMed

    Favero, Lucilla; Granucci, Giovanni; Persico, Maurizio

    2016-04-21

    We present a simulation of the photodynamics of benzophenone for the first 20 ps after n →π* excitation, performed by trajectory surface hopping calculations with on-the-fly semiempirical determination of potential energy surfaces and electronic wavefunctions. Both the dynamic and spin-orbit couplings are taken into account, and time-resolved fluorescence emission is also simulated. The computed decay time of the S1 state is in agreement with experimental observations. The direct S1→ T1 intersystem crossing (ISC) accounts for about 2/3 of the S1 decay rate. The remaining 1/3 goes through T2 or higher triplets. The nonadiabatic transitions within the triplet manifold are much faster than ISC and keep the population of T1 at about 3/4 of the total triplet population, and that of the other states (mainly T2) at 1/4. Two internal coordinates are vibrationally active immediately after n →π* excitation: one is the C[double bond, length as m-dash]O stretching and the other one is a combination of the conrotatory torsion of phenyl rings and of bending involving the carbonyl C atom. The period of the torsion-bending mode coincides with oscillations in the time-resolved photoelectron spectra of Spighi et al. and substantially confirms their assignment. PMID:27031566

  3. Ocean surface winds drive dynamics of transoceanic aerial movements.

    PubMed

    Felicísimo, Angel M; Muñoz, Jesús; González-Solis, Jacob

    2008-01-01

    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. PMID:18698354

  4. Applications of granular-dynamics numerical simulations to asteroid surfaces

    NASA Astrophysics Data System (ADS)

    Richardson, D. C.; Michel, P.; Schwartz, S. R.; Yu, Y.; Ballouz, R.-L.; Matsumura, S.

    2014-07-01

    Spacecraft images and indirect observations including thermal inertia measurements indicate most small bodies have surface regolith. Evidence of granular flow is also apparent in the images. This material motion occurs in very low gravity, therefore in a totally different gravitational environment than on the Earth. Upcoming sample-return missions to small bodies, and possible future manned missions, will involve interaction with the surface regolith, so it is important to develop tools to predict the surface response. We have added new capabilities to the N-body gravity tree code pkdgrav [1,2] that permit the simulation of granular dynamics, including multi-contact physics and friction forces, using the soft-sphere discrete-element method [3]. The numerical approach has been validated through comparison with laboratory experiments (e.g., [3,4]). (1) We carried out impacts into granular materials using different projectile shapes under Earth's gravity [5] and compared the results to laboratory experiments [6] in support of JAXA's Hayabusa 2 asteroid sample-return mission. We tested different projectile shapes and confirmed that the 90-degree cone was the most efficient at excavating mass when impacting 5-mm-diameter glass beads. Results are sensitive to the normal coefficient of restitution and the coefficient of static friction. Preliminary experiments in micro-gravity for similar impact conditions show both the amount of ejected mass and the timescale of the impact process increase, as expected. (2) It has been found (e.g., [7,8]) that ''fresh'' (unreddened) Q-class asteroids have a high probability of recent planetary encounters (˜1 Myr; also see [9]), suggesting that surface refreshening may have occurred due to tidal effects. As an application of the potential effect of tidal interactions, we carried out simulations of Apophis' predicted 2029 encounter with the Earth to see whether regolith motion might occur, using a range of plausible material parameters

  5. 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.

  6. 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.

  7. Model system for studies of microbial dynamics at exuding surfaces such as the rhizosphere

    NASA Technical Reports Server (NTRS)

    Odham, G.; Tunlid, A.; Valeur, A.; Sundin, P.; White, D. C.

    1986-01-01

    An autoclavable all-glass system for studying microbial dynamics at permeable surfaces is described. Standard hydrophobic or hydrophilic membranes (46-mm diameter) of various pore sizes were supported on a glass frit through which nutrient solutions were pumped by a peristaltic pump. The pump provided a precisely controlled flow at speeds of 0.5 to 500 ml of defined or natural cell exudates per h, which passed through the membrane into a receiving vessel. The construction allowed a choice of membranes, which could be modified. The system was tested with a bacterium, isolated from rape plant roots (Brassica napus L.), that was inoculated on a hydrophilic membrane filter and allowed to develop into a biofilm. A defined medium with a composition resembling that of natural rape root exudate was pumped through the membrane at 0.5 ml/h. Scanning electron microscopic examinations indicated that the inoculum formed microcolonies embedded in exopolymers evenly distributed over the membrane surface. The lipid composition and content of poly-beta-hydroxybutyrate in free-living and adhered cells were determined by gas chromatography. The bacterial consumption of amino acids in the exudate was also studied.

  8. Model system for studies of microbial dynamics at exuding surfaces such as the rhizosphere.

    PubMed Central

    Odham, G; Tunlid, A; Valeur, A; Sundin, P; White, D C

    1986-01-01

    An autoclavable all-glass system for studying microbial dynamics at permeable surfaces is described. Standard hydrophobic or hydrophilic membranes (46-mm diameter) of various pore sizes were supported on a glass frit through which nutrient solutions were pumped by a peristaltic pump. The pump provided a precisely controlled flow at speeds of 0.5 to 500 ml of defined or natural cell exudates per h, which passed through the membrane into a receiving vessel. The construction allowed a choice of membranes, which could be modified. The system was tested with a bacterium, isolated from rape plant roots (Brassica napus L.), that was inoculated on a hydrophilic membrane filter and allowed to develop into a biofilm. A defined medium with a composition resembling that of natural rape root exudate was pumped through the membrane at 0.5 ml/h. Scanning electron microscopic examinations indicated that the inoculum formed microcolonies embedded in exopolymers evenly distributed over the membrane surface. The lipid composition and content of poly-beta-hydroxybutyrate in free-living and adhered cells were determined by gas chromatography. The bacterial consumption of amino acids in the exudate was also studied. Images PMID:11536565

  9. Critical insight into the influence of the potential energy surface on fission dynamics

    SciTech Connect

    Mazurek, K.

    2011-07-15

    The present work is dedicated to a careful investigation of the influence of the potential energy surface on the fission process. The time evolution of nuclei at high excitation energy and angular momentum is studied by means of three-dimensional Langevin calculations performed for two different parametrizations of the macroscopic potential: the Finite Range Liquid Drop Model (FRLDM) and the Lublin-Strasbourg Drop (LSD) prescription. Depending on the mass of the system, the topology of the potential throughout the deformation space of interest in fission is observed to noticeably differ within these two approaches, due to the treatment of curvature effects. When utilized in the dynamical calculation as the driving potential, the FRLDM and LSD models yield similar results in the heavy-mass region, whereas the predictions can be strongly dependent on the Potential Energy Surface (PES) for medium-mass nuclei. In particular, the mass, charge, and total kinetic energy distributions of the fission fragments are found to be narrower with the LSD prescription. The influence of critical model parameters on our findings is carefully investigated. The present study sheds light on the experimental conditions and signatures well suited for constraining the parametrization of the macroscopic potential. Its implication regarding the interpretation of available experimental data is briefly discussed.

  10. WRF-simulated sensitivity to land surface schemes in short and medium ranges for a high-temperature event in East China: A comparative study

    NASA Astrophysics Data System (ADS)

    Zeng, Xin-Min; Wang, Ning; Wang, Yang; Zheng, Yiqun; Zhou, Zugang; Wang, Guiling; Chen, Chaohui; Liu, Huaqiang

    2015-09-01

    We designed simulations for the high-temperature event that occurred on 23 July 2003 in East China using a series of forecast lead times, from short-range to medium-range, and four land surface schemes (LSSs) (i.e., SLAB, NOAH, RUC, and PX) in the Weather Research and Forecasting Model (WRF), Version 3. The sensitivities of short and medium-range simulations to the LSSs systematically varied with the lead times. In general, the model reproduced short-range, high-temperature distributions. The simulated weather was sensitive to the LSSs, and the LSS-induced sensitivity was higher in the medium range than in the short-range. Furthermore, the LSS performances were complex, i.e., the PX errors apparently increased in the medium range (longer than 6 days), RUC produced the maximum errors, and SLAB and NOAH had approximately equivalent errors that slightly increased. Additional sensitivity simulations revealed that the WRF modeling system assigns relatively low initial soil moisture for RUC and that soil moisture initialization plays an important role that is comparable to the LSS choice in the simulations. LSS-induced negative feedback between surface air temperature (SAT) and atmospheric circulation in the lower atmosphere was found in the medium range. These sensitivities were mainly caused by the LSS-induced differences in surface sensible heat flux and by errors associated with the lead times. Using the SAT equation, further diagnostic analyses revealed LSS deficiencies in simulating surface fluxes and physical processes that modify the SAT and indicated the main reasons for these deficiencies. These results have implications for model improvement and application.

  11. Transient nonlinear optically-thick radiative-convective double-diffusive boundary layers in a Darcian porous medium adjacent to an impulsively started surface: Network simulation solutions

    NASA Astrophysics Data System (ADS)

    Anwar Bég, O.; Zueco, J.; Takhar, H. S.; Bég, T. A.; Sajid, A.

    2009-11-01

    A boundary-layer model is described for the two-dimensional nonlinear transient thermal convection heat and mass transfer in an optically-thick fluid in a Darcian porous medium adjacent to an impulsively started vertical surface, in the presence of significant thermal radiation and buoyancy forces in an (X∗,Y∗,t∗) coordinate system. An algebraic approximation is employed to simplify the integro-differential equation of radiative transfer for unidirectional flux normal to the plate into the boundary-layer regime, by incorporating this flux term in the energy conservation equation. The conservation equations are non-dimensionalized into an (X,Y,T) coordinate system and solved using the Network Simulation Method (NSM), a robust numerical technique which demonstrates high efficiency and accuracy. The transient variation of non-dimensional streamwise velocity component (u) and temperature (T) and concentration (C) functions is computed for various selected values of Stark number (radiation-conduction interaction parameter) and Darcy number. Transient velocity (u) and steady-state local skin friction (τX) are also studied for various thermal Grashof number (Gr), species Grashof number (Gm), Schmidt number (Sc) and Stark number (N) values. These computations for the infinite permeability case (Da → ∞) are compared with previous finite difference solutions [Prasad et al. Int J Therm Sci 2007;46(12):1251-8] and shown to be in excellent agreement. An increase in Darcy number is seen to accelerate the flow and boost velocity. A decrease in Stark number (corresponding to an increase in thermal radiation heat transfer contribution) is shown to increase the velocity values. Temperature function is observed to fall in value with a rise in Da and increase with decrease in N (corresponding to an increase in thermal radiation heat transfer contribution). Applications of the study include rocket combustion chambers, astrophysical flows, spacecraft thermal fluid dynamics in

  12. Optimization of critical medium components using response surface methodology for phenazine-1-carboxylic acid production by Pseudomonas sp. M-18Q.

    PubMed

    Yuan, Li-Li; Li, Ya-Qian; Wang, Yi; Zhang, Xue-Hong; Xu, Yu-Quan

    2008-03-01

    The optimal flask-shaking batch fermentation medium for phenazine-1-carboxylic acid (PCA) production by Pseudomonas sp. M-18Q, a qscR chromosomal inactivated mutant of the strain M18 was studied using statistical experimental design and analysis. The Plackett-Burman design (PBD) was used to evaluate the effects of eight medium components on the production of PCA, which showed that glucose and soytone were the most significant ingredients (P<0.05). The steepest ascent experiment was adopted to determine the optimal region of the medium composition. The optimum composition of the fermentation medium for maximum PCA yield, as determined on the basis of a five-level two-factor central composite design (CCD), was obtained by response surface methodology (RSM). The high correlation between the predicted and observed values indicated the validity of the model. A maximum PCA yield of 1240 mg/l was obtained at 17.81 g/l glucose and 11.47 g/l soytone, and the production was increased by 65.3% compared with that using the original medium, which was at 750 mg/l.

  13. Nonlinear dynamics and breakup of free-surface flows

    SciTech Connect

    Eggers, J.

    1997-07-01

    Surface-tension-driven flows and, in particular, their tendency to decay spontaneously into drops have long fascinated naturalists, the earliest systematic experiments dating back to the beginning of the 19th century. Linear stability theory governs the onset of breakup and was developed by Rayleigh, Plateau, and Maxwell. However, only recently has attention turned to the nonlinear behavior in the vicinity of the singular point where a drop separates. The increased attention is due to a number of recent and increasingly refined experiments, as well as to a host of technological applications, ranging from printing to mixing and fiber spinning. The description of drop separation becomes possible because jet motion turns out to be effectively governed by one-dimensional equations, which still contain most of the richness of the original dynamics. In addition, an attraction for physicists lies in the fact that the separation singularity is governed by universal scaling laws, which constitute an asymptotic solution of the Navier-Stokes equation before and after breakup. The Navier-Stokes equation is thus continued uniquely through the singularity. At high viscosities, a series of noise-driven instabilities has been observed, which are a nested superposition of singularities of the same universal form. At low viscosities, there is rich scaling behavior in addition to aesthetically pleasing breakup patterns driven by capillary waves. The author reviews the theoretical development of this field alongside recent experimental work, and outlines unsolved problems. {copyright} {ital 1997} {ital The American Physical Society}

  14. Optodynamics: dynamic aspects of laser beam-surface interaction

    NASA Astrophysics Data System (ADS)

    Možina, J.; Diaci, J.

    2012-05-01

    This paper presents a synthesis of the results of our original research in the area of laser-material interaction and pulsed laser material processing with a special emphasis on the dynamic aspects of laser beam-surface interaction, which include the links between the laser material removal and the resulting material motion. In view of laser material processing, a laser beam is not only considered as a tool but also as a generator of information about the material transformation. The information is retained and conveyed by different kinds of optically induced mechanical waves. Several generation/detection schemes have been developed to extract this information, especially in the field of non-destructive material evaluation. Blast and acoustic waves, which propagate in the air surrounding the work-piece, have been studied using microphone detection as well as various setups of the laser beam deflection probe. Stress waves propagating through the work-piece have been studied using piezoelectric transducers and laser interferometers.

  15. Exploring the free energy surface using ab initio molecular dynamics.

    PubMed

    Samanta, Amit; Morales, Miguel A; Schwegler, Eric

    2016-04-28

    Efficient exploration of configuration space and identification of metastable structures in condensed phase systems are challenging from both computational and algorithmic perspectives. In this regard, schemes that utilize a set of pre-defined order parameters to sample the relevant parts of the configuration space [L. Maragliano and E. Vanden-Eijnden, Chem. Phys. Lett. 426, 168 (2006); J. B. Abrams and M. E. Tuckerman, J. Phys. Chem. B 112, 15742 (2008)] have proved useful. Here, we demonstrate how these order-parameter aided temperature accelerated sampling schemes can be used within the Born-Oppenheimer and the Car-Parrinello frameworks of ab initio molecular dynamics to efficiently and systematically explore free energy surfaces, and search for metastable states and reaction pathways. We have used these methods to identify the metastable structures and reaction pathways in SiO2 and Ti. In addition, we have used the string method [W. E, W. Ren, and E. Vanden-Eijnden, Phys. Rev. B 66, 052301 (2002); L. Maragliano et al., J. Chem. Phys. 125, 024106 (2006)] within the density functional theory to study the melting pathways in the high pressure cotunnite phase of SiO2 and the hexagonal closed packed to face centered cubic phase transition in Ti. PMID:27131525

  16. The Dynamics of Near-Surface Dust on Airless Bodies

    NASA Astrophysics Data System (ADS)

    Hartzell, Christine M.

    The behavior of dust particles under the influence of electrostatic forces has been investigated near the surface of asteroids and the Moon. Dust particle motion on airless bodies has important implications for our understanding of the evolution of these bodies as well as the design of future exploration vehicles. Electrostatically-dominated dust motion has been hypothesized to cause the observed Lunar Horizon Glow and dust ponds on the asteroid Eros. The first major contribution of this thesis is the identification of the electric field strength required in order to electrostatically loft dust particles off the surface of the Moon and asteroids Eros and Itokawa, taking into account the gravity of the body (assumed to be spherical) and the cohesion between dust grains (assumed to have the material properties of lunar regolith). In order to solve for the electric field strength required as a function of dust particle size (assumed to be spherical), we assumed that the charge on the dust particle was given by Gauss' law. It can be seen that it is easiest to launch intermediate-sized particles, rather than the submicron-micron sized particles that have been previously considered due to the dominance of cohesion for small particle sizes. Additionally, the electric field strength required to loft particles is orders of magnitude larger than is likely to be present in situ, unless grain charging is amplified beyond the levels predicted by Gauss' law. The significance of cohesion in electrostatic dust lofting has also been demonstrated experimentally. Piles of uniformly sized dust grains are placed on a biased conducting plate in a plasma. We see that the pile of 15 micron dust spreads more than piles of 5, 10, 20, and 25 micron dust grains. This observation confirms our theory-based prediction of the importance of cohesion for small grain sizes. The experimental proof presented also has implications for interpretations of horizon glow observations and

  17. Dynamic scaling analysis of two-dimensional cell colony fronts in a gel medium: A biological system approaching a quenched Kardar-Parisi-Zhang universality

    NASA Astrophysics Data System (ADS)

    Huergo, M. A. C.; Muzzio, N. E.; Pasquale, M. A.; González, P. H. Pedro; Bolzán, A. E.; Arvia, A. J.

    2014-08-01

    The interfacial two-dimensional spreading dynamics of quasilinear Vero cell colony fronts in methylcellulose (MC)-containing culture medium, under a constant average front displacement velocity regime, was investigated. Under comparable experimental conditions, the average colony front displacement velocity becomes lower than that reported for a standard culture medium. Initially, the presence of MC in the medium hinders both the colony spreading, due to a gradual change in the average size and shape of cells and their distribution in the colony, and the cell motility in the gelled medium. Furthermore, at longer culture times enlarged cells appear at random in the border region of the colony. These cells behave as obstacles (pinning sites) for the displacement of smaller cells towards the colony front. The dynamic scaling analysis of rough fronts yields the set of exponents α =0.63±0.04,β =0.75±0.05, and z =0.84±0.05, which is close to that expected for a quenched Kardar-Parisi-Zhang model.

  18. STRUCTURAL DYNAMICS OF METAL PARTITIONING TO MINERAL SURFACES

    EPA Science Inventory

    The conceptual understanding of surface complexation reactions that control trace element partitioning to mineral surfaces is limited by the assumption that the solid reactant possesses a finite, time-invariant population of surface functional groups. This assumption has limited...

  19. Validation of a Laboratory Method for Evaluating Dynamic Properties of Reconstructed Equine Racetrack Surfaces

    PubMed Central

    Setterbo, Jacob J.; Chau, Anh; Fyhrie, Patricia B.; Hubbard, Mont; Upadhyaya, Shrini K.; Symons, Jennifer E.; Stover, Susan M.

    2012-01-01

    Background Racetrack surface is a risk factor for racehorse injuries and fatalities. Current research indicates that race surface mechanical properties may be influenced by material composition, moisture content, temperature, and maintenance. Race surface mechanical testing in a controlled laboratory setting would allow for objective evaluation of dynamic properties of surface and factors that affect surface behavior. Objective To develop a method for reconstruction of race surfaces in the laboratory and validate the method by comparison with racetrack measurements of dynamic surface properties. Methods Track-testing device (TTD) impact tests were conducted to simulate equine hoof impact on dirt and synthetic race surfaces; tests were performed both in situ (racetrack) and using laboratory reconstructions of harvested surface materials. Clegg Hammer in situ measurements were used to guide surface reconstruction in the laboratory. Dynamic surface properties were compared between in situ and laboratory settings. Relationships between racetrack TTD and Clegg Hammer measurements were analyzed using stepwise multiple linear regression. Results Most dynamic surface property setting differences (racetrack-laboratory) were small relative to surface material type differences (dirt-synthetic). Clegg Hammer measurements were more strongly correlated with TTD measurements on the synthetic surface than the dirt surface. On the dirt surface, Clegg Hammer decelerations were negatively correlated with TTD forces. Conclusions Laboratory reconstruction of racetrack surfaces guided by Clegg Hammer measurements yielded TTD impact measurements similar to in situ values. The negative correlation between TTD and Clegg Hammer measurements confirms the importance of instrument mass when drawing conclusions from testing results. Lighter impact devices may be less appropriate for assessing dynamic surface properties compared to testing equipment designed to simulate hoof impact (TTD

  20. Thermo-electro-mechanical vibration analysis of size-dependent nanobeam resting on elastic medium under axial preload in presence of surface effect

    NASA Astrophysics Data System (ADS)

    Marzbanrad, Javad; Boreiry, Mahya; Shaghaghi, Gholam Reza

    2016-07-01

    In the present manuscript, a nonclassical beam theory is developed to analyze free vibration of piezoelectric nanobeam by considering surface effects resting on Winkler-Pasternak elastic medium and thermal loading with axial preload. The nonclassical Eringen theory is utilized to incorporate the length-scale parameter to account for the small-scale effect, while the Gurtin-Murdoch model is employed to inject the surface effects including surface elasticity, surface stress and surface density. The governing equations are derived using Hamilton's principle in the framework of Euler-Bernoulli beam theory. The governing partial differential equations of motions of system are reduced to a set of algebraic equations with the help of differential transformation method as a semi-analytical-numerical. The mathematical derivations and numerical results are presented in detail for various boundary conditions. Some numerical examples are illustrated in order to investigate the effect of several parameters such as the nonlocal parameter, piezoelectric voltage, surface effects, temperature change, axial preload and elastic medium parameters. Moreover, it is also indicated that the numerical results have good agreement with previous studies.

  1. Super-resolution restoration applied to the characterisation of dynamic surface changes on the Martian surface

    NASA Astrophysics Data System (ADS)

    Tao, Yu; Muller, Jan-Peter

    2016-10-01

    Higher spatial resolution imaging data is always desirable to the international community of planetary scientists interested in improving understanding of surface formation processes. We have previously developed a novel Super-resolution restoration (SRR) technique using Gotcha sub-pixel matching [Shin & Muller, PR, 2012], orthorectification, segmentation, and 4th order PDE-TV, called GPT SRR [Tao & Muller, PSS, 2016]. This technique is able to restore 5cm-12.5cm near rover scale images (Navcam at a range of ≥5m) from multi-angle repeat-pass 25cm resolution MRO HiRISE images [Tao & Muller, ISPRS, 2016].We have successfully applied the GPT-SRR to the MER and MSL missions (http://www.progisweb.eu), as well as the alleged site of the Beagle-2 spacecraft (https://www.flickr.com/photos/uclnews/albums/72157667609698345). In this work, we further apply GPT-SRR on areas with known dynamic changes, including Recurring Slope Lineae (RSL), Gullies, and Polar Dune Flows. We restore static surface and meanwhile track the dynamic features to characterise the "change", including directions and speed of the changes. We also demonstrate that such repeat images can be used to image the MER-A rover stuck in the sands.AcknowledgementsThe research leading to these results has received funding from the European Union's Seventh Framework Programme (FP7/2007-2013) under iMars grant agreement no. 607379 as well as partial funding from the STFC "MSSL Consolidated Grant" ST/K000977/1.

  2. Bacterial Community Dynamics During the Application of a Myxococcus xanthus-Inoculated Culture Medium Used for Consolidation of Ornamental Limestone

    PubMed Central

    Jimenez-Lopez, Concepcion; Sterflinger, Katja; Ettenauer, Jörg; Jroundi, Fadwa; Fernandez-Vivas, Antonia; Gonzalez-Muñoz, Maria Teresa

    2010-01-01

    In this study, we investigated under laboratory conditions the bacterial communities inhabiting quarry and decayed ornamental carbonate stones before and after the application of a Myxococcus xanthus-inoculated culture medium used for consolidation of the stones. The dynamics of the community structure and the prevalence of the inoculated bacterium, M. xanthus, were monitored during the time course of the consolidation treatment (30 days). For this purpose, we selected a molecular strategy combining fingerprinting by denaturing gradient gel electrophoresis (DGGE) with the screening of eubacterial 16S rDNA clone libraries by DGGE and sequencing. Quantification of the inoculated strain was performed by quantitative real-time PCR (qPCR) using M. xanthus-specific primers designed in this work. Results derived from DGGE and sequencing analysis showed that, irrespective of the origin of the stone, the same carbonatogenic microorganisms were activated by the application of a M. xanthus culture. Those microorganisms were Pseudomonas sp., Bacillus sp., and Brevibacillus sp. The monitoring of M. xanthus in the culture media of treated stones during the time course experiment showed disparate results depending on the applied technique. By culture-dependent methods, the detection of this bacterium was only possible in the first day of the treatment, showing the limitation of these conventional techniques. By PCR-DGGE analysis, M. xanthus was detected during the first 3–6 days of the experiment. At this time, the population of this bacterium in the culture media varied between 108–106 cells ml−1, as showed by qPCR analyses. Thereafter, DGGE analyses showed to be not suitable for the detection of M. xanthus in a mixed culture. Nevertheless, qPCR analysis using specific primers for M. xanthus showed to be a more sensitive technique for the detection of this bacterium, revealing a population of 104 cells ml−1 in the culture media of both treated stones at the end of

  3. Nonequilibrium Molecular Dynamics Simulations of Organic Friction Modifiers Adsorbed on Iron Oxide Surfaces.

    PubMed

    Ewen, James P; Gattinoni, Chiara; Morgan, Neal; Spikes, Hugh A; Dini, Daniele

    2016-05-10

    For the successful development and application of lubricants, a full understanding of the nanoscale behavior of complex tribological systems is required, but this is difficult to obtain experimentally. In this study, we use nonequilibrium molecular dynamics (NEMD) simulations to examine the atomistic structure and friction properties of commercially relevant organic friction modifier (OFM) monolayers adsorbed on iron oxide surfaces and lubricated by a thin, separating layer of hexadecane. Specifically, acid, amide, and glyceride OFMs, with saturated and Z-unsaturated hydrocarbon tail groups, are simulated at various surface coverages and sliding velocities. At low and medium coverage, the OFMs form liquidlike and amorphous monolayers, respectively, which are significantly interdigitated with the hexadecane lubricant, resulting in relatively high friction coefficients. At high coverage, solidlike monolayers are formed for all of the OFMs, which, during sliding, results in slip planes between well-defined OFM and hexadecane layers, yielding a marked reduction in the friction coefficient. When present at equal surface coverage, OFMs with saturated and Z-unsaturated tail groups are found to yield similar structure and friction behavior. OFMs with glyceride head groups yield significantly lower friction coefficients than amide and particularly carboxylic acid head groups. For all of the OFMs and coverages simulated, the friction coefficient is found to increase linearly with the logarithm of sliding velocity; however, the gradient of this increase depends on the coverage. The structure and friction details obtained from these simulations agree well with experimental results and also shed light on the relative tribological performance of these OFMs through nanoscale structural variations. This has important implications in terms of the applicability of NEMD to aid the development of new formulations to control friction.

  4. Actinobacillus succinogenes ATCC 55618 Fermentation Medium Optimization for the Production of Succinic Acid by Response Surface Methodology

    PubMed Central

    Zhu, Li-Wen; Wang, Cheng-Cheng; Liu, Rui-Sang; Li, Hong-Mei; Wan, Duan-Ji; Tang, Ya-Jie

    2012-01-01

    As a potential intermediary feedstock, succinic acid takes an important place in bulk chemical productions. For the first time, a method combining Plackett-Burman design (PBD), steepest ascent method (SA), and Box-Behnken design (BBD) was developed to optimize Actinobacillus succinogenes ATCC 55618 fermentation medium. First, glucose, yeast extract, and MgCO3 were identified to be key medium components by PBD. Second, preliminary optimization was run by SA method to access the optimal region of the key medium components. Finally, the responses, that is, the production of succinic acid, were optimized simultaneously by using BBD, and the optimal concentration was located to be 84.6 g L−1 of glucose, 14.5 g L−1 of yeast extract, and 64.7 g L−1 of MgCO3. Verification experiment indicated that the maximal succinic acid production of 52.7 ± 0.8 g L−1 was obtained under the identified optimal conditions. The result agreed with the predicted value well. Compared with that of the basic medium, the production of succinic acid and yield of succinic acid against glucose were enhanced by 67.3% and 111.1%, respectively. The results obtained in this study may be useful for the industrial commercial production of succinic acid. PMID:23093852

  5. Dynamics of groundwater-surface water interactions in urban streams

    NASA Astrophysics Data System (ADS)

    Musolff, A.; Schmidt, C.; Fleckenstein, J. H.

    2010-12-01

    In industrialized countries the majority of streams and rivers have been subject to changes in the hydrological regime and alteration of the channel morphology. Urban streams are typically characterized by “flashier” hydrographs as a result of more direct runoff from impervious surfaces. Channel structure and complexity are often impaired compared to pristine streams. As a consequence the potential for bedform-driven water flow in the streambed is reduced. The downward transport of oxygen by advective flow in the streambed is known to be of great ecological importance for the hyporheic macro and micro fauna and facilitates nutrient cycling and the degradation of organic pollutants. We studied the dynamics of groundwater-surface water exchange of two anthropogenically impacted streams in urban areas to examine the effects of variable hydrologic boundary conditions on water flux and redox conditions in the streambed. The first stream is fed by groundwater as well as storm-water from a large industrial area. Here, we monitored the variability of vertical hydraulic gradients, streambed temperature and redox conditions in the streambed over the course of 5 months. The second stream is frequently polluted by combined sewer overflows (CSO) from an urban watershed. Here, we measured the vertical hydraulic gradients, streambed temperature and electrical conductivity (EC) in the stream, the streambed and in the adjacent aquifer. Both streams are characterized by strong variations in hydraulic gradients due to the dynamic hydrographs as well as the variations in total head in the shallow aquifer. Therefore, magnitude and direction of water flux through the streambed changed significantly over time. At the first site long-term variations of redox conditions in the shallow streambed (0.1 m) were related to the direction of water fluxes. Downward water flow resulted in increased redox potentials. However, the high short-term variability of redox conditions could not be

  6. Simulation of the interaction of electromagnetic waves with dispersed particles in the propagation of breather in the surface layer of a liquid medium

    SciTech Connect

    Zabolotin, V.V.; Uvarova, L.A.

    2015-03-10

    A numerical simulation of the interaction of laser radiation with dispersed particles in the course of propagation of breather in the surface layer of the liquid breather was performed. The shape and amplitude of the acoustic signal formed in this interaction were obtained. Two acoustic signals, before and after the impact of a breather on the process of optical sound generation, were compared. Results of the comparison showed that the breather spreading over the surface of the liquid medium affecst the acoustic signal and its effect must be considered in the measurements.

  7. Molecular dynamics-based triangulation algorithm of free-form parametric surfaces for computer-aided engineering

    NASA Astrophysics Data System (ADS)

    Zheleznyakova, A. L.

    2015-05-01

    A new computational approach for automated triangulation of Computer-Aided Design (CAD) surface models, applicable to various CFD (Computational Fluid Dynamics) problems of practical interest is proposed. The complex shaped product configurations are represented by a set of Non-Uniform Rational B-Splines (NURBS) surface patches. The suggested technique is based on the molecular dynamics method. The main idea of the approach is that the mesh nodes are considered as similarly charged interacting particles which move within the region to be meshed under the influence of internal (such as particle-particle interaction forces) and external forces as well as optional additional forces. Moreover, the particles experience a medium resistance due to which the system comes to equilibrium within a relatively short period of time. The proposed 3D surface mesh generation algorithm uses a parametric NURBS representation as initial definition of the domain boundary. This method first distributes the interacting nodes into optimal locations in the parametric domain of the NURBS surface patch using molecular dynamics simulation. Then, the well-shaped triangles can be created after connecting the nodes by Delaunay triangulation. Finally, the mapping from parametric space to 3D physical space is performed. Since the presented interactive algorithm allows to control the distance between a pair of nodes depending on the curvature of the NURBS surface, the method generates high quality triangular mesh. The algorithm enables to produce uniform mesh, as well as anisotropic adaptive mesh with refinement in the large gradient regions. The mesh generation approach has the abilities to preserve the representation accuracy of the input geometry model, create a close relationship between geometry modeling and grid generation process, be automated to a large degree. Some examples are considered in order to illustrate the method's ability to generate a surface mesh for a complicated CAD model.

  8. Application of response surface methodology in the optimisation of a growth medium for enhanced natural preservative bacteriocin production by a probiotic bacterium.

    PubMed

    Kanmani, Paulraj; Kumar, R Satish; Yuvaraj, N; Paari, K A; Pattukumar, V; Arul, Venkatesan

    2012-01-01

    In this study, a statistics-based experimental design was utilised for the optimisation of a growth medium which possibly enhanced bacteriocin production by Streptococcus phocae PI80. Carbon, nitrogen sources and a bio-surfactant were first screened using a one variable at a time technique and scored for increasing yield production. The selected variables were further statistically optimised using response surface methodology with a central composite design. The high- and low-level limits of the selected variables were determined, and a set of 34 experimental runs were performed. The concentration of each medium ingredient influenced the bacteriocin activity to about 22,500 AU mL⁻¹. The carbon and nitrogen sources were identified as significant factors in restraining the bacteriocin activity produced by S. phocae PI80. The statistics-based experimental design was found to be very efficient in optimising the media components in a number of experimental runs, with a three-fold increase in bacteriocin activity compared to the un-optimised medium. The optimum medium composition was found to be sodium succinate (10.0 g L⁻¹), yeast extract (4.0 g L⁻¹), glucose (9.0 g L⁻¹), NaCl (10.0 g L⁻¹), Tween 80 (6.0 g L⁻¹) and K₂HPO₄ (1.0 g L⁻¹). This optimised medium is two-fold more cost effective than the commercial Lactobacillus MRS medium.

  9. Microscopic Receding Contact Line Dynamics on Pillar and Irregular Superhydrophobic Surfaces

    PubMed Central

    Yeong, Yong Han; Milionis, Athanasios; Loth, Eric; Bayer, Ilker S.

    2015-01-01

    Receding angles have been shown to have great significance when designing a superhydrophobic surface for applications involving self-cleaning. Although apparent receding angles under dynamic conditions have been well studied, the microscopic receding contact line dynamics are not well understood. Therefore, experiments were performed to measure these dynamics on textured square pillar and irregular superhydrophobic surfaces at micron length scales and at micro-second temporal scales. Results revealed a consistent “slide-snap” motion of the microscopic receding line as compared to the “stick-slip” dynamics reported in previous studies. Interface angles between 40–60° were measured for the pre-snap receding lines on all pillar surfaces. Similar “slide-snap” dynamics were also observed on an irregular nanocomposite surface. However, the sharper features of the surface asperities resulted in a higher pre-snap receding line interface angle (~90°). PMID:25670630

  10. 2011 Dynamics at Surfaces Gordon Research Conference (August 7-12, 2011, Salve Regina University, Newport, Rhode Island)

    SciTech Connect

    Greg Sitz

    2011-08-12

    The 2011 Gordon Conference on Dynamics at Surfaces is the 32nd 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 scattering dynamics, chemical reaction dynamics, non-adiabatic effects in reactive and inelastic scattering of molecules from surfaces, single molecule dynamics at surfaces, surface photochemistry, ultrafast dynamics at surfaces, and dynamics at water interfaces. The conference brings together investigators from a variety of scientific disciplines including chemistry, physics, materials science, geology, biophysics, and astronomy.

  11. Optimization of the medium composition for production of mycelial biomass and exo-polymer by Grifola frondosa GF9801 using response surface methodology.

    PubMed

    Cui, F J; Li, Y; Xu, Z H; Xu, H Y; Sun, K; Tao, W Y

    2006-07-01

    In this work, a three-level Box-Behnken factorial design was employed combining with response surface methodology (RSM) to optimize the medium composition for the production of the mycelial biomass and exo-polymer in submerged cultures by Grifola frondosa GF9801. A mathematical model was then developed to show the effect of each medium composition and their interactions on the production of mycelial biomass and exo-polymer. The model estimated that, a maximal yield of mycelial biomass (17.61 g/l) could be obtained when the concentrations of glucose, KH2PO4, peptone were set at 45.2 g/l, 2.97 g/l, 6.58 g/l, respectively; while a maximal exo-polymer yield (1.326 g/l) could be achieved when setting concentrations of glucose, KH2PO4, peptone at 58.6 g/l, 4.06 g/l and 3.79 g/l, respectively. These predicted values were also verified by validation experiments. Compared with the values obtained by other runs in the experimental design, the optimized medium resulted in a significant increase in the yields of mycelial biomass and exo-polymer. Maximum mycelial biomass yield of 22.50 g/l was achieved in a 15-l fermenter using the optimized medium. PMID:15990290

  12. Medium Optimization for the Production of Fibrinolytic Enzyme by Paenibacillus sp. IND8 Using Response Surface Methodology

    PubMed Central

    Prakash Vincent, Samuel Gnana

    2014-01-01

    Production of fibrinolytic enzyme by a newly isolated Paenibacillus sp. IND8 was optimized using wheat bran in solid state fermentation. A 25 full factorial design (first-order model) was applied to elucidate the key factors as moisture, pH, sucrose, yeast extract, and sodium dihydrogen phosphate. Statistical analysis of the results has shown that moisture, sucrose, and sodium dihydrogen phosphate have the most significant effects on fibrinolytic enzymes production (P < 0.05). Central composite design (CCD) was used to determine the optimal concentrations of these three components and the experimental results were fitted with a second-order polynomial model at 95% level (P < 0.05). Overall, 4.5-fold increase in fibrinolytic enzyme production was achieved in the optimized medium as compared with the unoptimized medium. PMID:24523635

  13. Optimization of nutrients for gellan gum production by Sphingomonas paucimobilis ATCC-31461 in molasses based medium using response surface methodology.

    PubMed

    Banik, R M; Santhiagu, A; Upadhyay, S N

    2007-03-01

    A molasses based medium for the production of gellan by Sphingomonas paucimobilis ATCC-31461 was developed. Placket-Burman design criterion was applied to study the effect of various nutrient supplements on gellan production using molasses. Among the 20 variables tested, molasses, tryptone, casaminoacid, disodium hydrogen orthophosphate and manganese chloride showed significant effect on gellan production. A central composite design was applied to determine the optimum concentrations of the significant variables obtained from Placket-Burman design. Most suitable medium composition for production of gellan was (g/l): molasses-112.5; tryptone-1; casaminoacid-1; disodium hydrogen orthophosphate-1; manganese chloride-0.947 and the optimum gellan production was 13.814 g/l.

  14. Single switch surface hopping for molecular dynamics with transitions

    NASA Astrophysics Data System (ADS)

    Fermanian Kammerer, Clotilde; Lasser, Caroline

    2008-04-01

    A trajectory surface hopping algorithm is proposed, which stems from a mathematically rigorous analysis of propagation through conical intersections of potential energy surfaces. Since nonadiabatic transitions are only performed when a classical trajectory attains one of its local minimal surface gaps, the algorithm is called single switch surface hopping. Numerical experiments for a two mode Jahn-Teller system are presented, which illustrate the asymptotic justification of the method as well as its good performance in the physically relevant parameter range.

  15. Mapping Carrier Dynamics on Material Surfaces in Space and Time using Scanning Ultrafast Electron Microscopy.

    PubMed

    Sun, Jingya; Adhikari, Aniruddha; Shaheen, Basamat S; Yang, Haoze; Mohammed, Omar F

    2016-03-17

    Selectively capturing the ultrafast dynamics of charge carriers on materials surfaces and at interfaces is crucial to the design of solar cells and optoelectronic devices. Despite extensive research efforts over the past few decades, information and understanding about surface-dynamical processes, including carrier trapping and recombination remains extremely limited. A key challenge is to selectively map such dynamic processes, a capability that is hitherto impractical by time-resolved laser techniques, which are limited by the laser's relatively large penetration depth and consequently these techniques record mainly bulk information. Such surface dynamics can only be mapped in real space and time by applying four-dimensional (4D) scanning ultrafast electron microscopy (S-UEM), which records snapshots of materials surfaces with nanometer spatial and subpicosecond temporal resolutions. In this method, the secondary electron (SE) signal emitted from the sample's surface is extremely sensitive to the surface dynamics and is detected in real time. In several unique applications, we spatially and temporally visualize the SE energy gain and loss, the charge carrier dynamics on the surface of InGaN nanowires and CdSe single crystal and its powder film. We also discuss the mechanisms for the observed dynamics, which will be the foundation for future potential applications of S-UEM to a wide range of studies on material surfaces and device interfaces.

  16. Segmental dynamics simulation of the deformation for polymer adhesive between surfaces

    SciTech Connect

    Lee, K.; Adams, J.B.

    1996-12-31

    The deformation of polymer adhesives between surfaces is investigated using the authors Segmental Dynamics Model. A simple tensile test is simulated by placing an equilibrated polymer adhesive film between two surfaces. The equilibrium structure and dynamics of the adhesive deformation are investigated. The density of anchor segments ({rho}) and the bond strength of the anchor segment to the surface ({phi}) were varied to determine the effects on deformation.

  17. Measurement of the surface effect of a small scattering object in a highly scattering medium by use of diffuse photon-pairs density wave

    NASA Astrophysics Data System (ADS)

    Wu, Jheng-Syong; Yu, Li-Ping; Chou, Chien

    2016-06-01

    The surface effect close to the boundary of a small light-scattering object in a highly scattering medium is experimentally demonstrated. This is the first attempt to measure the surface effect of a small spherical scattering object in 1% intralipid solution by use of developed diffuse photon-pairs density wave (DPPDW) in terms of the amplitude and phase detection. Theoretically, the surface effect of a small scattering object in turbid media is localized close to the boundary according to the perturbation theory, concerning an inhomogeneous distribution of the diffusion coefficient in the frequency-domain diffusion equation. Hence, an improvement of the spatial resolution of the image via an inverse algorithm, which relates to detection sensitivity of localization to the boundary of the image object in a multiple scattering medium, is anticipated. In this study, we demonstrate that DPPDW is able to sense the surface effect of a 2-mm spherical scattering object in 1% intralipid solution, with high sensitivity. Subsequently, an improvement of spatial resolution of imaging in turbid media by using DPPDW in comparison with conventional diffuse photon density wave (DPDW) using inverse algorithm is discussed.

  18. Surface pump-probe femtosecond-laser mass spectrometry: Time-, mass-, and velocity-resolved detection of surface reaction dynamics

    SciTech Connect

    Vaida, Mihai E.; Bernhardt, Thorsten M.

    2010-10-15

    A detailed account of the experimental methodology of surface pump-probe femtosecond-laser mass spectrometry is presented. This recently introduced technique enables the direct time-resolved investigation of surface reaction dynamics by monitoring the mass and the relative velocity of intermediates and products of a photoinduced surface reaction via multiphoton ionization. As a model system, the photodissociation dynamics of methyl iodide adsorbed at submonolayer coverage on magnesia ultrathin films is investigated. The magnesia surface preparation and characterization as well as the pulsed deposition of methyl iodide are described. The femtosecond-laser excitation (pump) and, in particular, the resonant multiphoton ionization surface detection (probe) schemas are discussed in detail. Results of pump-probe time-resolved methyl and iodine atom detection experiments are presented and the potential of this method for velocity-resolved photofragment analysis is evaluated.

  19. The Short- to Medium-Term Predictive Accuracy of Static and Dynamic Risk Assessment Measures in a Secure Forensic Hospital

    ERIC Educational Resources Information Center

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

    2013-01-01

    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…

  20. Use of activated carbon as a support medium for H2S biofiltration and effect of bacterial immobilization on available pore surface.

    PubMed

    Ng, Y L; Yan, R; Chen, X G; Geng, A L; Gould, W D; Liang, D T; Koe, L C C

    2004-12-01

    The use of support media for the immobilization of microorganisms is widely known to provide a surface for microbial growth and a shelter that protects the microorganisms from inhibitory compounds. In this study, activated carbon is used as a support medium for the immobilization of microorganisms enriched from municipal sewage activated sludge to remove gas-phase hydrogen sulfide (H2S), a major odorous component of waste gas from sewage treatment plants. A series of designed experiments is used to examine the effect on bacteria-immobilized activated carbon (termed "biocarbon") due to physical adsorption, chemical reaction, and microbial degradation in the overall removal of H2S. H2S breakthrough tests are conducted with various samples, including microbe-immobilized carbon and Teflon discs, salts-medium-washed carbon, and ultra-pure water-washed carbon. The results show a higher removal capacity for the microbe-immobilized activated carbon compared with the activated carbon control in a batch biofilter column. The increase in removal capacity is attributed to the role played by the immobilized microorganisms in metabolizing adsorbed sulfur and sulfur compounds on the biocarbon, hence releasing the adsorption sites for further H2S uptake. The advantage for activated carbon serving as the support medium is to adsorb a high initial concentration of substrate and progressively release this for microbial degradation, hence acting as a buffer for the microorganisms. Results obtained from surface area and pore size distribution analyses of the biocarbon show a correlation between the available surface area and pore volume with the extent of microbial immobilization and H2S uptake. The depletion of surface area and pore volume is seen as one of the factors which cause the onset of column breakthrough. Microbial growth retardation is due to the accumulation of metabolic products (i.e., sulfuric acid); and a lack of water and nutrient salts in the batch biofilter are other

  1. Aggregation behavior of sodium dioctylsulfosuccinate in aqueous ethylene glycol medium. A case of hydrogen bonding between surfactant and solvent and its manifestation in the surface tension isotherm.

    PubMed

    Das, D; Dey, J; Chandra, A K; Thapa, U; Ismail, K

    2012-11-13

    The dependence of critical micelle concentration (cmc) of sodium dioctylsulfosuccinate (AOT) on the amount of ethylene glycol (EG) in water + EG medium was reported to be unusual and different from that of other surfactants to the extent that the cmc of AOT in EG is lower than in water. It is yet to be understood why AOT behaves so in water + EG medium, although AOT is known to have some special properties. Hence in the present study cmc of AOT in water + EG medium in the range from 0 to 100% (by weight) EG is measured by using surface tension and fluorescence emission methods. In contrast to what was reported, this study revealed that with respect to EG amount the cmc of AOT follows the general trend and AOT has higher cmc in EG than in water. On the other hand, it was surprisingly found that a break in the surface tension isotherm occurs in the premicellar region when the amount of EG exceeds 50% rendering a bisigmoidal shape to the surface tension isotherm. UV spectral study showed that AOT and EG undergo hydrogen bonding in the premicellar region when the EG amount is ≥50% and this hydrogen bonding becomes less on adding NaCl. The density functional theory calculations also showed formation of hydrogen bonds between EG and AOT through the sulfonate group of AOT providing thereby support to the experimental findings. The calculations predicted a highly stable AOT-EG-H(2)O trimer complex with a binding energy of -37.93 kcal mol(-1). The present system is an example, which is first of its kind, of a case where hydrogen bonding with surfactant and solvent molecules results in a surface tension break.

  2. Mathematical Analysis of Hall Effect on Transient Hartman Flow about a Rotating Horizontal Permeable Surface in a Porous Medium under Inclined Magnetic Field.

    PubMed

    Suresh, M; Manglik, A

    2014-01-01

    This paper proposes the exact solution for unsteady flow of a viscous incompressible electrically conducting fluid past a impulsively started infinite horizontal surface which is rotating with an angular velocity embedded in a saturated porous medium under the influence of strong magnetic field with hall effect. Our study focuses on the change of direction of the external magnetic field on the flow system which leads to change in the flow behavior and skin frictional forces at the boundary. Systems of flow equations are solved using Laplace transform technique. The impacts of control parameters Hartman number, rotation of the system, hall effect, inclination of the magnetic field, and Darcy number on primary and secondary velocities are shown graphically, skin friction at horizontal boundary in tabular form. For validating our results, in the absence of permeability of the porous medium and inclination of the magnetic field the results are in good agreement with the published results.

  3. The shape, stability and dynamics of elastic surfaces

    NASA Astrophysics Data System (ADS)

    Mahadevan, L.

    2008-03-01

    Bending a thin sheet is easier than stretching it, an observation which has its roots in geometry. We will use this fact to explain some unusual problems in biology, physics and geology. At the everyday scale, I will discuss the morphology of avascular algal blades, the dynamics of defects in an elastic ribbon, and the dynamics of prey capture by certain carnivorous plants. At the geological scale, I will try to explain the shape of island arcs on our planet. Finally, time permitting, I will discuss how we might extend these ideas to the macromolecular scale, to derive a mechanical model for the dynamic instability of a growing microtubule.

  4. Electrostatic charge-charge and dipole-dipole interactions near the surface of a medium with screening non-locality (Review Article)

    NASA Astrophysics Data System (ADS)

    Gabovich, Alexander M.; Voitenko, Alexander I.

    2016-08-01

    Interaction energy between two point charges, WQQ', or two point dipoles, WPP', located in a medium with a constant dielectric permittivity near the plane surface of a metallic or semiconducting substrate with the spatial dispersion of its dielectric function has been revisited. The calculations were made on the basis of the Green's function method for layered systems. Long-range lateral asymptotics were found. The non-local character of screening in the substrates was shown to substantially modify the dependences of WQQ' and WPP' on the distance between the objects concerned. Thus, the purported conventional electrostatic interactions between adsorbed atoms and molecules (modeled by point charges and point dipoles) should be reconsidered making allowance for the substrate polarization. In particular, this factor may significantly influence the structure of electrostatic dipole lattices arising near the surfaces of solids, as well as the kinetics of charge or dipole motion over the surface.

  5. Dynamics of changes in the colored form of spiroantrooxazine incorporated into polytetrafluoroethylene F-42 in a supercritical carbon dioxide medium

    NASA Astrophysics Data System (ADS)

    Kopylov, A. S.; Glagolev, N. N.; Timashev, P. S.; Cherkasova, A. V.; Timashev, S. F.; Solov'eva, A. B.

    2015-09-01

    It is shown that the incorporation of spiroantrooxazine (SAO), which has pronounced photochromic properties, into polytetrafluoroethylene F-42 in supercritical carbon dioxide medium leads to the formation of metastable colored photochromic states of different structure. In the subsequent relaxation of the polymer-SAO system, these states give rise to the most thermodynamically stable isomeric form of SAO for the given system. The kinetics of these reactions is analyzed in supercritical CO2 medium and after placing the test sample in air upon the formation of the unstable colored form of the photochromic molecule in the polymeric matrix. It is noted that in these cases, comparison of the rate constants of relaxation transitions allows us to numerically assess how the matrix plasticization by carbon dioxide affects the formation of photochromic colored states and the relaxation reorganization of the photochromic metastable forms.

  6. Sub-10 ns single-shot dynamic recording in holographic polymeric medium by nonlinear absorption using excited state absorption process

    NASA Astrophysics Data System (ADS)

    Kamada, Kenji; Satoh, Kazuyuki; Tanaka, Yoshito

    2016-09-01

    Optical recording by a single shot of an 8 ns laser pulse in a dye-doped holographic polymeric medium was demonstrated with a peak power as low as 71 W at a wavelength of 402 nm. Nonlinear absorption triggered by two-photon absorption and enhanced by the succeeding process allows high-speed recording corresponding to 125 Mbps (3.4 times the recording speed of a Blu-ray Disc). The preformed holographic grating in the medium enhanced the readout signal through diffraction, resulting in a signal-to-noise ratio of about 15 dB. The recording capacity was estimated at ca. 80 GB/side for 100 µm/side by recording 20 layers, but that of over TB/side class would be possible for optical optimization. Theoretically, it can be improved to 10 TB/side for 800 µm/side by recording 400 layers.

  7. Dynamics of Charged Dust Near Surfaces in Space

    NASA Astrophysics Data System (ADS)

    Colwell, Joshua; Horanyi, Mihaly; Sickafoose, Amanda; Robertson, Scott

    2002-11-01

    Objects in plasma, such as planetary bodies in the solar wind, charge to a floating potential determined by the balance between charging currents in the local plasma environment. In cases where secondary electron emission and photoemission are weak, objects will become negatively charged due to electron collection and will be surrounded by a plasma sheath. Solar ultraviolet radiation can produce a photoelectron sheath above the sunlit surface of airless planetary bodies. In both cases an electric field is present near the surface that can accelerate charged dust particles near the surface. Dust may be stably levitated if the electric force balances the gravitational force. Experiments in a plasma sheath have shown that particles can be stably levitated with surface potentials consistent with those expected on planetary surfaces. Our experiments have also shown that particles can be lifted off the surface by the electric field without any additional disturbance. This may explain the separation of dust from the surfaces of larger particles in Saturn's rings observed as 'spokes' by local plasma presumably generated by an impact. Observations of smooth deposits of regolith in crater bottoms on the asteroid 433 Eros by the NEAR spacecraft suggest a transport mechanism for regolith. Levitation of charged dust and transport in an inhomogeneous electric field is a possible explanation for the distribution of regolith on Eros and other asteroids. More generally, acceleration of charged dust in the near-surface sheath can lead to loss of fine-grained particles from objects with weak gravitational accelerations. We have carried out experiments on charging, levitation, and transport of dust in plasma and photoelectron sheaths. A tungsten filament beneath the surface plate creates the primary electrons that ionize gas in the chamber. When the surface is biased to a sufficiently high voltage (-40V to -80V), dust particles are lifted off the surface. Some of these particles

  8. Dynamics of DNA Chains on Flat and Patterned Surfaces

    NASA Astrophysics Data System (ADS)

    Li, Bingquan; Xiaohua, Fang; Seo, Young-Soo; Samuilov, Vladimir; Rafailovich, Miriam; Sokolov, Jonathan

    2003-03-01

    The electrophoresis of DNA chains on flat silicon and patterned surfaces was studied by Confocal Fluorescence Microscopy and Atomic Force Microscopy. Solutions of lambda DNA of 48,502 bp and Schizosaccharomyces pombe (S. pombe) of 3 6 Mb were deposited on different surfaces. The surfaces were chemically modified to be hydrophilic or SAM-covered and the patterns were produced over length scales from nano to micro size in the form of gratings or square arrays. The interaction with the surface and mobility of DNA chains depended on the surface chemistry, topography and ion concentration of buffer. The motion of individual chains in the electric field was analyzed both in terms of the dimensions and orientation of the pattern structure. Supported by NSF-MRSEC program (DMR-9632525)

  9. Coupling surface and mantle dynamics: A novel experimental approach

    NASA Astrophysics Data System (ADS)

    Kiraly, Agnes; Faccenna, Claudio; Funiciello, Francesca; Sembroni, Andrea

    2015-05-01

    Recent modeling shows that surface processes, such as erosion and deposition, may drive the deformation of the Earth's surface, interfering with deeper crustal and mantle signals. To investigate the coupling between the surface and deep process, we designed a three-dimensional laboratory apparatus, to analyze the role of erosion and sedimentation, triggered by deep mantle instability. The setup is constituted and scaled down to natural gravity field using a thin viscous sheet model, with mantle and lithosphere simulated by Newtonian viscous glucose syrup and silicon putty, respectively. The surface process is simulated assuming a simple erosion law producing the downhill flow of a thin viscous material away from high topography. The deep mantle upwelling is triggered by the rise of a buoyant sphere. The results of these models along with the parametric analysis show how surface processes influence uplift velocity and topography signals.

  10. Applying Parallel Adaptive Methods with GeoFEST/PYRAMID to Simulate Earth Surface Crustal Dynamics

    NASA Technical Reports Server (NTRS)

    Norton, Charles D.; Lyzenga, Greg; Parker, Jay; Glasscoe, Margaret; Donnellan, Andrea; Li, Peggy

    2006-01-01

    This viewgraph presentation reviews the use Adaptive Mesh Refinement (AMR) in simulating the Crustal Dynamics of Earth's Surface. AMR simultaneously improves solution quality, time to solution, and computer memory requirements when compared to generating/running on a globally fine mesh. The use of AMR in simulating the dynamics of the Earth's Surface is spurred by future proposed NASA missions, such as InSAR for Earth surface deformation and other measurements. These missions will require support for large-scale adaptive numerical methods using AMR to model observations. AMR was chosen because it has been successful in computation fluid dynamics for predictive simulation of complex flows around complex structures.

  11. Dynamics of Phenanthrenequinone on Carbon Nano-Onion Surfaces Probed by Quasielastic Neutron Scattering

    SciTech Connect

    Anjos, Daniela M; Mamontov, Eugene; Brown, Gilbert M; Overbury, Steven {Steve} H; Mavila Chathoth, Suresh

    2012-01-01

    We used quasielastic neutron scattering (QENS) to study the dynamics of phenanthrenequinone (PQ) on the surface of onion-like carbon (OLC), or so called carbon onions, as a function of surface coverage and temperature. For both the high- and low-coverage samples, we observed two diffusion processes; a faster process and nearly an order of magnitude slower process. On the high-coverage surface, the slow diffusion process is of long-range translational character, whereas the fast diffusion process is spatially localized on the length scale of ~ 4.7 . On the low-coverage surface, both diffusion processes are spatially localized; on the same length scale of ~ 4.7 for the fast diffusion and a somewhat larger length scale for the slow diffusion. Arrhenius temperature dependence is observed except for the long-range diffusion on the high-coverage surface. We attribute the fast diffusion process to the generic localized in-cage dynamics of PQ molecules, and the slow diffusion process to the long-range translational dynamics of PQ molecules, which, depending on the coverage, may be either spatially restricted, or long-range. On the low-coverage surface, uniform surface coverage is not attained, and the PQ molecules experience the effect of spatial constraints on their long-range translational dynamics. Unexpectedly, the dynamics of PQ molecules on OLC as a function of temperature and surface coverage bears qualitative resemblance to the dynamics of water molecules on oxide surfaces, including practically temperature-independent residence times for the low-coverage surface. The dynamics features that we observed may be universal across different classes of surface adsorbates.

  12. Influence of surface oxidation on ion dynamics and capacitance in porous and nonporous carbon electrodes

    DOE PAGES

    Dyatkin, Boris; Zhang, Yu; Mamontov, Eugene; Kolesnikov, Alexander I.; Cheng, Yongqiang; Meyer, III, Harry M.; Cummings, Peter T.; Gogotsi, Yury G.

    2016-04-07

    Here, we investigate the influence of surface chemistry and ion confinement on capacitance and electrosorption dynamics of room-temperature ionic liquids (RTILs) in supercapacitors. Using air oxidation and vacuum annealing, we produced defunctionalized and oxygen-rich surfaces of carbide-derived carbons (CDCs) and graphene nanoplatelets (GNPs). While oxidized surfaces of porous CDCs improve capacitance and rate handling abilities of ions, defunctionalized nonporous GNPs improve charge storage densities on planar electrodes. Quasi-elastic neutron scattering (QENS) and inelastic neutron scattering (INS) probed the structure, dynamics, and orientation of RTIL ions confined in divergently functionalized pores. Oxidized, ionophilic surfaces draw ions closer to pore surfaces andmore » enhance potential-driven ion transport during electrosorption. Molecular dynamics (MD) simulations corroborated experimental data and demonstrated the significance of surface functional groups on ion orientations, accumulation densities, and capacitance.« less

  13. Structure and Dynamics of the Au(111) Surface in an Electrochemical Enviroment

    NASA Astrophysics Data System (ADS)

    Collini, John; Liu, Yihua; McDonough, Bryanne; Pierce, Michael; You, Hoydoo; Komanicky, Vladimir; Barbour, Andi

    The Au(111) surface possesses a well-known herringbone surface reconstruction pattern. However, the character of the reconstruction's response to external variables is not completely understood due to the limited amount of kinetics and dynamics studies of the surface in different environments. Here, we present in-situ x-ray scattering measurements from the Advanced Photon Source at Argonne National Laboratory of the Au(111) surface in a controllable electrochemical environment of weak NaF solution. Crystal truncation rod (CTR) measurements were taken to examine how the average surface properties and overall structure change with cell voltage. X-ray photon correlation spectroscopy (XPCS) measurements were also taken to examine how the dynamics of the surface change with voltage. The relation between applied potential, average kinetics, and microstate dynamics will be discussed. Funding provided by Research Corporation for Science Advancement. Work done at the Advanced Photon Source supported by the U.S. Department of Energy.

  14. Droplet-surface Impingement Dynamics for Intelligent Spray Design

    NASA Technical Reports Server (NTRS)

    VanderWal, Randy L.; Kizito, John P.; Tryggvason, Gretar; Berger, Gordon M.; Mozes, Steven D.

    2004-01-01

    Spray cooling has high potential in thermal management and life support systems by overcoming the deleterious effect of microgravity upon two-phase heat transfer. In particular spray cooling offers several advantages in heat flux removal that include the following: 1. By maintaining a wetted surface, spray droplets impinge upon a thin fluid film rather than a dry solid surface 2. Most heat transfer surfaces will not be smooth but rough. Roughness can enhance conductive cooling, aid liquid removal by flow channeling. 3. Spray momentum can be used to a) substitute for gravity delivering fluid to the surface, b) prevent local dryout and potential thermal runaway and c) facilitate liquid and vapor removal. Yet high momentum results in high We and Re numbers characterizing the individual spray droplets. Beyond an impingement threshold, droplets splash rather than spread. Heat flux declines and spray cooling efficiency can markedly decrease. Accordingly we are investigating droplet impingement upon a) dry solid surfaces, b) fluid films, c) rough surfaces and determining splashing thresholds and relationships for both dry surfaces and those covered by fluid films. We are presently developing engineering correlations delineating the boundary between splashing and non-splashing regions.

  15. Effect of low-concentration rhamnolipid on transport of Pseudomonas aeruginosa ATCC 9027 in an ideal porous medium with hydrophilic or hydrophobic surfaces.

    PubMed

    Zhong, Hua; Liu, Guansheng; Jiang, Yongbing; Brusseau, Mark L; Liu, Zhifeng; Liu, Yang; Zeng, Guangming

    2016-03-01

    The success of effective bioaugmentation processes for remediation of soil and groundwater contamination requires effective transport of the injected microorganisms in the subsurface environment. In this study, the effect of low concentrations of monorhamnolipid biosurfactant solutions on transport of Pseudomonas aeruginosa in an ideal porous medium (glass beads) with hydrophilic or hydrophobic surfaces was investigated by conducting miscible-displacement experiments. Transport behavior was examined for both glucose-grown and hexadecane-grown cells, with low and high surface hydrophobicity, respectively. A clean-bed colloid deposition model was used for determination of deposition rate coefficients. Results show that cells with high surface hydrophobicity exhibit greater retention than cells with low surface hydrophobicity. Rhamnolipid affects cell transport primarily by changing cell surface hydrophobicity, with an additional minor effect by increasing solution ionic strength. There is a good linear relation between k and rhamnolipid-regulated cell surface hydrophobicity presented as bacterial-adhesion-to-hydrocarbon (BATH) rate of cells (R(2)=0.71). The results of this study show the importance of hydrophobic interaction for transport of bacterial cells in silica-based porous media, and the potential of using low-concentration rhamnolipid solutions for facilitating bacterial transport in bioaugmentation efforts. PMID:26722821

  16. Effect of low-concentration rhamnolipid on transport of Pseudomonas aeruginosa ATCC 9027 in an ideal porous medium with hydrophilic or hydrophobic surfaces.

    PubMed

    Zhong, Hua; Liu, Guansheng; Jiang, Yongbing; Brusseau, Mark L; Liu, Zhifeng; Liu, Yang; Zeng, Guangming

    2016-03-01

    The success of effective bioaugmentation processes for remediation of soil and groundwater contamination requires effective transport of the injected microorganisms in the subsurface environment. In this study, the effect of low concentrations of monorhamnolipid biosurfactant solutions on transport of Pseudomonas aeruginosa in an ideal porous medium (glass beads) with hydrophilic or hydrophobic surfaces was investigated by conducting miscible-displacement experiments. Transport behavior was examined for both glucose-grown and hexadecane-grown cells, with low and high surface hydrophobicity, respectively. A clean-bed colloid deposition model was used for determination of deposition rate coefficients. Results show that cells with high surface hydrophobicity exhibit greater retention than cells with low surface hydrophobicity. Rhamnolipid affects cell transport primarily by changing cell surface hydrophobicity, with an additional minor effect by increasing solution ionic strength. There is a good linear relation between k and rhamnolipid-regulated cell surface hydrophobicity presented as bacterial-adhesion-to-hydrocarbon (BATH) rate of cells (R(2)=0.71). The results of this study show the importance of hydrophobic interaction for transport of bacterial cells in silica-based porous media, and the potential of using low-concentration rhamnolipid solutions for facilitating bacterial transport in bioaugmentation efforts.

  17. Wetting and Interfacial Tension Dynamics of Oil-Nanofluids-Surface Minerals System

    NASA Astrophysics Data System (ADS)

    Bai, L.; Li, C.; Darnault, C. J. G.; Korte, C.; Ladner, D.; Daigle, H.

    2015-12-01

    Among the techniques used in enhanced oil recovery (EOR), chemical injection involves the injection of surfactants to increase the oil mobility and decrease the interfacial tension (IFT). With the nanotechnology revolution, the use of nanoparticles has shown unique opportunities in petroleum engineering due to their physico-chemical properties. Our research examines the potential application of nanoparticles as a means of EOR by studying the influence of silicon oxide nanoparticles on the wettability and IFT of oil-nanofluids-surface systems. Batch studies were conducted to assess the stability of the nanoparticle suspensions of different concentrations (0, 0.001, 0.005, 0.01, 0.05 and 0.1 wt. %) in different reservoir conditions with and without the addition of surfactants (i.e. 5% brine, and Tween 20 at 0.5 and 2 cmc). Testing of oil-nanofluids and oil-nanofluids-minerals interactions was performed using crude oils from West Texas (light, API 40), Prudhoe Bay (medium, API 28), and Lloydminster (heavy, API 20). The dynamic behavior of IFT was measured using a pendant drop method. Results for 5% brine-nanoparticle systems indicated that 0.001 and 0.01 wt.% of nanoparticles contributed to a significant decrease of IFT for West Texas and Prudhoe Bay oils, while the highest decrease of IFT for Lloydminster was reported with 0.1 wt.% nanoparticles. IFT decrease was also enhanced by surfactant, and the addition of nanoparticles at 0.001 wt.% to surfactant resulted in significant decrease of IFT in most of the tested oil-nanofluid systems. The sessile drop method was used to measure the dynamic behavior of the contact angle of these oil droplets on minerals surface made of thin sections from Berea and Boise sandstone cores through a wetting test. Different nanofluid and surfactant concentrations were tested for the optimization of changes in wettability, which is a critical phase in assessing the behavior of nanofluids for optimal EOR with the selected crude oils.

  18. Mixed Functionality Semiconductor Surfaces: Formation, Characterization, Interfacial Dynamics, and Applications

    NASA Astrophysics Data System (ADS)

    O'Leary, Leslie Esther

    The properties of any semiconductor device rely on the charge separation characteristics at interfaces within that device. The charge separation characteristics include relative energetics, interfacial electronic states, and the presence or absence of insulating layers. More importantly, the interfacial properties determine the maximum solar conversion efficiency for a photoelectrochemical or photovoltaic device. Solution-based halogenation/alkylation chemistry was used to functionalize Si surfaces. The chemistry was adapted to allow for the controlled formation of multicomponent molecular monolayers. Functional molecules were incorporated by the mixed monolayer approach, and lowered densities of surface electronic defect states and increased resistance toward the formation of deleterious Si oxides were observed. Heck coupoling reactions were developed at thiophene-containing monolayers. Thiophene terminated Si(111) surfaces had defect frequencies of > 1 defect per 1,000 surface atoms, too large for solar energy conversion applications, while multicomponent CH3/thiophene monolayers had defect densities of < 1 per 500,000 surface atoms. Robust secondary chemistry at Si(111) with facile charge transfer to covalently linked molecules with preservation of surface electronic properties was shown for the first time. Molecular adsorbates with interesting electronic dipoles, such as bromothiophene, were incorporated into mixed monolayers. The electron distribution across the surface dipole caused a shift in the work function of Si by > 600 mV. The fundamental mechanism of Wf shift was elucidated by a combined ab initio and experimental study, and the dependence of Si band-edge positions on pH was relieved using Si-C bonds. Designer surface chemistry was used to covalently link Si microwires within a flexible PDMS matrix, and a direct correlation between the surface bonding mechanism and interfacial adhesion strength was unambiguously observed. The formation and electronic

  19. Adsorption-Induced Surface Stresses of the Water/Quartz Interface: Ab Initio Molecular Dynamics Study.

    PubMed

    Gor, Gennady Y; Bernstein, Noam

    2016-05-31

    Adsorption-induced deformation is expansion or contraction of a solid due to adsorption on its surface. This phenomenon is important for a wide range of applications, from chemomechanical sensors to methane recovery from geological formations. The strain of the solid is driven by the change of the surface stress due to adsorption. Using ab initio molecular dynamics, we calculate the surface stresses for the dry α-quartz surfaces, and investigate how these stresses change when the surfaces are exposed to water. We find that the nonhydroxylated surface shows small and approximately isotropic changes in stress, while the hydroxylated surface, which interacts more strongly with the polar water molecules, shows larger and qualitatively anisotropic (opposite sign in xx and yy) surface stress changes. All of these changes are several times larger than the surface tension of water itself. The anisotropy and possibility of positive surface stress change can explain experimentally observed surface area contraction due to adsorption.

  20. In situ atomic scale visualization of surface kinetics driven dynamics of oxide growth on a Ni-Cr surface.

    PubMed

    Luo, Langli; Zou, Lianfeng; Schreiber, Daniel K; Olszta, Matthew J; Baer, Donald R; Bruemmer, Stephen M; Zhou, Guangwen; Wang, Chong-Min

    2016-02-25

    We report the in situ atomic-scale visualization of the dynamic three-dimensional growth of NiO during the initial oxidation of Ni-10at%Cr using environmental transmission electron microscopy. A step-by-step adatom growth mechanism in 3D is observed and a change in the surface planes of growing oxide islands can be induced by local surface kinetic variations. PMID:26815841

  1. Motions caused by the growth of Bacillus subtilis macrofibres in fluid medium result in new forms of movement of the multicellular structures over solid surfaces.

    PubMed

    Mendelson, N H; Sarlls, J E; Thwaites, J J

    2001-04-01

    Bacillus subtilis macrofibres, highly ordered multicellular structures, undergo twisting and writhing motions when they grow in fluid medium as a result of forces generated by the elongation of individual cells. Macrofibres are denser than the fluid medium in which they are cultured, consequently they settle to the bottom of the growth chamber and grow in contact with it. The ramifications of growth on plastic and glass surfaces were examined. Macrofibres were observed to rotate about a vertical axis near the centre of their length in a chiral-specific direction. Right-handed fibres rotated clockwise on plastic surfaces at approximately 4 degrees min(-1), left-handed structures of lower twist rotate anti-clockwise at about half that rate. Very large ball structures produced late in macrofibre formation perched on many small protruding fibres but rotated only when driven by large fibres attached to their periphery. Closer examination showed that fibres made contact with surfaces at only a few points along their length (between 1 and 6 on glass). The regions in contact with the surface changed periodically as a result of rotation of the fibre shaft caused by growth. Every time the weight of a fibre transferred from one contact point to another, each section of the fibre took a small step approximately proportional to its distance from the fibre mid-point. The net result was a rolling of each section over the surface so that the fibre rotation about a vertical axis was produced. Macrofibres also took large steps when part of the structure rose off the floor, swept through an arc in the fluid and then returned to the floor at a new location. The rate of movement during a large step, measured as the change of angle between the moving and stationary portions of the fibre, was 5 degrees s(-1). These observations reveal that the forces derived from helical growth that lead to macrofibre formation also cause characteristic macrofibre motion that differs from classical

  2. Dynamic Moon: New Impacts and Contemporary Surface Changes

    NASA Astrophysics Data System (ADS)

    Speyerer, E. J.; Povilaitis, R. Z.; Robinson, M. S.; Thomas, P. C.; Wagner, R. V.

    2016-05-01

    Before and after image pairs acquired by the Lunar Reconnaissance Orbiter Camera enable the identification of new impact craters and secondary surface changes revealing new insight into the cratering process and regolith gardening.

  3. Droplet-Surface Impingement Dynamics for Intelligent Spray Design

    NASA Technical Reports Server (NTRS)

    Wal, Randy L. Vander; Kizito, John P.; Tryggvason, Gretar

    2004-01-01

    Spray cooling has high potential in thermal management and life support systems by overcoming the deleterious effect of microgravity upon two-phase heat transfer. In particular spray cooling offers several advantages in heat flux removal that include the following: 1) By maintaining a wetted surface, spray droplets impinge upon a thin fluid film rather than a dry solid surface; 2. Most heat transfer surfaces will not be smooth but rough. Roughness can enhance conductive cooling, aid liquid removal by flow channeling; and 3. Spray momentum can be used to a) substitute for gravity delivering fluid to the surface, b) prevent local dryout and potential thermal runaway and c) facilitate liquid and vapor removal. Yet high momentum results in high We and Re numbers characterizing the individual spray droplets. Beyond an impingement threshold, droplets splash rather than spread. Heat flux declines and spray cooling efficiency can markedly decrease. Accordingly we are investigating droplet impingement upon a) dry solid surfaces, b) fluid films, c) rough surfaces and determining splashing thresholds and relationships for both dry surfaces and those covered by fluid films. We are presently developing engineering correlations delineating the boundary between splashing and non-splashing regions. Determining the splash/non-splash boundary is important for many practical applications. Coating and cooling processes would each benefit from near-term empirical relations and subsequent models. Such demonstrations can guide theoretical development by providing definitive testing of its predictive capabilities. Thus, empirical relations describing the boundary between splash and non-splash are given for drops impinging upon a dry solid surface and upon a thin fluid film covering a similar surface. Analytical simplification of the power laws describing the boundary between the splash and non-splash regions yields insight into the engineering parameters governing the splash and non

  4. Oscillon dynamics and rogue wave generation in Faraday surface ripples.

    PubMed

    Xia, H; Maimbourg, T; Punzmann, H; Shats, M

    2012-09-14

    We report new experimental results which suggest that the generation of extreme wave events in the Faraday surface ripples is related to the increase in the horizontal mobility of oscillating solitons (oscillons). The analysis of the oscillon trajectories in a horizontal plane shows that at higher vertical acceleration, oscillons move chaotically, merge and form enclosed areas on the water surface. The probability of the formation of such craters, which precede large wave events, increases with the increase in horizontal mobility. PMID:23005636

  5. Dynamic superhydrophobic behavior in scalable random textured polymeric surfaces

    NASA Astrophysics Data System (ADS)

    Moreira, David; Park, Sung-hoon; Lee, Sangeui; Verma, Neil; Bandaru, Prabhakar R.

    2016-03-01

    Superhydrophobic (SH) surfaces, created from hydrophobic materials with micro- or nano- roughness, trap air pockets in the interstices of the roughness, leading, in fluid flow conditions, to shear-free regions with finite interfacial fluid velocity and reduced resistance to flow. Significant attention has been given to SH conditions on ordered, periodic surfaces. However, in practical terms, random surfaces are more applicable due to their relative ease of fabrication. We investigate SH behavior on a novel durable polymeric rough surface created through a scalable roll-coating process with varying micro-scale roughness through velocity and pressure drop measurements. We introduce a new method to construct the velocity profile over SH surfaces with significant roughness in microchannels. Slip length was measured as a function of differing roughness and interstitial air conditions, with roughness and air fraction parameters obtained through direct visualization. The slip length was matched to scaling laws with good agreement. Roughness at high air fractions led to a reduced pressure drop and higher velocities, demonstrating the effectiveness of the considered surface in terms of reduced resistance to flow. We conclude that the observed air fraction under flow conditions is the primary factor determining the response in fluid flow. Such behavior correlated well with the hydrophobic or superhydrophobic response, indicating significant potential for practical use in enhancing fluid flow efficiency.

  6. Electrically modulated dynamic spreading of drops on soft surfaces

    NASA Astrophysics Data System (ADS)

    Dey, Ranabir; Daga, Ashish; DasGupta, Sunando; Chakraborty, Suman

    2015-07-01

    The intricate interaction between the deformability of a substrate and the dynamic spreading of a liquid drop on the same, under the application of an electrical voltage, has remained far from being well understood. Here, we demonstrate that electrospreading dynamics on soft substrates is dictated by the combined interplay of electrocapillarity, the wetting line friction, and the viscoelastic energy dissipation at the contact line. Our results reveal that during such electro-elastocapillarity mediated spreading of a sessile drop, the contact radius evolution exhibits a universal power-law in a substrate elasticity based non-dimensional time, with an electrical voltage dependent spreading exponent. Simultaneously, the macroscopic dynamic contact angle variation follows a general power-law in the contact line velocity, normalized by elasticity dependent characteristic velocity scale. These findings will be beneficial for comprehending droplet spreading dynamics stemming from the combination of electrically modulated spreading and "soft wetting." Hence, our results are likely to provide the foundation for the development of a plethora of applications involving droplet manipulations by exploiting the interplay between electrically triggered spreading and substrate-compliance over interfacial scales.

  7. INTRODUCTION: Surface Dynamics, Phonons, Adsorbate Vibrations and Diffusion

    NASA Astrophysics Data System (ADS)

    Bruch, L. W.

    2004-07-01

    understanding of the underlying factors determining the optical quality of GaInNAs, such as composition, growth and annealing conditions. We are still far from establishing an understanding of the band structure and its dependence on composition. Fundamental electronic interactions such as electron-electron and electron-phonon scattering, dependence of effective mass on composition, strain and orientation, quantum confinement effects, effects of localized nitrogen states on high field transport and on galvanometric properties, and mechanisms for light emission in these materials, are yet to be fully understood. Nature and formation mechanisms of grown-in and processing-induced defects that are important for material quality and device performance are still unknown. Such knowledge is required in order to design strategies to efficiently control and eliminate harmful defects. For many potential applications (such as solar cells, HBTs) it is essential to get more information on the transport properties of dilute nitride materials. The mobility of minority carriers is known to be low in GaInNAs and related material. The experimental values are far from reaching the theoretical ones, due to defects and impurities introduced in the material during the growth. The role of the material inhomogeneities on the lateral carrier transport also needs further investigation. From the device's point of view most attention to date has been focused on the GaInNAs/GaAs system, mainly because of its potential for optoelectronic devices covering the 1.3-1.55 µm data and telecommunications wavelength bands. As is now widely appreciated, these GaAs-compatible structures allow monolithic integration of AlGaAs-based distributed Bragg reflector mirrors (DBRs) for vertical cavity surface-emitting lasers with low temperature sensitivity and compatibility with AlOx-based confinement techniques. In terms of conventional edge-emitting lasers (EELs), the next step is to extend the wavelength range for cw room

  8. Degradation of the electrospun silica nanofiber in a biological medium for primary hippocampal neuron – effect of surface modification

    PubMed Central

    Feng, Z Vivian; Chen, Wen Shuo; Keratithamkul, Khomson; Stoick, Michael; Kapala, Brittany; Johnson, Eryn; Huang, An-Chi; Chin, Ting Yu; Chen-Yang, Yui Whei; Yang, Mong-Lin

    2016-01-01

    In this work, silica nanofibers (SNFs) were prepared by an electrospinning method and modified with poly-d-lysine (PDL) or (3-aminopropyl) trimethoxysilane (APTS) making biocompatible and degradable substrates for neuronal growth. The as-prepared SNF, modified SNF-PDL, and SNF-APTS were evaluated using scanning electron microscopy, nitrogen adsorption/desorption isotherms, contact angle measurements, and inductively coupled plasma atomic emission spectroscopy. Herein, the scanning electron microscopic images revealed that dissolution occurred in a corrosion-like manner by enlarging porous structures, which led to loss of structural integrity. In addition, covalently modified SNF-APTS with more hydrophobic surfaces and smaller surface areas resulted in significantly slower dissolution compared to SNF and physically modified SNF-PDL, revealing that different surface modifications can be used to tune the dissolution rate. Growth of primary hippocampal neuron on all substrates led to a slower dissolution rate. The three-dimensional SNF with larger surface area and higher surface density of the amino group promoted better cell attachment and resulted in an increased neurite density. This is the first known work addressing the degradability of SNF substrate in physiological conditions with neuron growth in vitro, suggesting a strong potential for the applications of the material in controlled drug release. PMID:27013873

  9. Degradation of the electrospun silica nanofiber in a biological medium for primary hippocampal neuron - effect of surface modification.

    PubMed

    Feng, Z Vivian; Chen, Wen Shuo; Keratithamkul, Khomson; Stoick, Michael; Kapala, Brittany; Johnson, Eryn; Huang, An-Chi; Chin, Ting Yu; Chen-Yang, Yui Whei; Yang, Mong-Lin

    2016-01-01

    In this work, silica nanofibers (SNFs) were prepared by an electrospinning method and modified with poly-d-lysine (PDL) or (3-aminopropyl) trimethoxysilane (APTS) making biocompatible and degradable substrates for neuronal growth. The as-prepared SNF, modified SNF-PDL, and SNF-APTS were evaluated using scanning electron microscopy, nitrogen adsorption/desorption isotherms, contact angle measurements, and inductively coupled plasma atomic emission spectroscopy. Herein, the scanning electron microscopic images revealed that dissolution occurred in a corrosion-like manner by enlarging porous structures, which led to loss of structural integrity. In addition, covalently modified SNF-APTS with more hydrophobic surfaces and smaller surface areas resulted in significantly slower dissolution compared to SNF and physically modified SNF-PDL, revealing that different surface modifications can be used to tune the dissolution rate. Growth of primary hippocampal neuron on all substrates led to a slower dissolution rate. The three-dimensional SNF with larger surface area and higher surface density of the amino group promoted better cell attachment and resulted in an increased neurite density. This is the first known work addressing the degradability of SNF substrate in physiological conditions with neuron growth in vitro, suggesting a strong potential for the applications of the material in controlled drug release. PMID:27013873

  10. Nitrogen dynamics at the groundwater-surface water interface of a degraded urban stream (journal)

    EPA Science Inventory

    Urbanization degrades stream ecosystems by altering hydrology and nutrient dynamics, yet relatively little effort has been devoted to understanding biogeochemistry of urban streams at the ground water-surface water interface. This zone may be especially important for nitrogen re...

  11. Improved sampling and validation of frozen Gaussian approximation with surface hopping algorithm for nonadiabatic dynamics

    NASA Astrophysics Data System (ADS)

    Lu, Jianfeng; Zhou, Zhennan

    2016-09-01

    In the spirit of the fewest switches surface hopping, the frozen Gaussian approximation with surface hopping (FGA-SH) method samples a path integral representation of the non-adiabatic dynamics in the semiclassical regime. An improved sampling scheme is developed in this work for FGA-SH based on birth and death branching processes. The algorithm is validated for the standard test examples of non-adiabatic dynamics.

  12. Dynamics of microdroplets over the surface of hot water

    NASA Astrophysics Data System (ADS)

    Umeki, Takahiro; Ohata, Masahiko; Nakanishi, Hiizu; Ichikawa, Masatoshi

    2015-01-01

    When drinking a cup of coffee under the morning sunshine, you may notice white membranes of steam floating on the surface of the hot water. They stay notably close to the surface and appear to almost stick to it. Although the membranes whiffle because of the air flow of rising steam, peculiarly fast splitting events occasionally occur. They resemble cracking to open slits approximately 1 mm wide in the membranes, and leave curious patterns. We studied this phenomenon using a microscope with a high-speed video camera and found intriguing details: i) the white membranes consist of fairly monodispersed small droplets of the order of 10 μm ii) they levitate above the water surface by 10 ~ 100 μm iii) the splitting events are a collective disappearance of the droplets, which propagates as a wave front of the surface wave with a speed of 1 ~ 2 m/s and iv) these events are triggered by a surface disturbance, which results from the disappearance of a single droplet.

  13. Dynamics of microdroplets over the surface of hot water

    PubMed Central

    Umeki, Takahiro; Ohata, Masahiko; Nakanishi, Hiizu; Ichikawa, Masatoshi

    2015-01-01

    When drinking a cup of coffee under the morning sunshine, you may notice white membranes of steam floating on the surface of the hot water. They stay notably close to the surface and appear to almost stick to it. Although the membranes whiffle because of the air flow of rising steam, peculiarly fast splitting events occasionally occur. They resemble cracking to open slits approximately 1 mm wide in the membranes, and leave curious patterns. We studied this phenomenon using a microscope with a high-speed video camera and found intriguing details: i) the white membranes consist of fairly monodispersed small droplets of the order of 10 μm; ii) they levitate above the water surface by 10 ~ 100 μm; iii) the splitting events are a collective disappearance of the droplets, which propagates as a wave front of the surface wave with a speed of 1 ~ 2 m/s; and iv) these events are triggered by a surface disturbance, which results from the disappearance of a single droplet. PMID:25623086

  14. Monitoring hillslope moisture dynamics with surface ERT and hydrometric point measurement: a case study from Ore Mountains, Germany

    NASA Astrophysics Data System (ADS)

    Hübner, R.; Heller, K.; Günther, T.; Kleber, A.

    2014-06-01

    Hillslopes are one of the basic units that mainly control water movement and flow pathways within catchments. The structure of their shallow subsurface affects water balance, e.g. infiltration, retention, and runoff. Nevertheless, there is still a gap of knowledge of the hydrological dynamics on hillslopes, notably due to the lack of generalization and transferability. To improve the knowledge of hydrological responses on hillslopes with periglacial cover beds, hydrometrical measurements have been carried out on a small spring catchment in the eastern Ore Mountains since November 2007. In addition, surface ERT measurements of several profiles were applied to enhance resolution of punctual hydrometric data. From May to December 2008 geoelectrical monitoring in nearly weekly intervals was implemented to trace seasonal moisture dynamics on the hillslope scale. To obtain the link between water content and resistivity, the parameters of Archie's law were determined using different core samples. To optimize inversion parameters and methods, the derived spatial and temporal water content distribution was compared to tensiometer data and resulting in remarkable coincidence. The measured resistivity shows a close correlation with precipitation. Depending on the amount and intensity of rain, different depths were affected by seepage water. Three different types of response to different amounts of precipitation (small, medium, high), could be differentiated. A period with a small amount causes a short interruption of the drying pattern at the surface in summer, whereas a medium amount induces a distinctive reaction at shallow depth (<0.9 m), and a high amount results in a strong response reaching down to 2 m.

  15. Efficient metal-free oxygen reduction in alkaline medium on high-surface-area mesoporous nitrogen-doped carbons made from ionic liquids and nucleobases.

    PubMed

    Yang, Wen; Fellinger, Tim-Patrick; Antonietti, Markus

    2011-01-19

    Mesoporous nitrogen-doped carbon materials with high surface areas up to 1500 m(2) g(-1) were conveniently made by the carbonization of nucleobases dissolved in an all-organic ionic liquid (1-ethyl-3-methylimidazolium dicyanamide). Using hard templating with silica nanoparticles, this process yields high-surface-area nitrogen-doped carbon materials with nitrogen contents as high as 12 wt %, narrow mesopore size distribution of ca. 12 nm diameter, and local graphitic carbon structure. It is demonstrated that the resulting nitrogen-doped carbons show very high catalytic activity, even in the metal-free case in the oxygen reduction reaction (ORR) for fuel cells. Specifically, the as-prepared materials exhibit a low onset voltage for ORR in alkaline medium and a high methanol tolerance, compared with those of commercial 20 wt % Pt/C catalyst. We regard this as a first step toward an all-sustainable fuel cell, avoiding noble metals. PMID:21155583

  16. Simulations of Gamma-Ray Burst Jets in a Stratified External Medium: Dynamics, Afterglow Light Curves, Jet Breaks, and Radio Calorimetry

    NASA Astrophysics Data System (ADS)

    De Colle, Fabio; Ramirez-Ruiz, Enrico; Granot, Jonathan; Lopez-Camara, Diego

    2012-05-01

    The dynamics of gamma-ray burst (GRB) jets during the afterglow phase is most reliably and accurately modeled using hydrodynamic simulations. All published simulations so far, however, have considered only a uniform external medium, while a stratified external medium is expected around long duration GRB progenitors. Here, we present simulations of the dynamics of GRB jets and the resulting afterglow emission for both uniform and stratified external media with ρextvpropr -k for k = 0, 1, 2. The simulations are performed in two dimensions using the special relativistic version of the Mezcal code. Common to all calculations is the initiation of the GRB jet as a conical wedge of half-opening angle θ0 = 0.2 whose radial profile is taken from the self-similar Blandford-McKee solution. The dynamics for stratified external media (k = 1, 2) are broadly similar to those derived for expansion into a uniform external medium (k = 0). The jet half-opening angle is observed to start increasing logarithmically with time (or radius) once the Lorentz factor Γ drops below θ-1 0. For larger k values, however, the lateral expansion is faster at early times (when Γ > θ-1 0) and slower at late times with the jet expansion becoming Newtonian and slowly approaching spherical symmetry over progressively longer timescales. We find that, contrary to analytic expectations, there is a reasonably sharp jet break in the light curve for k = 2 (a wind-like external medium), although the shape of the break is affected more by the viewing angle (for θobs <= θ0) than by the slope of the external density profile (for 0 <= k <= 2). Steeper density profiles (i.e., increasing k values) are found to produce more gradual jet breaks while larger viewing angles cause smoother and later appearing jet breaks. The counterjet becomes visible as it becomes sub-relativistic, and for k = 0 this results in a clear bump-like feature in the light curve. However, for larger k values the jet decelerates more

  17. Composition-dependent metallic glass alloys correlate atomic mobility with collective glass surface dynamics.

    PubMed

    Nguyen, Duc; Zhu, Zhi-Guang; Pringle, Brian; Lyding, Joseph; Wang, Wei-Hua; Gruebele, Martin

    2016-06-22

    Glassy metallic alloys are richly tunable model systems for surface glassy dynamics. Here we study the correlation between atomic mobility, and the hopping rate of surface regions (clusters) that rearrange collectively on a minute to hour time scale. Increasing the proportion of low-mobility copper atoms in La-Ni-Al-Cu alloys reduces the cluster hopping rate, thus establishing a microscopic connection between atomic mobility and dynamics of collective rearrangements at a glass surface made from freshly exposed bulk glass. One composition, La60Ni15Al15Cu10, has a surface resistant to re-crystallization after three heating cycles. When thermally cycled, surface clusters grow in size from about 5 glass-forming units to about 8 glass-forming units, evidence of surface aging without crystal formation, although its bulk clearly forms larger crystalline domains. Such kinetically stable glass surfaces may be of use in applications where glassy coatings stable against heating are needed.

  18. A stochastic, local mode study of neon-liquid surface collision dynamics.

    PubMed

    Packwood, Daniel M; Phillips, Leon F

    2011-01-14

    Equations of motion for a fast, light rare gas atom passing over a liquid surface are derived and used to infer the dynamics of neon collisions with squalane and perfluorinated polyether surfaces from experimental data. The equations incorporate the local mode model of a liquid surface via a stochastic process and explicitly account for impulsive collisional energy loss to the surface. The equations predict angular distributions for scattering of neon that are in good quantitative agreement with experimental data. Our key dynamical conclusions are that experimental angular distributions derive mainly from local mode surface topography rather than from structural features of individual surface molecules, and that the available data for these systems can be accounted for almost exclusively by single collisions between neon atoms and the liquid surface.

  19. Thermodynamically Constrained Averaging Theory Approach for Modeling Flow and Transport Phenomena in Porous Medium Systems: 8. Interface and Common Curve Dynamics

    PubMed Central

    Gray, William G.; Miller, Cass T.

    2010-01-01

    This work is the eighth in a series that develops the fundamental aspects of the thermodynamically constrained averaging theory (TCAT) that allows for a systematic increase in the scale at which multiphase transport phenomena is modeled in porous medium systems. In these systems, the explicit locations of interfaces between phases and common curves, where three or more interfaces meet, are not considered at scales above the microscale. Rather, the densities of these quantities arise as areas per volume or length per volume. Modeling of the dynamics of these measures is an important challenge for robust models of flow and transport phenomena in porous medium systems, as the extent of these regions can have important implications for mass, momentum, and energy transport between and among phases, and formulation of a capillary pressure relation with minimal hysteresis. These densities do not exist at the microscale, where the interfaces and common curves correspond to particular locations. Therefore, it is necessary for a well-developed macroscale theory to provide evolution equations that describe the dynamics of interface and common curve densities. Here we point out the challenges and pitfalls in producing such evolution equations, develop a set of such equations based on averaging theorems, and identify the terms that require particular attention in experimental and computational efforts to parameterize the equations. We use the evolution equations developed to specify a closed two-fluid-phase flow model. PMID:21197134

  20. Car-Parrinello Molecular Dynamics Simulations of Infrared Spectra of Crystalline Vitamin C with Analysis of Double Minimum Proton Potentials for Medium-Strong Hydrogen Bonds.

    PubMed

    Brela, Mateusz Z; Wójcik, Marek J; Boczar, Marek; Witek, Łukasz; Yasuda, Mitsuru; Ozaki, Yukihiro

    2015-06-25

    We studied proton dynamics of a hydrogen bonds of the crystalline l-ascorbic acid. Our approach was based on the Car-Parrinello molecular dynamics. The focal point of our study was simulation of the infrared spectra of l-ascorbic acid associated with the O-H stretching modes that are very sensitive to the strength of hydrogen bonding. In the l-ascorbic acid there are four kinds of hydrogen bonds. We calculated their spectra by using anharmonic approximation and the time course of the dipole moment function as obtained from the Car-Parrinello simulation. The quantization of the nuclear motion of the protons was made to perform detailed analysis of strength and properties of hydrogen bonds. We presented double minimum proton potentials with small value of barriers for medium-strong hydrogen bonds. We have also shown the difference character of medium-strong hydrogen bonds compared to weaker hydrogen bonds in the l-ascorbic acid. PMID:26028251

  1. Medium-assisted non-polar solvent dynamic microwave extraction for determination of organophosphorus pesticides in cereals using gas chromatography-mass spectrometry.

    PubMed

    Wu, Lijie; Song, Ying; Xu, Xu; Li, Na; Shao, Mingyuan; Zhang, Hanqi; Yu, Aimin; Yu, Cui; Ma, Qiang; Lu, Chunmei; Wang, Ziming

    2014-11-01

    A fast and green pretreatment method, medium-assisted non-polar solvent dynamic microwave extraction, was first applied to extract ten of organophosphorus pesticides (OPPs) from five cereal samples. Without adding any polar solvent, graphite powders (GP) were used as microwave absorption medium to transform microwave energy into heat energy. For recycling GP, an extractor was made by sealing GP inside the exterior tube of a glass sleeve. By dynamic microwave extraction using hexane as extraction solvent, ten OPPs could be extracted completely within 200s, and the extract was directly analysed by GC-MS without any clean-up process. The effects of some experimental parameters on extraction efficiency were investigated and optimised. Relative standard deviations of intra- and inter-day ranging from 1.02% to 5.32% were obtained. Five real samples were analysed, and the recoveries obtained were in the range of 73.2-99.8%, and the relative standard deviations were lower than 6.63%.

  2. Molecular dynamics modeling of a nanomaterials-water surface interaction

    NASA Astrophysics Data System (ADS)

    Nejat Pishkenari, Hossein; Keramati, Ramtin; Abdi, Ahmad; Minary-Jolandan, Majid

    2016-04-01

    In this article, we study the formation of nanomeniscus around a nanoneedle using molecular dynamics simulation approach. The results reveal three distinct phases in the time-evolution of meniscus before equilibrium according to the contact angle, meniscus height, and potential energy. In addition, we investigated the correlation between the nanoneedle diameter and nanomeniscus characteristics. The results have applications in various fields such as scanning probe microscopy and rheological measurements.

  3. Unbiased Clustering of Molecular Dynamics for Spatially Resolved Analysis of Chemically Heterogeneous Surfaces.

    PubMed

    Nelson, Nathaniel; Schwartz, Daniel K

    2015-06-01

    A technique is described for resolving and interpreting molecular interactions with a chemically heterogeneous surface. Using total internal reflection fluorescence microscopy, dynamic single molecule trajectories were accumulated simultaneously for fluorescently labeled fatty acid (interacting primarily via hydrophobic interactions) and dextran (interacting via hydrogen-bonding interactions) probe molecules at the interface between an aqueous solvent and a photopatterned solid surface with distinct regions of amine-terminated and poly(ethylene glycol) self-assembled monolayers. Using dynamic properties of the probe molecules (adsorption rate, surface diffusion coefficient, residence time), an unsupervised Gaussian mixture model algorithm was used to identify areas of the surface that were chemically related to each other, and the dynamic behaviors of the probe molecules were studied statistically on these distinct regions. The dynamic data were compared to data from homogeneous surfaces of known chemistry to provide a chemical identification of each location on the surface. Spatial maps were also constructed, allowing for spatial visualization of surface chemistry on a hydrophilic substrate. This work enables the direct study of interactions between single-molecule probes and distinct surface chemistries, even in the presence of spatial heterogeneity, without human bias, assumptions about surface structure, or model-dependent analysis.

  4. Mechanisms, kinetics, and dynamics of oxidation and reactions on oxide surfaces investigated by scanning probe microscopy.

    PubMed

    Altman, Eric I; Schwarz, Udo D

    2010-07-20

    Advances in scanning probe microscopies (SPM) have allowed the mechanisms and rates of adsorption, diffusion and reactions on surfaces to be characterized by directly observing the motions of the individual atoms and molecules involved. The importance of oxides as thermal and photocatalysts, chemical sensors, and substrates for epitaxial growth has motivated dynamical SPM studies of oxide surfaces and their formation. Work on the TiO(2) (110) surface is reviewed as an example of how dynamic SPM studies have revealed unexpected interactions between adsorbates and defects that influence macroscopic reaction rates. Studies following diffusion, adsorption and phase transitions on bulk and surface oxides are also discussed. A perspective is provided on advanced SPM techniques that hold great promise for yielding new insights into the mechanisms and rates of elemental processes that take place either during oxidation or on oxide surfaces, with particular emphasis on methods that extend the time and chemical resolution of dynamical SPM measurements.

  5. Molecular dynamics simulation study of water adsorption on hydroxylated graphite surfaces.

    PubMed

    Picaud, Sylvain; Collignon, B; Hoang, Paul N M; Rayez, J C

    2006-04-27

    In this paper, we present results from molecular dynamic simulations devoted to the characterization of the interaction between water molecules and hydroxylated graphite surfaces considered as models for surfaces of soot emitted by aircraft. The hydroxylated graphite surfaces are modeled by anchoring several OH groups on an infinite graphite plane. The molecular dynamics simulations are based on a classical potential issued from quantum chemical calculations. They are performed at three temperatures (100, 200, and 250 K) to provide a view of the structure and dynamics of water clusters on the model soot surface. These simulations show that the water-OH sites interaction is quite weak compared to the water-water interaction. This leads to the clustering of the water molecules above the surface, and the corresponding water aggregate can only be trapped by the OH sites when the temperature is sufficiently low, or when the density of OH sites is sufficiently high.

  6. Aligned magnetic field and cross-diffusion effects of a nanofluid over an exponentially stretching surface in porous medium

    NASA Astrophysics Data System (ADS)

    Sulochana, C.; Sandeep, N.; Sugunamma, V.; Rushi Kumar, B.

    2016-06-01

    In this paper, we investigated the effects of aligned magnetic field, thermal radiation, heat generation/absorption, cross-diffusion, viscous dissipation, heat source and chemical reaction on the flow of a nanofluid past an exponentially stretching sheet in porous medium. The governing partial differential equations are transformed to set of ordinary differential equations using self-similarity transformation, which are then solved numerically using bvp4c Matlab package. Finally the effects of various non-dimensional parameters on velocity, temperature, concentration, skin friction, local Nusselt and Sherwood numbers are thoroughly investigated and presented through graphs and tables. We observed that an increase in the aligned angle strengthens the applied magnetic field and decreases the velocity profiles of the flow. Soret and Dufour numbers are helpful to enhance the heat transfer rate. An increase in the heat source parameter, radiation parameter and Eckert number increases the mass transfer rate. Mixed convection parameter has tendency to enhance the friction factor along with the heat and mass transfer rate.

  7. Annual dynamics of impervious surface in the Pearl River Delta, China, from 1988 to 2013, using time series Landsat imagery

    NASA Astrophysics Data System (ADS)

    Zhang, Lei; Weng, Qihao

    2016-03-01

    Information on impervious surface distribution and dynamics is useful for understanding urbanization and its impacts on hydrological cycle, water management, surface energy balances, urban heat island, and biodiversity. Numerous methods have been developed and successfully applied to estimate impervious surfaces. Previous methods of impervious surface estimation mainly focused on the spectral differences between impervious surfaces and other land covers. Moreover, the accuracy of estimation from single or multi-temporal images was often limited by the mixed pixel problem in coarse- or medium-resolution imagery or by the intra-class spectral variability problem in high resolution imagery. Time series satellite imagery provides potential to resolve the above problems as well as the spectral confusion with similar surface characteristics due to phenological change, inter-annual climatic variability, and long-term changes of vegetation. Since Landsat time series has a long record with an effective spatial resolution, this study aimed at estimating and mapping impervious surfaces by analyzing temporal spectral differences between impervious and pervious surfaces that were extracted from dense time series Landsat imagery. Specifically, this study developed an efficient method to extract annual impervious surfaces from time series Landsat data and applied it to the Pearl River Delta, southern China, from 1988 to 2013. The annual classification accuracy yielded from 71% to 91% for all classes, while the mapping accuracy of impervious surfaces ranged from 80.5% to 94.5%. Furthermore, it is found that the use of more than 50% of Scan Line Corrector (SLC)-off images after 2003 did not substantially reduced annual classification accuracy, which ranged from 78% to 91%. It is also worthy to note that more than 80% of classification accuracies were achieved in both 2002 and 2010 despite of more than 40% of cloud cover detected in these two years. These results suggested that the

  8. Droplet evaporation dynamics on a superhydrophobic surface with negligible hysteresis.

    PubMed

    Dash, Susmita; Garimella, Suresh V

    2013-08-27

    We report on experiments of droplet evaporation on a structured superhydrophobic surface that displays very high contact angle (CA ∼ 160 deg), and negligible contact angle hysteresis (<1 deg). The droplet evaporation is observed to occur in a constant-contact-angle mode, with contact radius shrinking for almost the entire duration of evaporation. Experiments conducted on Teflon-coated smooth surface (CA ∼ 120 deg) as a baseline also support an evaporation process that is dominated by a constant-contact-angle mode. The experimental results are compared with an isothermal diffusion model for droplet evaporation from the literature. Good agreement is observed for the Teflon-coated smooth surface between the analytical expression and experimental results in terms of the total time for evaporation, transient volume, contact angle, and contact radius. However, for the structured superhydrophobic surface, the experiments indicate that the time taken for complete evaporation of the droplet is greater than the predicted time, across all droplet volumes. This disparity is attributed primarily to the evaporative cooling at the droplet interface due to the high aspect ratio of the droplet and also the lower effective thermal conductivity of the substrate due to the presence of air gaps. This hypothesis is verified by numerically evaluating the temperature distribution along the droplet interface. We propose a generalized relation for predicting the instantaneous volume of droplets with initial CA > 90 deg, irrespective of the mode of evaporation.

  9. Control and dynamics study for the satellite power system. Volume 1: MPTS/SPS collector dynamic analysis and surface deformation

    NASA Technical Reports Server (NTRS)

    Wang, S. J.

    1980-01-01

    The basic dynamic properties and performance characteristics of the microwave power transmission satellite antenna were analyzed in an effort to develop criteria, requirements, and constraints for the control and structure design. The vibrational properties, the surface deformation, and the corresponding scan loss under the influence of disturbances are considered.

  10. Improvement of Surface Temperature Prediction Using SVR with MOGREPS Data for Short and Medium range over South Korea

    NASA Astrophysics Data System (ADS)

    Lim, S. J.; Choi, R. K.; Ahn, K. D.; Ha, J. C.; Cho, C. H.

    2014-12-01

    As the Korea Meteorology Administration (KMA) has operated Met Office Global and Regional Ensemble Prediction System (MOGREPS) with introduction of Unified Model (UM), many attempts have been made to improve predictability in temperature forecast in last years. In this study, post-processing method of MOGREPS for surface temperature prediction is developed with machine learning over 52 locations in South Korea. Past 60-day lag time was used as a training phase of Support Vector Regression (SVR) method for surface temperature forecast model. The selected inputs for SVR are followings: date and surface temperatures from Numerical Weather prediction (NWP), such as GDAPS, individual 24 ensemble members, mean and median of ensemble members for every 3hours for 12 days.To verify the reliability of SVR-based ensemble prediction (SVR-EP), 93 days are used (from March 1 to May 31, 2014). The result yielded improvement of SVR-EP by RMSE value of 16 % throughout entire prediction period against conventional ensemble prediction (EP). In particular, short range predictability of SVR-EP resulted in 18.7% better RMSE for 1~3 day forecast. The mean temperature bias between SVR-EP and EP at all test locations showed around 0.36°C and 1.36°C, respectively. SVR-EP is currently extending for more vigorous sensitivity test, such as increasing training phase and optimizing machine learning model.

  11. Approach of Computational Fluid Dynamics of VOF Model in Two Phase flow through Porous Medium under Microgravity Condition

    NASA Astrophysics Data System (ADS)

    Hasan, Raisul

    2016-07-01

    In this research paper firstly theoretical analysis and design of the porous matrix for filtration and selection of associated liquid (highly viscous and low viscous liquid) is carried out. Hence, porosity of the bed has been found out followed by a detailed CFD analysis of the flow to identify displacement structure (fingering: due to the nonlinear interactions among viscous, capillary and gravitational forces). Moreover, an experiment will be with synthetic porous medium consists of a single layer of glass beads which are then positioned homogeneously or non-homogeneously between two Perspex sheets and then fluid displacement structure/fingering will be photographed. Then the effort will be made to validate results with the experiment based photograph and then the CFD model will be extended to microgravity condition KEYWORDS: CFD, Fingering, microgravity, Non-homogeneously, Capillary .

  12. The dynamical regime of fluid flow at the core surface

    NASA Astrophysics Data System (ADS)

    Bloxham, Jeremy

    1988-06-01

    An alternative method for determining the fluid motion immediately beneath the core-mantle boundary is presented which is based on solving the full nonlinear core motions problem. This method is used to examine three dynamical hypotheses about the flow: (1) the steady motions hypothesis; (2) the geostrophic hypothesis; and (3) the toroidal flow hypothesis. Better fits to the field are obtained with the toroidal flows than with geostrophic flows, casting considerable doubt on the validity of the geostrophic hypothesis. Additionally, some indication is found that failure of the frozen-flux approximation, a concomitant assumption, may be a serious obstacle to obtaining reliable maps of the core fluid flow.

  13. Model for dynamic self-assembled magnetic surface structures

    NASA Astrophysics Data System (ADS)

    Belkin, M.; Glatz, A.; Snezhko, A.; Aranson, I. S.

    2010-07-01

    We propose a first-principles model for the dynamic self-assembly of magnetic structures at a water-air interface reported in earlier experiments. The model is based on the Navier-Stokes equation for liquids in shallow water approximation coupled to Newton equations for interacting magnetic particles suspended at a water-air interface. The model reproduces most of the observed phenomenology, including spontaneous formation of magnetic snakelike structures, generation of large-scale vortex flows, complex ferromagnetic-antiferromagnetic ordering of the snake, and self-propulsion of bead-snake hybrids.

  14. Molecular dynamics simulation of bicrystalline metal surface treatment

    SciTech Connect

    Nikonov, A. Yu.

    2015-10-27

    The paper reports the molecular dynamics simulation results on the behavior of a copper crystallite in local frictional contact. The crystallite has a perfect defect-free structure and contains a high-angle grain boundary of type Σ5. The influence of the initial structure on the specimen behavior under loading was analyzed. It is shown that nanoblocks are formed in the subsurface layer. The atomic mechanism of nanofragmentation was studied. A detailed analysis of atomic displacements in the blocks showed that the displacements are rotational. Calculations revealed that the misorientation angle of formed nanoblocks along different directions does not exceed 2 degrees.

  15. Model for dynamic self-assembled magnetic surface structures.

    SciTech Connect

    Belkin, M.; Glatz, A.; Snezhko, A.; Aranson, I. S.; Materials Science Division; Northwestern Univ.

    2010-07-07

    We propose a first-principles model for the dynamic self-assembly of magnetic structures at a water-air interface reported in earlier experiments. The model is based on the Navier-Stokes equation for liquids in shallow water approximation coupled to Newton equations for interacting magnetic particles suspended at a water-air interface. The model reproduces most of the observed phenomenology, including spontaneous formation of magnetic snakelike structures, generation of large-scale vortex flows, complex ferromagnetic-antiferromagnetic ordering of the snake, and self-propulsion of bead-snake hybrids.

  16. Effect of Surface Oxidation on Interfacial Water Structure at a Pyrite (100) Surface as Studied by Molecular Dynamics Simulation

    SciTech Connect

    Jin, Jiaqi; Miller, Jan D.; Dang, Liem X.; Wick, Collin D.

    2015-06-01

    In the first part of this paper, a Scanning Electron Microscopy and contact angle study of a pyrite surface (100) is reported describing the relationship between surface oxidation and the hydrophilic surface state. In addition to these experimental results, the following simulated surface states were examined using Molecular Dynamics Simulation (MDS): fresh unoxidized (100) surface; polysulfide at the (100) surface; elemental sulfur at the (100) surface. Crystal structures for the polysulfide and elemental sulfur at the (100) surface were simulated using Density Functional Theory (DFT) quantum chemical calculations. The well known oxidation mechanism which involves formation of a metal deficient layer was also described with DFT. Our MDS results of the behavior of interfacial water at the fresh and oxidized pyrite (100) surfaces without/with the presence of ferric hydroxide include simulated contact angles, number density distribution for water, water dipole orientation, water residence time, and hydrogen-bonding considerations. The significance of the formation of ferric hydroxide islands in accounting for the corresponding hydrophilic surface state is revealed not only from experimental contact angle measurements but also from simulated contact angle measurements using MDS. The hydrophilic surface state developed at oxidized pyrite surfaces has been described by MDS, on which basis the surface state is explained based on interfacial water structure. The Division of Chemical Sciences, Geosciences, and Biosciences, Office of Basic Energy Sciences (BES), of the DOE funded work performed by Liem X. Dang. Battelle operates the Pacific Northwest National Laboratory for DOE. The calculations were carried out using computer resources provided by BES.

  17. Collective lipid bilayer dynamics excited by surface acoustic waves.

    PubMed

    Reusch, T; Schülein, F J R; Nicolas, J D; Osterhoff, M; Beerlink, A; Krenner, H J; Müller, M; Wixforth, A; Salditt, T

    2014-09-12

    We use standing surface acoustic waves to induce coherent phonons in model lipid multilayers deposited on a piezoelectric surface. Probing the structure by phase-controlled stroboscopic x-ray pulses we find that the internal lipid bilayer electron density profile oscillates in response to the externally driven motion of the lipid film. The structural response to the well-controlled motion is a strong indication that bilayer structure and membrane fluctuations are intrinsically coupled, even though these structural changes are averaged out in equilibrium and time integrating measurements. Here the effects are revealed by a timing scheme with temporal resolution on the picosecond scale in combination with the sub-nm spatial resolution, enabled by high brilliance synchrotron x-ray reflectivity.

  18. Dynamics of a near-surface pipeline tow

    SciTech Connect

    Binns, J.R.; Marcollo, H.; Hinwood, J.; Doctors, L.J.

    1995-12-31

    Installation of ocean pipelines can involve near-surface towing conditions through waves. This paper presents a method for evaluating the response of the pipeline in waves in order to predict bending stresses. The investigation covers the effects of back tension, towing depth, pipe stiffness and wave frequency. Techniques for determining numerical solutions for the response of the pipeline and the bending moment have been developed and these results compare favorably with the experiments.

  19. On the Surface Formation of NH3 and HNCO in Dark Molecular Clouds - Searching for Wöhler Synthesis in the Interstellar Medium

    NASA Astrophysics Data System (ADS)

    Fedoseev, Gleb; Lamberts, Thanja; Linnartz, Harold; Ioppolo, Sergio; Zhao, Dongfeng

    Despite its potential to reveal the link between the formation of simple species and more complex molecules (e.g., amino acids), the nitrogen chemistry of the interstellar medium (ISM) is still poorly understood. Ammonia (NH _{3}) is one of the few nitrogen-bearing species that have been observed in interstellar ices toward young stellar objects (YSOs) and quiescent molecular clouds. The aim of the present work is to experimentally investigate surface formation routes of NH _{3} and HNCO through non-energetic surface reactions in interstellar ice analogues under fully controlled laboratory conditions and at astrochemically relevant cryogenic temperatures. This study focuses on the formation of NH _{3} and HNCO in CO-rich (non-polar) interstellar ices that simulate the CO freeze-out stage in interstellar dark cloud regions, well before thermal and energetic processing start to become predominant. Our work confirms the surface formation of ammonia through the sequential addition of three hydrogen/deuterium atoms to a single nitrogen atom at low temperature. The H/D fractionation of the formed ammonia is also shown. Furthermore, we show the surface formation of solid HNCO through the interaction of CO molecules with NH radicals - one of the intermediates in the formation of solid NH _{3}. Finally, we discuss the implications of HNCO in astrobiology, as a possible starting point for the formation of more complex prebiotic species.

  20. Surface effects on dynamic stability and loading during outdoor running using wireless trunk accelerometry.

    PubMed

    Schütte, Kurt H; Aeles, Jeroen; De Beéck, Tim Op; van der Zwaard, Babette C; Venter, Rachel; Vanwanseele, Benedicte

    2016-07-01

    Despite frequently declared benefits of using wireless accelerometers to assess running gait in real-world settings, available research is limited. The purpose of this study was to investigate outdoor surface effects on dynamic stability and dynamic loading during running using tri-axial trunk accelerometry. Twenty eight runners (11 highly-trained, 17 recreational) performed outdoor running on three outdoor training surfaces (concrete road, synthetic track and woodchip trail) at self-selected comfortable running speeds. Dynamic postural stability (tri-axial acceleration root mean square (RMS) ratio, step and stride regularity, sample entropy), dynamic loading (impact and breaking peak amplitudes and median frequencies), as well as spatio-temporal running gait measures (step frequency, stance time) were derived from trunk accelerations sampled at 1024Hz. Results from generalized estimating equations (GEE) analysis showed that compared to concrete road, woodchip trail had several significant effects on dynamic stability (higher AP ratio of acceleration RMS, lower ML inter-step and inter-stride regularity), on dynamic loading (downward shift in vertical and AP median frequency), and reduced step frequency (p<0.05). Surface effects were unaffected when both running level and running speed were added as potential confounders. Results suggest that woodchip trails disrupt aspects of dynamic stability and loading that are detectable using a single trunk accelerometer. These results provide further insight into how runners adapt their locomotor biomechanics on outdoor surfaces in situ.

  1. One-step tumor detection from dynamic morphology tracking on aptamer-grafted surfaces

    PubMed Central

    Mahmood, Mohammed Arif I.; Hasan, Mohammad Raziul; Khan, Umair J. M.; Allen, Peter B.; Kim, Young-tae; Ellington, Andrew D.; Iqbal, Samir M.

    2015-01-01

    In this paper, we report a one-step tumor cell detection approach based on the dynamic morphological behavior tracking of cancer cells on a ligand modified surface. Every cell on the surface was tracked in real time for several minutes immediately after seeding until these were finally attached. Cancer cells were found to be very active in the aptamer microenvironment, changing their shapes rapidly from spherical to semi-elliptical, with much flatter spread and extending pseudopods at regular intervals. When incubated on a functionalized surface, the balancing forces between cell surface molecules and the surface-bound aptamers, together with the flexibility of the membranes, caused cells to show these distinct dynamic activities and variations in their morphologies. On the other hand, healthy cells remained distinguishingly inactive on the surface over the same period. The quantitative image analysis of cell morphologies provided feature vectors that were statistically distinct between normal and cancer cells. PMID:26753172

  2. Analytical simulation and inversion of dynamic urban land surface effects

    NASA Astrophysics Data System (ADS)

    Bayer, P.; Rivera, J.; Blum, P.; Schweizer, D.; Rybach, L.

    2015-12-01

    Long-term thermal changes at the land surface can be backtracked from borehole temperature profiles. The main focus so far has been on past climate changes, assuming perfect coupling of surface air and ground temperature. In many urbanized areas, however, temperature profiles are heavily perturbed. We find a characteristic bending of urban profiles towards shallow depth, which indicates strong heating from the ground surface during recent decades. This phenomenon is generally described as subsurface urban heat island (UHI) effect, which exists beneath many cities worldwide. Major drivers are land use changes and urban structures that act as long-term heat sources that artificially load the top 100 m of the ground. While variability in land use and coverage are critical factors for reliable borehole climatology, temperature profiles can also be inverted to trace back the combined effect of past urbanization and climate. We present an analytical framework based on the superposition of specific Green's functions for simulating transient land use changes and their effects on borehole temperature profiles. By inversion in a Bayesian framework, flexible calibration of unknown spatially distributed parameter values and their correlation is feasible. The procedure is applied to four temperature logs which are around 200-400 m deep from the city and suburbs of Zurich, Switzerland. These were recorded recently by a temperature sensor and data logger introduced in closed borehole heat exchangers before the start of geothermal operation. At the sites, long-term land use changes are well documented for more than the last century. This facilitated focusing on a few unknown parameters, and we selected the contribution by asphalt and by basements of buildings. It is revealed that for three of the four sites, these two factors dominate the subsurface UHI evolution. At one site, additional factors such as buried district heating networks may play a role. It is demonstrated that site

  3. Ocean current surface measurement using dynamic elevations obtained by the GEOS-3 radar altimeter

    NASA Technical Reports Server (NTRS)

    Leitao, C. D.; Huang, N. E.; Parra, C. G.

    1977-01-01

    Remote Sensing of the ocean surface from the GEOS-3 satellite using radar altimeter data has confirmed that the altimeter can detect the dynamic ocean topographic elevations relative to an equipotential surface, thus resulting in a reliable direct measurement of the ocean surface. Maps of the ocean dynamic topography calculated over a one month period and with 20 cm contour interval are prepared for the last half of 1975. The Gulf Stream is observed by the rapid slope change shown by the crowding of contours. Cold eddies associated with the current are seen as roughly circular depressions.

  4. Organization of postural coordination patterns as a function of scaling the surface of support dynamics.

    PubMed

    Ko, Ji-Hyun; Newell, Karl M

    2015-01-01

    The number and nature of the dynamical degrees of freedom (DFs) in postural coordination patterns was investigated as a function of practice over the continuously scaled frequency of the support surface dynamics. The modal number of dynamical DFs of the coordination pattern was reduced with practice particularly in the higher frequency conditions. The ankle-knee and knee-hip couplings were highly variable across the platform frequencies and practice. The findings show that practice and higher platform frequency both contribute to reducing the number of dynamical DFs of movement organization in compensatory postural control and that this is related to an increase in the strength of particularly the ankle and hip synergy.

  5. Novel Gyroscopic Mounting for Crystal Oscillators to Increase Short and Medium Term Stability under Highly Dynamic Conditions

    PubMed Central

    Abedi, Maryam; Jin, Tian; Sun, Kewen

    2015-01-01

    In this paper, a gyroscopic mounting method for crystal oscillators to reduce the impact of dynamic loads on their output stability has been proposed. In order to prove the efficiency of this mounting approach, each dynamic load-induced instability has been analyzed in detail. A statistical study has been performed on the elevation angle of the g-sensitivity vector of Stress Compensated-cut (SC-cut) crystals. The analysis results show that the proposed gyroscopic mounting method gives good performance for host vehicle attitude changes. A phase noise improvement of 27 dB maximum and 5.7 dB on average can be achieved in the case of steady state loads, while under sinusoidal vibration conditions, the maximum and average phase noise improvement are as high as 24 dB and 7.5 dB respectively. With this gyroscopic mounting method, random vibration-induced phase noise instability is reduced 30 dB maximum and 8.7 dB on average. Good effects are apparent for crystal g-sensitivity vectors with low elevation angle φ and azimuthal angle β. under highly dynamic conditions, indicating the probability that crystal oscillator instability will be significantly reduced by using the proposed mounting approach. PMID:26091393

  6. Time-resolved interference unveils nanoscale surface dynamics in evaporating sessile droplet

    NASA Astrophysics Data System (ADS)

    Verma, Gopal; Singh, Kamal P.

    2014-06-01

    We report a simple optical technique to measure time-resolved nanoscale surface profile of an evaporating sessile fluid droplet. By analyzing the high contrast Newton-ring like dynamical fringes formed by interfering Fresnel reflections, we demonstrated λ/100 ≈ 5 nm sensitivity in surface height (at 0.01-160 nm/s rate) of an evaporating water drop. The remarkably high sensitivity allowed us to precisely measure its transient surface dynamics during contact-line slips, weak perturbations on the evaporation due to external magnetic field and partial confinement of the drop. Further, we measured evaporation dynamics of a sessile water drop on soft deformable surface to demonstrate wide applicability of this technique.

  7. N-body dynamics on closed surfaces: the axioms of mechanics

    NASA Astrophysics Data System (ADS)

    Boatto, Stefanella; Dritschel, David G.; Schaefer, Rodrigo G.

    2016-08-01

    A major challenge for our understanding of the mathematical basis of particle dynamics is the formulation of N-body and N-vortex dynamics on Riemann surfaces. In this paper, we show how the two problems are, in fact, closely related when considering the role played by the intrinsic geometry of the surface. This enables a straightforward deduction of the dynamics of point masses, using recently derived results for point vortices on general closed differentiable surfaces M endowed with a metric g. We find, generally, that Kepler's Laws do not hold. What is more, even Newton's First Law (the law of inertia) fails on closed surfaces with variable curvature (e.g. the ellipsoid).

  8. MO-E-17A-02: Incorporation of Contrast Medium Dynamics in Anthropomorphic Phantoms: The Advent of 5D XCAT Models

    SciTech Connect

    Sahbaee, P; Samei, E; Segars, W

    2014-06-15

    Purpose: To develop a unique method to incorporate the dynamics of contrast-medium propagation into the anthropomorphic phantom, to generate a five-dimensional (5D) patient model for multimodality imaging studies. Methods: A compartmental model of blood circulation network within the body was embodied into an extended cardiac-torso (4D-XCAT) patient model. To do so, a computational physiologic model of the human cardiovascular system was developed which includes a series of compartments representing heart, vessels, and organs. Patient-specific cardiac output and blood volume were used as inputs influenced by the weight, height, age, and gender of the patient's model. For a given injection protocol and given XCAT model, the contrast-medium transmission within the body was described by a series of mass balance differential equations, the solutions to which provided the contrast enhancement-time curves for each organ; thereby defining the tissue materials including the contrastmedium within the XCAT model. A library of time-dependent organ materials was then defined. Each organ in each voxelized 4D-XCAT phantom was assigned to a corresponding time-varying material to create the 5D-XCAT phantom in which the fifth dimension is blood/contrast-medium within the temporal domain. Results: The model effectively predicts the time-varying concentration behavior of various contrast-medium administration in each organ for different patient models as function of patient size (weight/height) and different injection protocol factors (injection rate and pattern, iodine concentration or volume). The contrast enhanced XCAT patient models was developed based on the concentration of iodine as a function of time after injection. Conclusion: Majority of medical imaging systems take advantage of contrast-medium administration in terms of better image quality, the effect of which was ignored in previous optimization studies. The study enables a comprehensive optimization of contrast

  9. Molecularly engineered surfaces for cell biology: from static to dynamic surfaces.

    PubMed

    Gooding, J Justin; Parker, Stephen G; Lu, Yong; Gaus, Katharina

    2014-04-01

    Surfaces with a well-defined presentation of ligands for receptors on the cell membrane can serve as models of the extracellular matrix for studying cell adhesion or as model cell surfaces for exploring cell-cell contacts. Because such surfaces can provide exquisite control over, for example, the density of these ligands or when the ligands are presented to the cell, they provide a very precise strategy for understanding the mechanisms by which cells respond to external adhesive cues. In the present feature article, we present an overview of the basic biology of cell adhesion before discussing surfaces that have a static presentation of immobile ligands. We outline the biological information that such surfaces have given us, before progressing to recently developed switchable surfaces and surfaces that mimic the lipid bilayer, having adhesive ligands that can move around the membrane and be remodeled by the cell. Finally, the feature article closes with some of the biological information that these new types of surfaces could provide.

  10. Calcite surface structure and reactivity: molecular dynamics simulations and macroscopic surface modelling of the calcite-water interface.

    PubMed

    Wolthers, M; Di Tommaso, D; Du, Z; de Leeuw, N H

    2012-11-21

    Calcite-water interactions are important not only in carbon sequestration and the global carbon cycle, but also in contaminant behaviour in calcite-bearing host rock and in many industrial applications. Here we quantify the effect of variations in surface structure on calcite surface reactivity. Firstly, we employ classical Molecular Dynamics simulations of calcite surfaces containing an etch pit and a growth terrace, to show that the local environment in water around structurally different surface sites is distinct. In addition to observing the expected formation of more calcium-water interactions and hydrogen-bonds at lower-coordinated sites, we also observed subtle differences in hydrogen bonding around acute versus obtuse edges and corners. We subsequently used this information to refine the protonation constants for the calcite surface sites, according to the Charge Distribution MUltiSite Ion Complexation (CD-MUSIC) approach. The subtle differences in hydrogen bonding translate into markedly different charging behaviour versus pH, in particular for acute versus obtuse corner sites. The results show quantitatively that calcite surface reactivity is directly related to surface topography. The information obtained in this study is not only crucial for the improvement of existing macroscopic surface models of the reactivity of calcite towards contaminants, but also improves our atomic-level understanding of mineral-water interactions.

  11. Optimization of the culture medium composition to improve the production of hyoscyamine in elicited Datura stramonium L. hairy roots using the Response Surface Methodology (RSM).

    PubMed

    Ryad, Amdoun; Lakhdar, Khelifi; Majda, Khelifi-Slaoui; Samia, Amroune; Mark, Asch; Corinne, Assaf-Ducrocq; Eric, Gontier

    2010-11-18

    Traditionally, optimization in biological analyses has been carried out by monitoring the influence of one factor at a time; this technique is called one-variable-at-a-time. The disadvantage of this technique is that it does not include any interactive effects among the variables studied and requires a large number of experiments. Therefore, in recent years, the Response Surface Methodology (RSM) has become the most popular optimization method. It is an effective mathematical and statistical technique which has been widely used in optimization studies with minimal experimental trials where interactive factors may be involved. This present study follows on from our previous work, where RSM was used to optimize the B5 medium composition in [NO(3-)], [Ca(2+)] and sucrose to attain the best production of hyoscyamine (HS) from the hairy roots (HRs) of Datura stramonium elicited by Jasmonic Acid (JA). The present paper focuses on the use of the RSM in biological studies, such as plant material, to establish a predictive model with the planning of experiments, analysis of the model, diagnostics and adjustment for the accuracy of the model. With the RSM, only 20 experiments were necessary to determine optimal concentrations. The model could be employed to carry out interpolations and predict the response to elicitation. Applying this model, the optimization of the HS level was 212.7% for the elicited HRs of Datura stramonium, cultured in B5-OP medium (optimized), in comparison with elicited HRs cultured in B5 medium (control). The optimal concentrations, under experimental conditions, were determined to be: 79.1 mM [NO(3-)], 11.4 mM [Ca(2+)] and 42.9 mg/L of sucrose.

  12. An assessment of the dynamic stability of microorganisms on patterned surfaces in relation to biofouling control.

    PubMed

    Halder, Partha; Nasabi, Mahyar; Jayasuriya, Niranjali; Shimeta, Jeff; Deighton, Margaret; Bhattacharya, Satinath; Mitchell, Arnan; Bhuiyan, Muhammed Ali

    2014-01-01

    Microstructure-based patterned surfaces with antifouling capabilities against a wide range of organisms are yet to be optimised. Several studies have shown that microtopographic features affect the settlement and the early stages of biofilm formation of microorganisms. It is speculated that the fluctuating stress-strain rates developed on patterned surfaces disrupt the stability of microorganisms. This study investigated the dynamic interactions of a motile bacterium (Escherichia coli) with microtopographies in relation to initial settlement. The trajectories of E. coli across a patterned surface of a microwell array within a microchannel-based flow cell system were assessed experimentally with a time-lapse imaging module. The microwell array was composed of 256 circular wells, each with diameter 10 μm, spacing 7 μm and depth 5 μm. The dynamics of E. coli over microwell-based patterned surfaces were compared with those over plain surfaces and an increased velocity of cell bodies was observed in the case of patterned surfaces. The experimental results were further verified and supported by computational fluid dynamic simulations. Finally, it was stated that the nature of solid boundaries and the associated microfluidic conditions play key roles in determining the dynamic stability of motile bacteria in the close vicinity over surfaces.

  13. Response surface methodology for optimization of medium for decolorization of textile dye Direct Black 22 by a novel bacterial consortium.

    PubMed

    Mohana, Sarayu; Shrivastava, Shalini; Divecha, Jyoti; Madamwar, Datta

    2008-02-01

    Decolorization and degradation of polyazo dye Direct Black 22 was carried out by distillery spent wash degrading mixed bacterial consortium, DMC. Response surface methodology (RSM) involving a central composite design (CCD) in four factors was successfully employed for the study and optimization of decolorization process. The hyper activities and interactions between glucose concentration, yeast extract concentration, dye concentration and inoculum size on dye decolorization were investigated and modeled. Under optimized conditions the bacterial consortium was able to decolorize the dye almost completely (>91%) within 12h. Bacterial consortium was able to decolorize 10 different azo dyes. The optimum combination of the four variables predicted through RSM was confirmed through confirmatory experiments and hence this bacterial consortium holds potential for the treatment of industrial waste water. Dye degradation products obtained during the course of decolorization were analyzed by HPTLC.

  14. Corrosion inhibition of Eleusine aegyptiaca and Croton rottleri leaf extracts on cast iron surface in 1 M HCl medium

    NASA Astrophysics Data System (ADS)

    Rajeswari, Velayutham; Kesavan, Devarayan; Gopiraman, Mayakrishnan; Viswanathamurthi, Periasamy; Poonkuzhali, Kaliyaperumal; Palvannan, Thayumanavan

    2014-09-01

    The adsorption and corrosion inhibition activities of Eleusine aegyptiaca (E. aegyptiaca) and Croton rottleri (C. rottleri) leaf extracts on cast iron corrosion in 1 M hydrochloric acid solution were studied first time by weight loss and electrochemical techniques viz., Tafel polarization and electrochemical impedance spectroscopy. The results obtained from the weight loss and electrochemical methods showed that the inhibition efficiency increased with inhibitor concentrations. It was found that the extracts acted as mixed-type inhibitors. The addition of halide additives (KCl, KBr, and KI) on the inhibition efficiency has also been investigated. The adsorption of the inhibitors on cast iron surface both in the presence and absence of halides follows the Langmuir adsorption isotherm model. The inhibiting nature of the inhibitors was supported by FT-IR, UV-vis, Wide-angle X-ray diffraction and SEM methods.

  15. The Dynamics of Laurentian Great Lakes Surface Energy Budgets

    NASA Astrophysics Data System (ADS)

    Spence, C.; Blanken, P.; Lenters, J. D.; Gronewold, A.; Kerkez, B.; Xue, P.; Froelich, N.

    2015-12-01

    The Laurentian Great Lakes constitute the largest freshwater surface in the world and are a valuable North American natural and socio-economic resource. In response to calls for improved monitoring and research on the energy and water budgets of the lakes, there has been a growing ensemble of in situ measurements - including offshore eddy flux towers, buoy-based sensors, and vessel-based platforms -deployed through an ongoing, bi-national collaboration known as the Great Lakes Evaporation Network (GLEN). The objective of GLEN is to reduce uncertainty in Great Lakes seasonal and 6-month water level forecasts, as well as climate change projections of the surface energy balance and water level fluctuations. Although It remains challenging to quantify and scale energy budgets and fluxes over such large water bodies, this presentation will report on recent successes in three areas: First, in estimating evaporation rates over each of the Great Lakes; Second, defining evaporation variability among the lakes, especially in winter and; Third, explaining the interaction between ice cover, water temperature, and evaporation across a variety of temporal and spatial scales. Research gaps remain, particularly those related to spatial variability and scaling of turbulent fluxes, so the presentation will also describe how this will be addressed with enhanced instrument and platform arrays.

  16. Robust passive dynamics of the musculoskeletal system compensate for unexpected surface changes during human hopping.

    PubMed

    van der Krogt, Marjolein M; de Graaf, Wendy W; Farley, Claire T; Moritz, Chet T; Richard Casius, L J; Bobbert, Maarten F

    2009-09-01

    When human hoppers are surprised by a change in surface stiffness, they adapt almost instantly by changing leg stiffness, implying that neural feedback is not necessary. The goal of this simulation study was first to investigate whether leg stiffness can change without neural control adjustment when landing on an unexpected hard or unexpected compliant (soft) surface, and second to determine what underlying mechanisms are responsible for this change in leg stiffness. The muscle stimulation pattern of a forward dynamic musculoskeletal model was optimized to make the model match experimental hopping kinematics on hard and soft surfaces. Next, only surface stiffness was changed to determine how the mechanical interaction of the musculoskeletal model with the unexpected surface affected leg stiffness. It was found that leg stiffness adapted passively to both unexpected surfaces. On the unexpected hard surface, leg stiffness was lower than on the soft surface, resulting in close-to-normal center of mass displacement. This reduction in leg stiffness was a result of reduced joint stiffness caused by lower effective muscle stiffness. Faster flexion of the joints due to the interaction with the hard surface led to larger changes in muscle length, while the prescribed increase in active state and resulting muscle force remained nearly constant in time. Opposite effects were found on the unexpected soft surface, demonstrating the bidirectional stabilizing properties of passive dynamics. These passive adaptations to unexpected surfaces may be critical when negotiating disturbances during locomotion across variable terrain. PMID:19589956

  17. Dynamics of Protonated Peptide Ion Collisions with Organic Surfaces: Consonance of Simulation and Experiment.

    PubMed

    Pratihar, Subha; Barnes, George L; Laskin, Julia; Hase, William L

    2016-08-18

    In this Perspective, mass spectrometry experiments and chemical dynamics simulations are described that have explored the atomistic dynamics of protonated peptide ions, peptide-H(+), colliding with organic surfaces. These studies have investigated the energy transfer and fragmentation dynamics for peptide-H(+) surface-induced dissociation (SID), peptide-H(+) physisorption on the surface, soft landing (SL), and peptide-H(+) reaction with the surface, reactive landing (RL). SID provides primary structures of biological ions and information regarding their fragmentation pathways and energetics. Two SID mechanisms are found for peptide-H(+) fragmentation. A traditional mechanism in which peptide-H(+) is vibrationally excited by its collision with the surface, rebounds off the surface and then dissociates in accord with the statistical, RRKM unimolecular rate theory. The other, shattering, is a nonstatistical mechanism in which peptide-H(+) fragments as it collides with the surface, dissociating via many pathways and forming many product ions. Shattering is important for collisions with diamond and perfluorinated self-assembled monolayer (F-SAM) surfaces, increasing in importance with the peptide-H(+) collision energy. Chemical dynamics simulations also provide important mechanistic insights on SL and RL of biological ions on surfaces. The simulations indicate that SL occurs via multiple mechanisms consisting of sequences of peptide-H(+) physisorption on and penetration in the surface. SL and RL have a broad range of important applications including preparation of protein or peptide microarrays, development of biocompatible substrates and biosensors, and preparation of novel synthetic materials, including nanomaterials. An important RL mechanism is intact deposition of peptide-H(+) on the surface. PMID:27467857

  18. Sharpening our Understanding but Blurring the Boundaries: Dynamic Observations of Surface Reconstruction

    SciTech Connect

    Baer, Donald R.

    2003-08-20

    Every now and then, reading a specific paper stimulates--in my mind at least--a variety of associations and connections that highlight advances that have been made and suggests links between areas that I may not have previously connected. The recent series of papers by McCarty and Bartelt (and co-workers) using low energy electron microscopy (LEEM) to study the dynamics of surface reconstruction of TiO2 , and NiAl sent my thinking in a variety loosely connected directions. Paraphrasing the response of one of my colleagues - the work causes us to think dynamically where we have often thought statically about what happens when surfaces reconstruct. The measurements also highlight the importance of newer techniques to help us visualize and understand phenomena that may have puzzled us for years. The dynamic interactions between surface structure and both the defect structure (and history) of the substrate and the nature of the environment of the specimen highlight an aspect of phenomena that drive surface reconstruction not normally considered and suggests additional and delightful challenges we face in understanding the bulk stability and surface structures of nano-sized objects. Since the physical arrangement of the atoms controls every aspect of the physics and chemistry of a surface or interface, the atomic geometry is a fundamental defining characteristic of a surface. , Details of the structure of a surface, including altered atomic positions, the presence of steps and various types of defects can significantly change the chemistry of a surface and impact processes ranging from the formation of interfaces in electronic components to the efficiency of a catalyst. Because of its importance there has been considerable effort devoted to understanding and predicting surface structures. However, dynamical aspects of surface reconstruction and the significance of material defects in the process have not been part of the standard picture.

  19. Comparative Analyses of Response Surface Methodology and Artificial Neural Network on Medium Optimization for Tetraselmis sp. FTC209 Grown under Mixotrophic Condition

    PubMed Central

    Tan, Joo Shun; Mohamad, Rosfarizan; Mokhtar, Mohd Noriznan; Ariff, Arbakariya B.

    2013-01-01

    Mixotrophic metabolism was evaluated as an option to augment the growth and lipid production of marine microalga Tetraselmis sp. FTC 209. In this study, a five-level three-factor central composite design (CCD) was implemented in order to enrich the W-30 algal growth medium. Response surface methodology (RSM) was employed to model the effect of three medium variables, that is, glucose (organic C source), NaNO3 (primary N source), and yeast extract (supplementary N, amino acids, and vitamins) on biomass concentration, Xmax, and lipid yield, Pmax/Xmax. RSM capability was also weighed against an artificial neural network (ANN) approach for predicting a composition that would result in maximum lipid productivity, Prlipid. A quadratic regression from RSM and a Levenberg-Marquardt trained ANN network composed of 10 hidden neurons eventually produced comparable results, albeit ANN formulation was observed to yield higher values of response outputs. Finalized glucose (24.05 g/L), NaNO3 (4.70 g/L), and yeast extract (0.93 g/L) concentration, affected an increase of Xmax to 12.38 g/L and lipid a accumulation of 195.77 mg/g dcw. This contributed to a lipid productivity of 173.11 mg/L per day in the course of two-week cultivation. PMID:24109209

  20. Optimization of medium composition for the production of alkaline beta-mannanase by alkaliphilic Bacillus sp. N16-5 using response surface methodology.

    PubMed

    Lin, Shan-shan; Dou, Wen-fang; Xu, Hong-yu; Li, Hua-zhong; Xu, Zheng-hong; Ma, Yan-he

    2007-07-01

    In this work, a 2(2) factorial design was employed combining with response surface methodology (RSM) to optimize the medium compositions for the production of alkaline beta-mannanase by alkaliphilic Bacillus sp. N16-5 isolated previously from sediment of Wudunur Soda Lake in Inner Mongolia, China. The central composite design (CCD) used for the analysis of treatment combinations showed that a second-order polynomial regression model was in good agreement with experimental results, with R (2) = 0.9829 (P < 0.05). The maximum activity was obtained at NaCl concentration (84.4 g l(-1)) and sodium glutamate (3.11 g l(-1)) and a high medium pH around 10.0. Under such conditions, the activity of alkaline beta-mannanase achieved 310.1 U/ml in the scale of 5-l fermenter, which was increased nearly twice compared with the original. Through optimization, the substrates shifted from the expensive substrates, such as locust bean gum and peptone, to the inexpensive ones such as konjac powder, soymeal, and sodium glutamate. The experiment results also suggested that the environmental conditions of high salinity and high alkalinity, as well as the inducer substrates, play very important roles in the production of the alkaline beta-mannanase by alkaliphilic Bacillus sp. N16-5. PMID:17361429

  1. Droplet impingement dynamics: effect of surface temperature during boiling and non-boiling conditions

    NASA Astrophysics Data System (ADS)

    Shen, Jian; Liburdy, James A.; Pence, Deborah V.; Narayanan, Vinod

    2009-11-01

    This study investigates the hydrodynamic characteristics of droplet impingement on heated surfaces and compares the effect of surface temperature when using water and a nanofluid on a polished and nanostructured surface. Results are obtained for an impact Reynolds number and Weber number of approximately 1700 and 25, respectively. Three discs are used: polished silicon, nanostructured porous silicon and gold-coated polished silicon. Seven surface temperatures, including single-phase (non-boiling) and two-phase (boiling) conditions, are included. Droplet impact velocity, transient spreading diameter and dynamic contact angle are measured. Results of water and a water-based single-wall carbon-nanotube nanofluid impinging on a polished silicon surface are compared to determine the effects of nanoparticles on impinging dynamics. The nanofluid results in larger spreading velocities, larger spreading diameters and an increase in early-stage dynamic contact angle. Results of water impinging on both polished silicon and nanostructured silicon show that the nanostructured surface enhances the heat transfer for evaporative cooling at lower surface temperatures, which is indicated by a shorter evaporation time. Using a nanofluid or a nanostructured surface can reduce the total evaporation time up to 20% and 37%, respectively. Experimental data are compared with models that predict dynamic contact angle and non-dimensional maximum spreading diameter. Results show that the molecular-kinetic theory's dynamic contact angle model agrees well with current experimental data for later times, but over-predicts at early times. Predictions of maximum spreading diameter based on surface energy analyses indicate that these models over-predict unless empirical coefficients are adjusted to fit the test conditions. This is a consequence of underestimates of the dissipative energy for the conditions studied.

  2. The Dynamics of Flat Surface Internal Geophysical Waves with Currents

    NASA Astrophysics Data System (ADS)

    Compelli, Alan; Ivanov, Rossen I.

    2016-08-01

    A two-dimensional water wave system is examined consisting of two discrete incompressible fluid domains separated by a free common interface. In a geophysical context this is a model of an internal wave, formed at a pycnocline or thermocline in the ocean. The system is considered as being bounded at the bottom and top by a flatbed and wave-free surface respectively. A current profile with depth-dependent currents in each domain is considered. The Hamiltonian of the system is determined and expressed in terms of canonical wave-related variables. Limiting behaviour is examined and compared to that of other known models. The linearised equations as well as long-wave approximations are presented.

  3. Dynamic potential and surface morphology study of sertraline membrane sensors

    PubMed Central

    Khater, M.M.; Issa, Y.M.; Hassib, H.B.; Mohammed, S.H.

    2014-01-01

    New rapid, sensitive and simple electrometric method was developed to determine sertraline hydrochloride (Ser-Cl) in its pure raw material and pharmaceutical formulations. Membrane sensors based on heteropolyacids as ion associating material were prepared. Silicomolybdic acid (SMA), silicotungstic acid (STA) and phosphomolybdic acid (PMA) were used. The slope and limit of detection are 50.00, 60.00 and 53.24 mV/decade and 2.51, 5.62 and 4.85 μmol L−1 for Ser-ST, Ser-PM and Ser-SM membrane sensors, respectively. Linear range is 0.01–10.00 for the three sensors. These new sensors were used for the potentiometric titration of Ser-Cl using sodium tetraphenylborate as titrant. The surface morphologies of the prepared membranes with and without the modifier (ion-associate) were studied using scanning and atomic force microscopes. PMID:26257944

  4. Response Surface Analysis of Crowd Dynamics during Tawaf

    NASA Astrophysics Data System (ADS)

    Zarita, Zainuddin; Lim Eng, Aik

    2012-07-01

    A refined cellular automata model is applied to simulate the crowd movement of Muslim pilgrims performing the Tawaf ritual within the Al-Haram Mosque in Mecca. The results from the simulation are obtained and the influence of the predictor variables of the evacuation process (pedestrian flow and Tawaf duration) on the responses (pedestrian density, average walking speed, and cumulative evacuee) is investigated using response surface methodology (RSM). The average results from the experiments with an rms error less than 0.5 are obtained from the RSM. Its performance indicates that the RSM possesses excellent predictive ability for the model evacuation study, because both the experimental and the predicted values agree well with the results obtained in this study.

  5. Surface wave dynamics in orbital shaken cylindrical containers

    NASA Astrophysics Data System (ADS)

    Reclari, M.; Dreyer, M.; Tissot, S.; Obreschkow, D.; Wurm, F. M.; Farhat, M.

    2014-05-01

    Be it to aerate a glass of wine before tasting, to accelerate a chemical reaction, or to cultivate cells in suspension, the "swirling" (or orbital shaking) of a container ensures good mixing and gas exchange in an efficient and simple way. Despite being used in a large range of applications this intuitive motion is far from being understood and presents a richness of patterns and behaviors which has not yet been reported. The present research charts the evolution of the waves with the operating parameters identifying a large variety of patterns, ranging from single and multiple crested waves to breaking waves. Free surface and velocity fields measurements are compared to a potential sloshing model, highlighting the existence of various flow regimes. Our research assesses the importance of the modal response of the shaken liquids, laying the foundations for a rigorous mixing optimization of the orbital agitation in its applications.

  6. Investigation of the static and dynamic fragmentation of metallic liquid sheets induced by random surface fluctuations

    NASA Astrophysics Data System (ADS)

    Durand, O.; Soulard, L.; Bourasseau, E.; Filippini, G.

    2016-07-01

    We perform molecular dynamics simulations to investigate the static and dynamic fragmentation of metallic liquid sheets of tin induced by random surface fluctuations. The static regime is analyzed by simulating sheets of different thicknesses, and the dynamic fragmentation is ensured by applying along the longitudinal direction of a sheet an instantaneous expansion velocity per initial unit length (expansion rate) with values ranging from 1 × 109 to 3 × 1010 s-1. The simulations show that the static/dynamic fragmentation becomes possible when the fluctuations of the upper and lower surfaces of the sheets can either overlap or make the local volume density of the system go down below a critical value. These two mechanisms cause locally in the sheet the random nucleation of pores of void, on a timescale that exponentially increases with the sheet thickness. Afterwards, the pores develop following distinct stages of growth, coalescence, and percolation, and later in time aggregates of liquid metal are formed. The simulations also show that the fragmentation of static sheets is characterized by relatively mono-dispersed surface and volume distributions of the pores and aggregates, respectively, whereas in extreme conditions of dynamic fragmentation (expansion rate typically in the range of 1 × 1010 s-1), the distributions are rather poly-dispersed and obey a power law decay with surface (volume). A model derived from the simulations suggests that both dynamic and static regimes of fragmentation are similar for expansion rates below typically 1 × 107 s-1.

  7. Splash Dynamics of Watercolors on Dry, Wet, and Cooled Surfaces

    NASA Astrophysics Data System (ADS)

    Baron, David; Vaidya, Ashwin; Su, Haiyan

    2015-11-01

    In his classic study in 1908, A.M. Worthington gave a thorough account of splashes and their formation through visualization experiments. In more recent times, there has been renewed interest in this subject, and much of the underlying physics behind Worthington's experiments has now been clarified. One specific set of such recent studies, which motivates this paper, concerns the fluid dynamics behind Jackson Pollock's drip paintings. The physical processes and the mathematical structures hidden in his works have received serious attention and made the scientific pursuit of art a compelling area of exploration. Our work explores the interaction of watercolors with watercolor paper. Specifically, we conduct experiments to analyze the settling patterns of droplets of watercolor paint on wet and frozen paper. Variations in paint viscosity, paper roughness, paper temperature, and the height of a released droplet are examined from time of impact, through its transient stages, until its final, dry state. Observable phenomena such as paint splashing, spreading, fingering, branching, rheological deposition, and fractal patterns are studied in detail and classified in terms of the control parameters.

  8. Medium- and long-term results of high tibial osteotomy using Garches external fixator and gait analysis for dynamic correction in varus osteoarthritis of the knee.

    PubMed

    McClelland, D; Barlow, D; Moores, T S; Wynn-Jones, C; Griffiths, D; Ogrodnik, P J; Thomas, P B M

    2016-05-01

    In arthritis of the varus knee, a high tibial osteotomy (HTO) redistributes load from the diseased medial compartment to the unaffected lateral compartment. We report the outcome of 36 patients (33 men and three women) with 42 varus, arthritic knees who underwent HTO and dynamic correction using a Garches external fixator until they felt that normal alignment had been restored. The mean age of the patients was 54.11 years (34 to 68). Normal alignment was achieved at a mean 5.5 weeks (3 to 10) post-operatively. Radiographs, gait analysis and visual analogue scores for pain were measured pre- and post-operatively, at one year and at medium-term follow-up (mean six years; 2 to 10). Failure was defined as conversion to knee arthroplasty. Pre-operative gait analysis divided the 42 knees into two equal groups with high (17 patients) or low (19 patients) adductor moments. After correction, a statistically significant (p < 0.001, t-test,) change in adductor moment was achieved and maintained in both groups, with a rate of failure of three knees (7.1%), and 89% (95% confidence interval (CI) 84.9 to 94.7) survivorship at medium-term follow-up. At final follow-up, after a mean of 15.9 years (12 to 20), there was a survivorship of 59% (95% CI 59.6 to 68.9) irrespective of adductor moment group, with a mean time to conversion to knee arthroplasty of 9.5 years (3 to 18; 95% confidence interval ± 2.5). HTO remains a useful option in the medium-term for the treatment of medial compartment osteoarthritis of the knee but does not last in the long-term. Cite this article: Bone Joint J 2016;98-B:601-7. PMID:27143729

  9. Advancements in medium and high resolution Earth observation for land-surface imaging: Evolutions, future trends and contributions to sustainable development

    NASA Astrophysics Data System (ADS)

    Ouma, Yashon O.

    2016-01-01

    Technologies for imaging the surface of the Earth, through satellite based Earth observations (EO) have enormously evolved over the past 50 years. The trends are likely to evolve further as the user community increases and their awareness and demands for EO data also increases. In this review paper, a development trend on EO imaging systems is presented with the objective of deriving the evolving patterns for the EO user community. From the review and analysis of medium-to-high resolution EO-based land-surface sensor missions, it is observed that there is a predictive pattern in the EO evolution trends such that every 10-15 years, more sophisticated EO imaging systems with application specific capabilities are seen to emerge. Such new systems, as determined in this review, are likely to comprise of agile and small payload-mass EO land surface imaging satellites with the ability for high velocity data transmission and huge volumes of spatial, spectral, temporal and radiometric resolution data. This availability of data will magnify the phenomenon of "Big Data" in Earth observation. Because of the "Big Data" issue, new computing and processing platforms such as telegeoprocessing and grid-computing are expected to be incorporated in EO data processing and distribution networks. In general, it is observed that the demand for EO is growing exponentially as the application and cost-benefits are being recognized in support of resource management.

  10. A medium-bright quasar sample - New quasar surface densities in the magnitude range from 16.4 to 17.65 for B

    NASA Technical Reports Server (NTRS)

    Mitchell, K. J.; Warnock, A., III; Usher, P. D.

    1984-01-01

    A new medium-bright quasar sample (MBQS) is constructed from spectroscopic observations of 140 bright objects selected for varying degrees of blue and ultraviolet excess (B-UVX) in five Palomar 1.2 m Schmidt fields. The MBQS contains 32 quasars with B less than 17.65 mag. The new integral surface densities in the B range from 16.45 to 17.65 mag are approximately 40 percent (or more) higher than expected. The MBQS and its redshift distribution increase the area of the Hubble diagram covered by complete samples of quasars. The general spectroscopic results indicate that the three-color classification process used to catalog the spectroscopic candidates (1) has efficiently separated the intrinsically B-UVX stellar objects from the Population II subdwarfs and (2) has produced samples of B-UVX objects which are more complete than samples selected by (U - B) color alone.

  11. Molecular Dynamics Simulations of Uranyl and Uranyl Carbonate Adsorption at Alumino-silicate Surfaces

    SciTech Connect

    Kerisit, Sebastien N.; Liu, Chongxuan

    2014-03-03

    Adsorption at mineral surfaces is a critical factor controlling the mobility of uranium(VI) in aqueous environments. Therefore, molecular dynamics (MD) simulations were performed to investigate uranyl(VI) adsorption onto two neutral alumino-silicate surfaces, namely the orthoclase (001) surface and the octahedral aluminum sheet of the kaolinite (001) surface. Although uranyl preferentially adsorbed as a bi-dentate innersphere complex on both surfaces, the free energy of adsorption at the orthoclase surface (-15 kcal mol-1) was significantly more favorable than that at the kaolinite surface (-3 kcal mol-1), which was attributed to differences in surface functional groups and to the ability of the orthoclase surface to dissolve a surface potassium ion upon uranyl adsorption. The structures of the adsorbed complexes compared favorably with X-ray absorption spectroscopy results. Simulations of the adsorption of uranyl complexes with up to three carbonate ligands revealed that uranyl complexes coordinated to up to 2 carbonate ions are stable on the orthoclase surface whereas uranyl carbonate surface complexes are unfavored at the kaolinite surface. Combining the MD-derived equilibrium adsorption constants for orthoclase with aqueous equilibrium constants for uranyl carbonate species indicates the presence of adsorbed uranium complexes with one or two carbonates in alkaline conditions, in support of current uranium(VI) surface complexation models.

  12. Gallium surface diffusion on GaAs (001) surfaces measured by crystallization dynamics of Ga droplets

    SciTech Connect

    Bietti, Sergio Somaschini, Claudio; Esposito, Luca; Sanguinetti, Stefano; Fedorov, Alexey

    2014-09-21

    We present accurate measurements of Ga cation surface diffusion on GaAs surfaces. The measurement method relies on atomic force microscopy measurement of the morphology of nano–disks that evolve, under group V supply, from nanoscale group III droplets, earlier deposited on the substrate surface. The dependence of the radius of such nano-droplets on crystallization conditions gives direct access to Ga diffusion length. We found an activation energy for Ga on GaAs(001) diffusion E{sub A}=1.31±0.15 eV, a diffusivity prefactor of D₀=0.53(×2.1±1) cm² s⁻¹ that we compare with the values present in literature. The obtained results permit to better understand the fundamental physics governing the motion of group III ad–atoms on III–V crystal surfaces and the fabrication of designable nanostructures.

  13. On the sensitivity of some common metallographic reagents to restoring obliterated marks on medium carbon (0.31% C) steel surfaces.

    PubMed

    Yin, Siaw Hui; Kuppuswamy, R

    2009-01-10

    Chemical etching, which is the most sensitive method to recover obliterated serial numbers on metal surfaces, has been practised quite successfully in forensic science laboratories all over the world. A large number of etchants suitable for particular metal surfaces based on empirical studies is available in the literature. This article reviews the sensitivity and efficacy of some popular etchants for recovering obliterated marks on medium carbon steel (0.31% C with ferrite-pearlite microstructure) used in automobile parts. The experiments involved engraving these carbon steel plates with some alphanumeric characters using a computer controlled machine "Gravograph" and erasing them to several depths below the bottom of their engraving depth. Seven metallographic reagents of which most of them were copper containing compounds were chosen for etching. The erased plates were etched with every one of these etchants using swabbing method. The results have revealed that Fry's reagent comprising cupric chloride 90 g, hydrochloric acid 120 mL and water 100mL provided the necessary contrast and was concluded to be the most sensitive. The same reagent was recommended by earlier workers for revealing strain lines in steel surfaces. Earlier, another reagent containing 5 g copper sulphate, 60 mL water, 30 mL (conc.) ammonium hydroxide, and 60 mL (conc.) hydrochloric acid was proved to be more sensitive to restore erased marks on low carbon steel (0.1% C with ferrite-pearlite structure) [M.A.M. Zaili, R. Kuppuswamy, H. Harun, Restoration of engraved marks on steel surfaces by etching technique, Forensic Sci. Int. 171 (2007) 27-32]. Thus the sensitivity of the etching reagent on steel surfaces appeared to be dependent on the content of carbon in the steel. PMID:19041202

  14. Equilibrium and dynamical properties of polymer chains in random medium filled with randomly distributed nano-sized fillers.

    PubMed

    Li, Chao-Yang; Luo, Meng-Bo; Huang, Jian-Hua; Li, Hong

    2015-12-21

    The effect of randomly distributed nano-sized fillers on the equilibrium and dynamical properties of linear polymers is studied by using off-lattice Monte Carlo simulation. Lennard-Jones interactions between polymers and fillers are considered. Results show that the statistical dimensions and dynamical diffusion of polymer are dependent on the polymer-filler interaction strength εpf. The mean square radius of gyration 〈RG(2)〉 shows a minimum at a critical polymer-filler interaction εpf*. The value of εpf* decreases with the increase in the polymer length or the concentration of fillers. The exponent ν in 〈RG(2)〉 ∼ N(2ν) is a typical value of self-avoiding walking chain at small εpf but it increases sharply to a bigger value at εpf > εpf*. The mean square displacement decreases with the increase in εpf. Moreover, the normal diffusion of the polymer at weak interactions changes to subnormal diffusion at moderate and strong attractions. We find that polymers diffuse in dilute filler regions at weak attraction and diffuse in dense filler regions at strong attraction. PMID:26568204

  15. Transmission-speckle correlation for measuring dynamic deformation of liquid surface

    NASA Astrophysics Data System (ADS)

    Liu, Zhanwei; Guo, Jing; Shi, Wenxiong; Huang, Xianfu; Xie, Huimin

    2015-02-01

    In this paper, a method based on transmission-speckle correlation is proposed for measuring static and dynamic deformation of liquid surface. In the method, a high-speed camera placed vertically above the tested liquid surface is used to observe and record a special speckle pattern put in advance at the bottom of liquid. According to the Snell's law, the deformation of liquid surface will lead to the movement of the transmission-speckles. In terms of this, the quantitative relationship between height changes of liquid surface and the in-plane displacement of transmission-speckles can be deduced. Combining with multi-directional Newton iteration algorithm, the dynamic deformation field of liquid surface can be calculated from the in-plane displacement vector field of transmission-speckle images in different moment using speckle correlation method. The sensitivity of the method in measuring height changes of liquid surface is discussed. In this paper, a validation test to measure the surface morphology of a plano-convex lens demonstrates the feasibility and the effectiveness of the method. In addition, the dynamic deformation and propagation process of ripples in the water surface caused by a droplet were investigated.

  16. The HD molecule in small and medium cages of clathrate hydrates: Quantum dynamics studied by neutron scattering measurements and computation

    SciTech Connect

    Colognesi, Daniele; Celli, Milva; Ulivi, Lorenzo; Powers, Anna; Xu, Minzhong; Bačić, Zlatko

    2014-10-07

    We report inelastic neutron scattering (INS) measurements on molecular hydrogen deuteride (HD) trapped in binary cubic (sII) and hexagonal (sH) clathrate hydrates, performed at low temperature using two different neutron spectrometers in order to probe both energy and momentum transfer. The INS spectra of binary clathrate samples exhibit a rich structure containing sharp bands arising from both the rotational transitions and the rattling modes of the guest molecule. For the clathrates with sII structure, there is a very good agreement with the rigorous fully quantum simulations which account for the subtle effects of the anisotropy, angular and radial, of the host cage on the HD microscopic dynamics. The sH clathrate sample presents a much greater challenge, due to the uncertainties regarding the crystal structure, which is known only for similar crystals with different promoter, but nor for HD (or H{sub 2}) plus methyl tert-butyl ether (MTBE-d12)

  17. The HD molecule in small and medium cages of clathrate hydrates: Quantum dynamics studied by neutron scattering measurements and computation

    NASA Astrophysics Data System (ADS)

    Colognesi, Daniele; Powers, Anna; Celli, Milva; Xu, Minzhong; Bačić, Zlatko; Ulivi, Lorenzo

    2014-10-01

    We report inelastic neutron scattering (INS) measurements on molecular hydrogen deuteride (HD) trapped in binary cubic (sII) and hexagonal (sH) clathrate hydrates, performed at low temperature using two different neutron spectrometers in order to probe both energy and momentum transfer. The INS spectra of binary clathrate samples exhibit a rich structure containing sharp bands arising from both the rotational transitions and the rattling modes of the guest molecule. For the clathrates with sII structure, there is a very good agreement with the rigorous fully quantum simulations which account for the subtle effects of the anisotropy, angular and radial, of the host cage on the HD microscopic dynamics. The sH clathrate sample presents a much greater challenge, due to the uncertainties regarding the crystal structure, which is known only for similar crystals with different promoter, but nor for HD (or H2) plus methyl tert-butyl ether (MTBE-d12).

  18. Vibrational dynamics and surface structure of Bi(111) from helium atom scattering measurements

    NASA Astrophysics Data System (ADS)

    Mayrhofer-Reinhartshuber, M.; Tamtögl, A.; Kraus, P.; Rieder, K. H.; Ernst, W. E.

    2012-03-01

    The Bi(111) surface was studied by elastic scattering of helium atoms at temperatures between 118 and 423 K. The observed diffraction patterns with clear peaks up to third order were used to model the surface corrugation using the eikonal approximation as well as the GR method. Best fit results were obtained with a rather large corrugation height compared to other surfaces with metallic character. The corrugation shows a slight enhancement of the surface electron density in between the positions of the surface atoms. The vibrational dynamics of Bi(111) were investigated by measurements of the Debye-Waller attenuation of the elastic diffraction peaks and a surface Debye temperature of (84 ± 8) K was determined. A decrease of the surface Debye temperature at higher temperatures that was recently observed on Bi nanofilms could not be confirmed in the case of our single-crystal measurements.

  19. Accelerated Molecular Dynamics Study of the Effects of Surface Hydrophilicity on Protein Adsorption.

    PubMed

    Mücksch, Christian; Urbassek, Herbert M

    2016-09-13

    The adsorption of streptavidin is studied on two surfaces, graphite and titanium dioxide, using accelerated molecular dynamics. Adsorption on graphite leads to strong conformational changes while the protein spreads out over the surface. Interestingly, also adsorption on the highly hydrophilic rutile surface induces considerable spreading of the protein. We pin down the cause for this unfolding to the interaction of the protein with the ordered water layers above the rutile surface. For special orientations, the protein penetrates the ordered water layers and comes into direct contact with the surface where the positively charged amino acids settle in places adjacent to the negatively charged top surface atom layer of rutile. We conclude that for both surface materials studied, streptavidin changes its conformation so strongly that it loses its potential for binding biotin. Our results are in good qualitative agreement with available experimental studies. PMID:27533302

  20. Quantum state resolved gas-surface reaction dynamics experiments: a tutorial review.

    PubMed

    Chadwick, Helen; Beck, Rainer D

    2016-07-01

    We present a tutorial review of our quantum state resolved experiments designed to study gas-surface reaction dynamics. The combination of a molecular beam, state specific reactant preparation by infrared laser pumping, and ultrahigh vacuum surface analysis techniques make it possible to study chemical reactivity at the gas-surface interface in unprecedented detail. We describe the experimental techniques used for state specific reactant preparation and for detection of surface bound reaction products developed in our laboratory. Using the example of the reaction of methane on Ni and Pt surfaces, we show how state resolved experiments uncovered clear evidence for vibrational mode specificity and bond selectivity, as well as steric effects in chemisorption reactions. The state resolved experimental data provides valuable benchmarks for comparison with theoretical models for gas-surface reactivity aiding in the development of a detailed microscopic understanding of chemical reactivity at the gas-surface interface. PMID:26235656

  1. Ordering layers of [bmim][PF6] ionic liquid on graphite surfaces: molecular dynamics simulation.

    PubMed

    Maolin, Sha; Fuchun, Zhang; Guozhong, Wu; Haiping, Fang; Chunlei, Wang; Shimou, Chen; Yi, Zhang; Jun, Hu

    2008-04-01

    Microscopic structures of room temperature ionic liquid (IL) [bmim][PF6] on hydrophobic graphite surfaces have been studied in detail by molecular dynamics simulation. It is clearly shown that both the mass and electron densities of the surface adsorbed ionic liquid are oscillatory, and the first peak adjacent to the graphite surface is considerably higher than others, corresponding to a solidlike IL bottom layer of 6 angstroms thick. Three IL layers are indicated between the graphite surface and the inner bulk IL liquid. The individually simulated properties of single-, double-, and triple-IL layers on the graphite surface are very similar to those of the layers between the graphite surface and the bulk liquid, indicating an insignificant effect of vapor-IL interface on the ordered IL layers. The simulation also indicates that the imidazolium ring and butyl tail of the cation (bmim+) of the IL bottom layer lie flat on the graphite surface.

  2. Flow Dynamics and Breakdown of Falling Liquid Films on the Heated Smooth and Structured Surface

    NASA Astrophysics Data System (ADS)

    Pecherkin, N. I.; Pavlenko, A. N.; Volodin, O. A.

    2011-09-01

    This paper presents the experimental results on heat transfer and hydrodynamics of the falling films of binary Freon mixtures on the tubes with smooth and textured surfaces. The range of Re number alteration at the working section inlet was Re = 10-155. The wave surface of the falling liquid film and the process of dry spot formation were recorded by the high-speed digital video camera. Results of investigation of the wave surface structure, measurements of heat transfer coefficients and dynamics of dry spot formation on the heated surface with corresponding critical heat fluxes are shown in this paper.

  3. Dynamic Range of Vertical Cavity Surface Emitting Lasers in Multimode Links

    SciTech Connect

    Lee, H.L.T.; Dalal, R.V.; Ram, R.J.; Choquette, K.D.

    1999-07-07

    The authors report spurious free dynamic range measurements of 850nm vertical cavity surface emitting lasers in short multimode links for radio frequency communication. For a 27m fiber link, the dynamic range at optimal bias was greater than 95dB-Hz{sup 2/3} for modulation frequencies between 1 and 5.5 GHz, which exceeds the requirements for antenna remoting in microcellular networks. In a free space link, they have measured the highest dynamic range in an 850nm vertical cavity surface emitting laser of 113dB-Hz{sup 2/3} at 900MHz. We have also investigated the effects of modal noise and differential mode delay on the dynamic range for longer lengths of fiber.

  4. Rydberg hydrogen atom near a metallic surface: Stark regime and ionization dynamics

    SciTech Connect

    Inarrea, Manuel; Salas, J. Pablo; Lanchares, Victor; Pascual, Ana Isabel; Palacian, Jesus F.; Yanguas, Patricia

    2007-11-15

    We investigate the classical dynamics of a hydrogen atom near a metallic surface in the presence of a uniform electric field. To describe the atom-surface interaction we use a simple electrostatic image model. Owing to the axial symmetry of the system, the z-component of the canonical angular momentum P{sub {phi}} is an integral and the electronic dynamics is modeled by a two degrees of freedom Hamiltonian in cylindrical coordinates. The structure and evolution of the phase space as a function of the electric field strength is explored extensively by means of numerical techniques of continuation of families of periodic orbits and Poincare surfaces of section. We find that, due to the presence of the electric field, the atom is strongly polarized through two consecutive pitchfork bifurcations that strongly change the phase space structure. Finally, by means of the phase space transition state theory and the classical spectral theorem, the ionization dynamics of the atom is studied.

  5. Utilizing dynamic tensiometry to quantify contact angle hysteresis and wetting state transitions on nonwetting surfaces.

    PubMed

    Kleingartner, Justin A; Srinivasan, Siddarth; Mabry, Joseph M; Cohen, Robert E; McKinley, Gareth H

    2013-11-01

    Goniometric techniques traditionally quantify two parameters, the advancing and receding contact angles, that are useful for characterizing the wetting properties of a solid surface; however, dynamic tensiometry, which measures changes in the net force on a surface during the repeated immersion and emersion of a solid into a probe liquid, can provide further insight into the wetting properties of a surface. We detail a framework for analyzing tensiometric results that allows for the determination of wetting hysteresis, wetting state transitions, and characteristic topographical length scales on textured, nonwetting surfaces, in addition to the more traditional measurement of apparent advancing and receding contact angles. Fluorodecyl POSS, a low-surface-energy material, was blended with commercially available poly(methyl methacrylate) (PMMA) and then dip- or spray-coated onto glass substrates. These surfaces were probed with a variety of liquids to illustrate the effects of probe liquid surface tension, solid surface chemistry, and surface texture on the apparent contact angles and wetting hysteresis of nonwetting surfaces. Woven meshes were then used as model structured substrates to add a second, larger length scale for the surface texture. When immersed into a probe liquid, these spray-coated mesh surfaces can form a metastable, solid-liquid-air interface on the largest length scale of surface texture. The increasing hydrostatic pressure associated with progressively greater immersion depths disrupts this metastable, composite interface and forces penetration of the probe liquid into the mesh structure. This transition is marked by a sudden change in the wetting hysteresis, which can be systematically probed using spray-coated, woven meshes of varying wire radius and spacing. We also show that dynamic tensiometry can accurately and quantitatively characterize topographical length scales that are present on microtextured surfaces.

  6. Simulation of dynamic behavior of surfactants on a hydrophobic surface using periodic-shell boundary molecular dynamics.

    PubMed

    Minami, Daiki; Horikoshi, Satoshi; Sakai, Kenichi; Sakai, Hideki; Abe, Masahiko

    2011-01-01

    The adsorption and aggregation behaviors of sodium dodecyl sulfate (SDS) and cetyltrimethylammonium bromide (CTAB) on a hydrophobic graphite surface were examined using a novel molecular dynamics (MD) simulation with the periodic-shell boundary condition (PSBC). Differences in the adsorption behavior of SDS and CTAB molecules were clearly shown on the hydrophobic surface. Unexpectedly, the SDS molecules approached the graphite surface with their hydrophilic head groups. This unexpected approach mode was thought to be due to the aqueous layer on the graphite surface. The hydrophobic moiety of SDS molecules repeatedly adsorbed and desorbed on the graphite surface. In addition, SDS molecules kept moving on the graphite surface; thus, they did not form a stable adsorption layer. In contrast to SDS, the hydrophobic moiety of CTAB molecules approached the graphite surface at the primary step of adsorption. The hydrophobic moieties of CTAB molecules came close to each other, whereas the hydrophilic groups separated from one another. This result suggests that the CTAB molecules form molecular assemblies with a curved structure. The simulation results were consistent with the experimental observations. A clear difference between the adsorption behavior of SDS and CTAB molecules was revealed by MD simulations with PSBC.

  7. Molecular dynamics simulation of surface segregation, diffusion and reaction phenomena in equiatomic Ni-Al systems

    NASA Astrophysics Data System (ADS)

    Evteev, A. V.; Levchenko, E. V.; Belova, I. V.; Murch, G. E.

    2012-12-01

    The molecular dynamics method is used to provide fundamental insights into surface segregation, bulk diffusion and alloying reaction phenomena in equiatomic Ni-Al systems. This knowledge can serve as a guide for the search and development of economic routes for controlling microstructure and properties of the intermetallic compound NiAl. This paper gives an overview of recent molecular dynamics simulations in the area along with other theoretical calculations and experimental measurements.

  8. Molecular dynamics simulation of Cun clusters scattering from a single-crystal Cu (111) surface: The influence of surface structure

    NASA Astrophysics Data System (ADS)

    Xianwen, Luo; Meng, Wang; Bitao, Hu

    2016-02-01

    By performing a molecular dynamics simulation, fragmentation of Cun clusters scattering from a single-crystal Cu (111) surface is studied. The interactions among copper atoms are modeled by tight-binding potential, and the positions of the copper clusters at each time step are calculated by integrating the Newton equations of motion. The percentage of unfragmented clusters depends on the incident velocities, angles of incidence, and surface structure. The influence of surface structure on the fragment distribution is discussed, and the clusters appear to be more stable under an axial channeling condition. The fragment distribution shifting toward the small fragment range for cluster scattering along a random direction is confirmed, indicating that the cluster undergoes more intensive fragmentation. Project supported by the National Natural Science Foundation of China (Grant No. 11405166).

  9. Specific Ions Modulate Diffusion Dynamics of Hydration Water on Lipid Membrane Surfaces

    PubMed Central

    2015-01-01

    Effects of specific ions on the local translational diffusion of water near large hydrophilic lipid vesicle surfaces were measured by Overhauser dynamic nuclear polarization (ODNP). ODNP relies on an unpaired electron spin-containing probe located at molecular or surface sites to report on the dynamics of water protons within ∼10 Å from the spin probe, which give rise to spectral densities for electron–proton cross-relaxation processes in the 10 GHz regime. This pushes nuclear magnetic resonance relaxometry to more than an order of magnitude higher frequencies than conventionally feasible, permitting the measurement of water moving with picosecond to subnanosecond correlation times. Diffusion of water within ∼10 Å of, i.e., up to ∼3 water layers around the spin probes located on hydrophilic lipid vesicle surfaces is ∼5 times retarded compared to the bulk water translational diffusion. This directly reflects on the activation barrier for surface water diffusion, i.e., how tightly water is bound to the hydrophilic surface and surrounding waters. We find this value to be modulated by the presence of specific ions in solution, with its order following the known Hofmeister series. While a molecular description of how ions affect the hydration structure at the hydrophilic surface remains to be answered, the finding that Hofmeister ions directly modulate the surface water diffusivity implies that the strength of the hydrogen bond network of surface hydration water is directly modulated on hydrophilic surfaces. PMID:24456096

  10. Using dynamic interferometric synthetic aperature radar (InSAR) to image fast-moving surface waves

    DOEpatents

    Vincent, Paul

    2005-06-28

    A new differential technique and system for imaging dynamic (fast moving) surface waves using Dynamic Interferometric Synthetic Aperture Radar (InSAR) is introduced. This differential technique and system can sample the fast-moving surface displacement waves from a plurality of moving platform positions in either a repeat-pass single-antenna or a single-pass mode having a single-antenna dual-phase receiver or having dual physically separate antennas, and reconstruct a plurality of phase differentials from a plurality of platform positions to produce a series of desired interferometric images of the fast moving waves.

  11. Linear optical studies of metal surfaces: Diffusion, growth, and surface dynamics

    NASA Astrophysics Data System (ADS)

    Nabighian, Edward Ara

    Through the use of laser-induced thermal desorption, a monolayer density grating is produced on a Ni(111) substrate. Using linear optical diffraction from this grating we monitor surface diffusion. By varying the angular direction of the grating we also monitor the azimuthal dependence of diffusion over 360° rotation. For hydrogen on Ni(111) we measured the diffusion rates from 65 K to 240 K, yielding diffusion rates which vary from 2 × 10 -15 cm2/sec to 2 × 10-7 cm2/sec. The results reveal energies of diffusion in both the classical overbarrier hopping and phonon-assisted quantum regimes. For xenon on Ni(111) we measured the diffusion rates from 30 K to 60 K, yielding diffusion rates which vary from 1.3 × 10-10 cm2/sec to 1 × 10-9 cm2/sec. In the case of xenon diffusion, the results also reveal an unusually low diffusivity. In addition, growth measurements of xenon on Ni(111) were studied from 35 K to 60 K using an optical reflectance difference technique. The growth of xenon was found to change mechanisms as temperature varied. At 35 K xenon grows in 3-dimensional islands (Volmer-Weber growth), at 40 K xenon grows as 2-dimensional islands (Frank van der Merwe growth), and above 60 K xenon grows to a thickness of only one monolayer. We can not only monitor the growth mechanism, but the growth rate as well. Finally we use optical reflectance difference to monitor sputtering and annealing on the Ni(111) substrate. The competing surface roughening of sputtering and surface reordering of annealing was found to follow an Arrhenius form with an activation energy of Ea = 1.1 eV/atom given by direct atom evaporation from step edges. By monitoring the formation of islands and pits on the surface during sputtering at various temperatures we are able to determine that above 823 K the annealing process reorders the surface faster than sputtering can create surface roughness. As temperature decreases we see an increase in island and pit formation due to the lessened

  12. Molecular dynamics simulations of spontaneous spreading of a nanodroplet on solid surfaces

    NASA Astrophysics Data System (ADS)

    Sedighi, Nahid; Murad, Sohail; Aggarwal, Suresh K.

    2011-02-01

    The dynamics of spontaneous spreading of nano-sized droplets on solid surfaces were investigated using molecular dynamics simulations. The spreading behavior was analyzed in terms of the temporal evolution of instantaneous spreading diameter and contact angle for surfaces with different wetting characteristics. The computational model was validated through qualitative comparison with existing numerical and experimental data, including correlations for the variation of dynamic contact angle and spreading diameter. The results indicated that the spreading dynamics are mainly governed by surface and viscous forces. The spontaneous spreading process on a wettable surface can be described by three different stages, namely the initial, intermediate and final stages. The initial stage is characterized by the development of a precursor film, which moves ahead of the droplet, whereas the intermediate and final spreading stages are governed by a balance between surface and viscous forces. Simulations were used to develop correlations for the temporal variation of contact angle and spreading diameter for wettable, partially wettable and non-wettable surfaces. These correlations were found to be closer to those based on the molecular kinetic model than to those based on the hydrodynamic model. The results were further analyzed to obtain correlations for the effect of droplet size on the spreading parameters. These correlations indicated that the normalized spreading diameter and contact angle scale with non-dimensional drop diameter as Dm/D0 propto D0-0.6 ± 0.04 and θR proptoD00.67 ± 0.12 and the normalized spreading time scales as t propto D00.25 ± 0.05. Global surface energy and viscous dissipation energy considerations were used to provide a physical basis for these correlations. Significant differences were observed between the dynamics of spontaneous and forced spreading, especially with respect to the effect of droplet size on the spreading behavior.

  13. The Structure of the Local Interstellar Medium. IV. Dynamics, Morphology, Physical Properties, and Implications of Cloud-Cloud Interactions

    NASA Astrophysics Data System (ADS)

    Redfield, Seth; Linsky, Jeffrey L.

    2008-01-01

    We present an empirical dynamical model of the LISM based on 270 radial velocity measurements for 157 sight lines toward nearby stars. Physical parameter measurements (i.e., temperature, turbulent velocity, depletions) are available for 90 components, or one-third of the sample, enabling initial characterizations of the physical properties of LISM clouds. The model includes 15 warm clouds located within 15 pc of the Sun, each with a different velocity vector. We derive projected morphologies of all clouds and estimate the volume filling factor of warm partially ionized material in the LISM to be between ~5.5% and 19%. Relative velocities of potentially interacting clouds are often supersonic, consistent with heating, turbulent, and metal depletion properties. Cloud-cloud collisions may be responsible for the filamentary morphologies found in ~\\frac{1}{3} of LISM clouds, the distribution of clouds along the boundaries of the two nearest clouds (LIC and G), the detailed shape and heating of the Mic Cloud, the location of nearby radio scintillation screens, and the location of an LISM cold cloud. Contrary to previous claims, the Sun appears to be located in the transition zone between the LIC and G Cloud. Based on observations made with the NASA/ESA Hubble Space Telescope, obtained from the Data Archive at the Space Telescope Science Institute, which is operated by the Association of Universities for Research in Astronomy, Inc., under NASA contract NAS 5-26555. These observations are associated with programs 9525 and 10236.

  14. Molecular dynamics simulation of a single-stranded DNA with heterogeneous distribution of nucleobases in aqueous medium

    NASA Astrophysics Data System (ADS)

    Chakraborty, Kaushik; Mantha, Sriteja; Bandyopadhyay, Sanjoy

    2013-08-01

    The DNA metabolic processes often involve single-stranded DNA (ss-DNA) molecules as important intermediates. In the absence of base complementarity, ss-DNAs are more flexible and interact strongly with water in aqueous media. Ss-DNA-water interactions are expected to control the conformational flexibility of the DNA strand, which in turn should influence the properties of the surrounding water molecules. We have performed room temperature molecular dynamics simulation of an aqueous solution containing the ss-DNA dodecamer, 5'-CGCGAATTCGCG-3'. The conformational flexibility of the DNA strand and the microscopic structure and ordering of water molecules around it have been explored. The simulation reveals transformation of the initial base-stacked form of the ss-DNA to a fluctuating collapsed coil-like conformation with the formation of a few non-sequentially stacked base pairs. A preliminary analysis shows further collapse of the DNA conformation in presence of additional salt (NaCl) due to screening of negative charges along the backbone by excess cations. Additionally, higher packing of water molecules within a short distance from the DNA strand is found to be associated with realignment of water molecules by breaking their regular tetrahedral ordering.

  15. Transverse-mode dynamics in vertical-cavity surface-emitting lasers with optical feedback

    SciTech Connect

    Torre, M.S.; Masoller, C.; Mandel, Paul

    2002-11-01

    We study the transverse-mode dynamics of vertical-cavity surface-emitting lasers with weak optical feedback. We use a model that takes into account the spatial dependence of the transverse modes and of two carrier density profiles, associated with confined carriers in the quantum well region of the laser and unconfined carriers in the barrier region. Optical feedback is included as in the Lang-Kobayashi model. We find that for adequate parameter values antiphase dynamics occurs. As the injection current varies, the antiphase dynamics is destroyed through a sequence of periodic mixed states leading to in-phase dynamics. In these mixed states there are time intervals in which the modes are in phase, followed by time intervals in which they are in antiphase. We study the origin of the antiphase dynamics, assessing the role of the different spatial profiles. We show that the competition between the different profiles leads to the observed antiphase behavior.

  16. Static and dynamic theoretical analyses of a scanning tip on suspended graphene surface

    NASA Astrophysics Data System (ADS)

    Yu, Yan-Zi; Guo, Jian-Gang

    2016-08-01

    Recent research progress shows that graphene exhibits distinct adhesion and friction behaviors. In the paper, the static and dynamic analyses of a diamond tip sliding on suspended graphene surface are conducted via theoretical and numerical research methods, and the adhesion and friction properties between them are investigated. The analytical expression of interaction potential between a diamond tip and graphene surface is derived based on the interatomic pairwise potential, and then, the lateral and normal interaction forces are calculated. The equilibrium heights and adhesion energy of the diamond tip are calculated on three particular sites of graphene surface. The influence of vertical distance between the tip and graphene surface is studied on the maximum static frictional force and initial velocity of tip. What is more, the influence of scanning velocity and damping are also analyzed on the frictional force and dynamic behaviors of the scanning tip, and the "stick-slip" phenomenon is observed and discussed by the numerical calculation.

  17. Non-universality in dynamically triangulated random surfaces with extrinsic curvature

    SciTech Connect

    Baillie, C.F.; Williams, R.D. ); Johnston, D.A. . Dept. of Physics)

    1990-08-30

    Earlier simulations of dynamically triangulated random surfaces with a pure Gaussian (Polyakov) action have suggested that the incorporation of a term which is equivalent to the square of the scalar curvature, R{sup 2}, in the continuum can affect the properties of the surfaces, despite the fact that such a term appears to be irrelevant on dimensional grounds. However, simulations by the current authors and Catterall of dynamically triangulated random surfaces with extrinsic curvature produced essentially identical results despite differing coefficients for the R{sup 2} term. In this paper, the authors show that small (positive or negative) values of this coefficient have little effect but that large values do produce measurable effects. This explains the concordance of our previous results with Catterall's and also provides evidence for nonuniversal behavior in the random surface model.

  18. Medium effects on the nucleation and growth mechanisms during the redox switching dynamics of conducting polymers: case of poly(3,4-ethylenedioxythiophene).

    PubMed

    Randriamahazaka, Hyacinthe; Bonnotte, Thomas; Noël, Vincent; Martin, Pascal; Ghilane, Jalal; Asaka, Kinji; Lacroix, Jean-Christophe

    2011-01-20

    The redox switching dynamics of poly(3,4-ethylenedioxythiophene) (PEDOT) in an acetonitrile solution and a room temperature ionic liquid, 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide (EmiTFSI), are investigated by means of potential step experiments. Redox switching can be viewed as a phase transition in which the nucleation and growth processes occur. We have developed a phenomenological model allowing the determination of the kinetic parameters. Two limiting cases are shown as follows: (i) a progressive and (ii) an instantaneous nucleation. In all cases, the growth process is described in terms of a self-exchange electron transfer reaction. We show that the mechanisms depend upon the medium. In acetonitrile, progressive nucleation and growth occur during oxidation (p-doping), whereas nucleation is instantaneous in the reduction of the PEDOT film. On the other hand, instantaneous nucleation and growth mechanisms are observed for both oxidation and reduction in EmiTFSI. The difference in the mechanisms results from the ionic exchange process associated with electron transfer and the initial structure of the film (open or compact). The influence of the applied potential on the dynamics is analyzed for both media. PMID:21171659

  19. Medium effects on the nucleation and growth mechanisms during the redox switching dynamics of conducting polymers: case of poly(3,4-ethylenedioxythiophene).

    PubMed

    Randriamahazaka, Hyacinthe; Bonnotte, Thomas; Noël, Vincent; Martin, Pascal; Ghilane, Jalal; Asaka, Kinji; Lacroix, Jean-Christophe

    2011-01-20

    The redox switching dynamics of poly(3,4-ethylenedioxythiophene) (PEDOT) in an acetonitrile solution and a room temperature ionic liquid, 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide (EmiTFSI), are investigated by means of potential step experiments. Redox switching can be viewed as a phase transition in which the nucleation and growth processes occur. We have developed a phenomenological model allowing the determination of the kinetic parameters. Two limiting cases are shown as follows: (i) a progressive and (ii) an instantaneous nucleation. In all cases, the growth process is described in terms of a self-exchange electron transfer reaction. We show that the mechanisms depend upon the medium. In acetonitrile, progressive nucleation and growth occur during oxidation (p-doping), whereas nucleation is instantaneous in the reduction of the PEDOT film. On the other hand, instantaneous nucleation and growth mechanisms are observed for both oxidation and reduction in EmiTFSI. The difference in the mechanisms results from the ionic exchange process associated with electron transfer and the initial structure of the film (open or compact). The influence of the applied potential on the dynamics is analyzed for both media.

  20. Theoretical Studies of the Structure and the Dynamics on Clean and Chemisorbed Metal Surfaces

    NASA Astrophysics Data System (ADS)

    Yang, Liqiu

    Molecular dynamics (MD) and lattice dynamics (LD) techniques are employed to investigate several phenomena related to the structure and vibrations at metal surfaces. The MD simulations are performed with the many-body interaction potentials obtained using the Embedded-Atom Method (EAM). As specific examples, we present the results for Ag(100) at 300 K and Cu(100) at 150 K, 300 K, and 600 K. The calculated frequencies and polarizations of all surface modes and resonances at the high-symmetry points in the two-dimensional Brillouin zone are in good agreement with available data, as well as, existing lattice dynamics results with force constants obtained from first-principles calculations. Our calculated surface relaxation is also in reasonable agreement with the data. We also test a much simpler lattice dynamics model with nearest neighbor central force interactions, and conclude that it can reproduce the main features of the phonon modes, but only when adjustable surface parameters are used. Additionally, the temperature dependent studies of the phonon line-widths and the mean-square displacement (MSD) of surface atoms are indicative of enhanced surface anharmonicity. On several chemisorbed metal surfaces, for which force constants are not available from first-principles calculations or the EAM, we perform lattice dynamics studies of phonon dispersion curves using simple force-constant models. These studies provide reliable mean-square displacement of surface atoms and can distinguish between possible reconstruction patterns, the results being insensitive to the exact values of the surface parameters. On c(2 times 2)S-Ni(100), it is found that the parallel component of the mean-square displacement for sulfur is around 50% larger than the vertical component, but for the mean-square displacement of oxygen atoms in the system c(2 times 2)O-Ni(100), the opposite is the case. As regards surface reconstruction, for both p(2 times 1)O-Ag(110) and p(2 times 1)O-Ni(110

  1. Effects of DO levels on surface force, cell membrane properties and microbial community dynamics of activated sludge.

    PubMed

    Ma, Si-Jia; Ding, Li-Li; Huang, Hui; Geng, Jin-Ju; Xu, Ke; Zhang, Yan; Ren, Hong-Qiang

    2016-08-01

    In this paper, we employ atomic force microscopy (AFM), fluorescence recovery after photobleaching (FRAP) technique, phospholipid fatty acids (PLFA) and MiSeq analysis to study the effects of traditional dissolved oxygen (DO) levels (0.71-1.32mg/L, 2.13-3.02mg/L and 4.31-5.16mg/L) on surface force, cell membrane properties and microbial community dynamics of activated sludge. Results showed that low DO level enhanced the surface force and roughness of activated sludge; the medium DO level decreased cell membrane fluidity by reducing the synthesis of branched fatty acids in the cell membrane; high DO level resulted in the highest protein content in the effluent by EEM scanning. Abundance of Micropruina, Zoogloea and Nakamurella increased and Paracoccus and Rudaea decreased with the increase of DO levels. RDA analysis suggested that saturated fatty acids (SFA), anteiso-fatty acids (AFA) and iso-fatty acids (IFA) were closely related to effluent quality as well as some genera. PMID:27187569

  2. Laser-induced damage in biological tissue: Role of complex and dynamic optical properties of the medium

    NASA Astrophysics Data System (ADS)

    Ahmed, Elharith M.

    Since its invention in the early 1960's, the laser has been used as a tool for surgical, therapeutic, and diagnostic purposes. To achieve maximum effectiveness with the greatest margin of safety it is important to understand the mechanisms of light propagation through tissue and how that light affects living cells. Lasers with novel output characteristics for medical and military applications are too often implemented prior to proper evaluation with respect to tissue optical properties and human safety. Therefore, advances in computational models that describe light propagation and the cellular responses to laser exposure, without the use of animal models, are of considerable interest. Here, a physics-based laser-tissue interaction model was developed to predict the spatial and temporal temperature and pressure rise during laser exposure to biological tissues. Our new model also takes into account the dynamic nature of tissue optical properties and their impact on the induced temperature and pressure profiles. The laser-induced retinal damage is attributed to the formation of microbubbles formed around melanosomes in the retinal pigment epithelium (RPE) and the damage mechanism is assumed to be photo-thermal. Selective absorption by melanin creates these bubbles that expand and collapse around melanosomes, destroying cell membranes and killing cells. The Finite Element (FE) approach taken provides suitable ground for modeling localized pigment absorption which leads to a non-uniform temperature distribution within pigmented cells following laser pulse exposure. These hot-spots are sources for localized thermo-elastic stresses which lead to rapid localized expansions that manifest themselves as microbubbles and lead to microcavitations. Model predictions for the interaction of lasers at wavelengths of 193, 694, 532, 590, 1314, 1540, 2000, and 2940 nm with biological tissues were generated and comparisons were made with available experimental data for the retina

  3. INTRODUCTION: Surface Dynamics, Phonons, Adsorbate Vibrations and Diffusion

    NASA Astrophysics Data System (ADS)

    Bruch, L. W.

    2004-07-01

    understanding of the underlying factors determining the optical quality of GaInNAs, such as composition, growth and annealing conditions. We are still far from establishing an understanding of the band structure and its dependence on composition. Fundamental electronic interactions such as electron-electron and electron-phonon scattering, dependence of effective mass on composition, strain and orientation, quantum confinement effects, effects of localized nitrogen states on high field transport and on galvanometric properties, and mechanisms for light emission in these materials, are yet to be fully understood. Nature and formation mechanisms of grown-in and processing-induced defects that are important for material quality and device performance are still unknown. Such knowledge is required in order to design strategies to efficiently control and eliminate harmful defects. For many potential applications (such as solar cells, HBTs) it is essential to get more information on the transport properties of dilute nitride materials. The mobility of minority carriers is known to be low in GaInNAs and related material. The experimental values are far from reaching the theoretical ones, due to defects and impurities introduced in the material during the growth. The role of the material inhomogeneities on the lateral carrier transport also needs further investigation. From the device's point of view most attention to date has been focused on the GaInNAs/GaAs system, mainly because of its potential for optoelectronic devices covering the 1.3-1.55 µm data and telecommunications wavelength bands. As is now widely appreciated, these GaAs-compatible structures allow monolithic integration of AlGaAs-based distributed Bragg reflector mirrors (DBRs) for vertical cavity surface-emitting lasers with low temperature sensitivity and compatibility with AlOx-based confinement techniques. In terms of conventional edge-emitting lasers (EELs), the next step is to extend the wavelength range for cw room

  4. Dynamical resonant electron capture in atom surface collisions: H- formation in H-Al(111) collisions

    NASA Astrophysics Data System (ADS)

    Borisov, A. G.; Teillet-Billy, D.; Gauyacq, J. P.

    1992-05-01

    The formation of H- ion by grazing-angle collisions of hydrogen on an Al(111) surface is investigated with the newly developed coupled angular mode method. The capture process involves a dynamical resonant process induced by the collision velocity. All the resonance properties of the H- level in front of an Al(111) surface are determined: position, width, and angular distribution of ejected electrons. The results are shown to account for the recent observations on H- formation by Wyputta, Zimny, and Winter.

  5. Spin-Dependent Studies of the Dynamics of He+ Ion Neutralization at Surfaces

    NASA Astrophysics Data System (ADS)

    Lancaster, J. C.; Kontur, F. J.; Nordlander, P.; Walters, G. K.; Dunning, F. B.

    2001-05-01

    Spin-labelling techniques, specifically the use of electron-spin-polarized ^4He^+ ions coupled with energy-resolved measurements of the ejected electron polarization, are used to study the dynamics of He^+ neutralization at surfaces. The He^+ ions are produced by Penning ionization in collisions between polarized He(2^3S) metastable atoms contained in a weak rf-excited discharge. Studies of Cu(100), Au(100), Al(100) and sub-monolayer alkali-covered Al(100) surfaces are underway to investigate the role of surface electronic structure, work function and adsorbate coverage in determining the neutralization dynamics. The data for clean surfaces display the same general behavior and reveal a marked correlation in the spins of the electrons involved in Auger neutralization of the He^+ ions. A pronounced energy dependence in the ejected electron polarization also is observed. These results are explained by model calculations which show the presence of the (polarized) He^+ ion leads to strong, spin-dependent perturbations in the local surface electronic structure. Quite different behavior is observed at alkali-covered surfaces, and further work is underway to identify the underlying dynamics.

  6. Impact of a Reducing Agent on the Dynamic Surface Properties of Lysozyme Solutions.

    PubMed

    Tihonov, Michael M; Kim, Viktoria V; Noskov, Boris A

    2016-05-01

    Disulfide bond shuffling in the presence of the reducing agents dithiothreitol (DTT) or β-mercaptoethanol (BME) strongly affects the surface properties of lysozyme solutions. The addition of 0.32 mM DTT substantially alters the kinetic dependencies of the dynamic surface elasticity and surface tension relative to those of pure protein solutions. The significant increase in the dynamic surface elasticity likely relates to the cross-linking between lysozyme molecules and the formation of a dense layer of protein globules stabilized by intermolecular disulfide bonds at the liquid/gas interface. This effect differs from the previously described influence of chaotropic denaturants, such as guanidine hydrochloride (GuHCl) and urea, on the surface properties of lysozyme solutions. If both chaotropic and reducing agents are added to protein solutions simultaneously, their effects become superimposed. In the case of mixed lysozyme/GuHCl/DTT solutions, the dynamic surface elasticity near equilibrium decreases as the GuHCl concentration increases because of the gradual loosening of the cross-linked layer of protein globules but remains much higher than that of lysozyme/GuHCl solutions. PMID:27086995

  7. Communication: Contrasting effects of glycerol and DMSO on lipid membrane surface hydration dynamics and forces.

    PubMed

    Schrader, Alex M; Cheng, Chi-Yuan; Israelachvili, Jacob N; Han, Songi

    2016-07-28

    Glycerol and dimethyl sulfoxide (DMSO) are commonly used cryoprotectants in cellular systems, but due to the challenges of measuring the properties of surface-bound solvent, fundamental questions remain regarding the concentration, interactions, and conformation of these solutes at lipid membrane surfaces. We measured the surface water diffusivity at gel-phase dipalmitoylphosphatidylcholine (DPPC) bilayer surfaces in aqueous solutions containing ≤7.5 mol. % of DMSO or glycerol using Overhauser dynamic nuclear polarization. We found that glycerol similarly affects the diffusivity of water near the bilayer surface and that in the bulk solution (within 20%), while DMSO substantially increases the diffusivity of surface water relative to bulk water. We compare these measurements of water dynamics with those of equilibrium forces between DPPC bilayers in the same solvent mixtures. DMSO greatly decreases the range and magnitude of the repulsive forces between the bilayers, whereas glycerol increases it. We propose that the differences in hydrogen bonding capability of the two solutes leads DMSO to dehydrate the lipid head groups, while glycerol affects surface hydration only as much as it affects the bulk water properties. The results suggest that the mechanism of the two most common cryoprotectants must be fundamentally different: in the case of DMSO by decoupling the solvent from the lipid surface, and in the case of glycerol by altering the hydrogen bond structure and intermolecular cohesion of the global solvent, as manifested by increased solvent viscosity.

  8. Surface of a calcium aluminosilicate glass by classical and ab initio molecular dynamics simulations

    NASA Astrophysics Data System (ADS)

    Ganster, Patrick; Benoit, Magali; Delaye, Jean-Marc; Kob, Walter

    We present the structural properties of thin films of a calcium aluminosilicate glass generated by classical molecular dynamics (MD). The films are generated by two methods: in the first, the films are created in the liquid state and quenched to 300 K; in the second, the films are generated at room temperature. Depending on the method, film thickness and surface roughness are different but the main structural characteristics of the films are similar. The atomic concentration appears to be inhomogeneous from the center of the films to the surface and new structural entities are present at the film surfaces. The surfaces are depleted in calcium atoms and are enriched in aluminum atoms. This atomic arrangement induces a de-polymerized area under the surface. At the surface, all structural properties are modified in comparison with those of the bulk: interatomic distances, angular distributions, ring size, coordinations. In order to confirm the surface properties, we relaxed a surface using ab initio molecular dynamics. Some modifications appear but they do not significantly change the results obtained by classical MD, validating the use of interatomic potentials for the study of such films.

  9. Communication: Contrasting effects of glycerol and DMSO on lipid membrane surface hydration dynamics and forces

    PubMed Central

    Schrader, Alex M.; Cheng, Chi-Yuan; Han, Songi

    2016-01-01

    Glycerol and dimethyl sulfoxide (DMSO) are commonly used cryoprotectants in cellular systems, but due to the challenges of measuring the properties of surface-bound solvent, fundamental questions remain regarding the concentration, interactions, and conformation of these solutes at lipid membrane surfaces. We measured the surface water diffusivity at gel-phase dipalmitoylphosphatidylcholine (DPPC) bilayer surfaces in aqueous solutions containing ≤7.5 mol. % of DMSO or glycerol using Overhauser dynamic nuclear polarization. We found that glycerol similarly affects the diffusivity of water near the bilayer surface and that in the bulk solution (within 20%), while DMSO substantially increases the diffusivity of surface water relative to bulk water. We compare these measurements of water dynamics with those of equilibrium forces between DPPC bilayers in the same solvent mixtures. DMSO greatly decreases the range and magnitude of the repulsive forces between the bilayers, whereas glycerol increases it. We propose that the differences in hydrogen bonding capability of the two solutes leads DMSO to dehydrate the lipid head groups, while glycerol affects surface hydration only as much as it affects the bulk water properties. The results suggest that the mechanism of the two most common cryoprotectants must be fundamentally different: in the case of DMSO by decoupling the solvent from the lipid surface, and in the case of glycerol by altering the hydrogen bond structure and intermolecular cohesion of the global solvent, as manifested by increased solvent viscosity. PMID:27475340

  10. Communication: Contrasting effects of glycerol and DMSO on lipid membrane surface hydration dynamics and forces

    NASA Astrophysics Data System (ADS)

    Schrader, Alex M.; Cheng, Chi-Yuan; Israelachvili, Jacob N.; Han, Songi

    2016-07-01

    Glycerol and dimethyl sulfoxide (DMSO) are commonly used cryoprotectants in cellular systems, but due to the challenges of measuring the properties of surface-bound solvent, fundamental questions remain regarding the concentration, interactions, and conformation of these solutes at lipid membrane surfaces. We measured the surface water diffusivity at gel-phase dipalmitoylphosphatidylcholine (DPPC) bilayer surfaces in aqueous solutions containing ≤7.5 mol. % of DMSO or glycerol using Overhauser dynamic nuclear polarization. We found that glycerol similarly affects the diffusivity of water near the bilayer surface and that in the bulk solution (within 20%), while DMSO substantially increases the diffusivity of surface water relative to bulk water. We compare these measurements of water dynamics with those of equilibrium forces between DPPC bilayers in the same solvent mixtures. DMSO greatly decreases the range and magnitude of the repulsive forces between the bilayers, whereas glycerol increases it. We propose that the differences in hydrogen bonding capability of the two solutes leads DMSO to dehydrate the lipid head groups, while glycerol affects surface hydration only as much as it affects the bulk water properties. The results suggest that the mechanism of the two most common cryoprotectants must be fundamentally different: in the case of DMSO by decoupling the solvent from the lipid surface, and in the case of glycerol by altering the hydrogen bond structure and intermolecular cohesion of the global solvent, as manifested by increased solvent viscosity.

  11. Communication: Contrasting effects of glycerol and DMSO on lipid membrane surface hydration dynamics and forces.

    PubMed

    Schrader, Alex M; Cheng, Chi-Yuan; Israelachvili, Jacob N; Han, Songi

    2016-07-28

    Glycerol and dimethyl sulfoxide (DMSO) are commonly used cryoprotectants in cellular systems, but due to the challenges of measuring the properties of surface-bound solvent, fundamental questions remain regarding the concentration, interactions, and conformation of these solutes at lipid membrane surfaces. We measured the surface water diffusivity at gel-phase dipalmitoylphosphatidylcholine (DPPC) bilayer surfaces in aqueous solutions containing ≤7.5 mol. % of DMSO or glycerol using Overhauser dynamic nuclear polarization. We found that glycerol similarly affects the diffusivity of water near the bilayer surface and that in the bulk solution (within 20%), while DMSO substantially increases the diffusivity of surface water relative to bulk water. We compare these measurements of water dynamics with those of equilibrium forces between DPPC bilayers in the same solvent mixtures. DMSO greatly decreases the range and magnitude of the repulsive forces between the bilayers, whereas glycerol increases it. We propose that the differences in hydrogen bonding capability of the two solutes leads DMSO to dehydrate the lipid head groups, while glycerol affects surface hydration only as much as it affects the bulk water properties. The results suggest that the mechanism of the two most common cryoprotectants must be fundamentally different: in the case of DMSO by decoupling the solvent from the lipid surface, and in the case of glycerol by altering the hydrogen bond structure and intermolecular cohesion of the global solvent, as manifested by increased solvent viscosity. PMID:27475340

  12. Microscopic bio-corrosion evaluations of magnesium surfaces in static and dynamic conditions.

    PubMed

    Bontrager, J; Mahapatro, A; Gomes, A S

    2014-08-01

    Biodegradable materials including biodegradable metals are continuously being investigated for the development of next generation cardiovascular stents. Predictive in vitro tests are needed that could evaluate potential materials while simulating in vivo conditions. In this manuscript we report the microscopic bio-corrosion evaluations of magnesium surfaces in static and dynamic conditions. A corrosion test bench was designed and fabricated and static and dynamic corrosion tests were carried out with samples of magnesium alloy. The fluid wall shear stress equation and the Churchill's friction factor equation were used to calculate the fluid velocity required to generate the desired shear stress on samples in the test bench. Static and dynamic corrosion tests at 24 and 72 h were carried out at 0.88 Pa shear stress mimicking the in vivo shear stress. Microscopic evaluations of the corroded surfaces were carried out by optical, scanning electron microscopy and energy dispersive X-ray spectroscopy to evaluate the corrosion behaviour and surface properties of the test samples. The surface and interface analysis of magnesium samples post test indicated that dynamic conditions prevented the build-up of corrosion by-products on the sample surface and the corrosion mechanism was uniform as compared to static conditions. The use of a masking element to restrict the exposed area of the sample didn't result in increased corrosion at the boundary. Thus, we have demonstrated the feasibility of the designed test bench as a viable method for bio-corrosion surface analysis under dynamic corrosion conditions for potential biodegradable cardiovascular stent materials.

  13. Translating human embryonic stem cells from 2-dimensional to 3-dimensional cultures in a defined medium on laminin- and vitronectin-coated surfaces.

    PubMed

    Heng, Boon Chin; Li, Jian; Chen, Allen Kuan-Liang; Reuveny, Shaul; Cool, Simon M; Birch, William R; Oh, Steve Kah-Weng

    2012-07-01

    While defining the environment for human embryonic stem cell (hESC) culture on 2-dimensional (2D) surfaces has made rapid progress, the industrial-scale implementation of this technology will benefit from translating this knowledge into a 3-dimensional (3D) system, thus enabling better control, automation, and volumetric scale-up in bioreactors. The current study describes a system with defined conditions that are capable of supporting the long-term 2D culture of hESCs and the transposing of these conditions to 3D microcarrier (MC) cultures. Vitronectin (VN) and laminin (LN) were chosen as matrices for the long-term propagation of hESCs in a defined culture medium (STEMPRO(®)) for conventional 2D culture. Adsorption of these proteins onto 2D tissue culture polystyrene (TCPS) indicated that surface density saturation of 510 and 850 ng/cm(2) for VN and LN, respectively, was attained above 20 μg/mL deposition solution concentration. Adsorption of these proteins onto spherical (97±10 μm), polystyrene MC followed a similar trend and coating surface densities of 450 and 650 ng/cm(2) for VN and LN, respectively, were used to support hESC propagation. The long-term expansion of hESCs was equally successful on TCPS and MC, with consistently high expression (>90%) of pluripotent markers (OCT-4, MAB-84, and TRA-1-60) over 20 passages and maintenance of karyotypic normality. The average fold increase in cell numbers on VN-coated MC per serial passage was 8.5±1.0, which was similar to LN-coated MC (8.5±0.9). Embryoid body differentiation assays and teratoma formation confirmed that hESCs retained the ability to differentiate into lineages of all 3 germ layers, thus demonstrating the first translation to a fully defined MC-based environment for the expansion of hESCs.

  14. The dynamics of under surface condensed substance irradiated by intense energy stream

    SciTech Connect

    Volkov, N. B.; Leyvi, A. Ya.; Mayer, A. E.; Yalovets, A. P.; Talala, K. A.

    2006-08-03

    The new method for simulation of dynamics of target surface irradiated by electron beams. There are two irradiation regimes: precritical and supercritical. We have conducted the research of crater formation for different beam parameters. Also 3D calculations of crater interaction and evolution of craters from initial irregular perturbation are carried out.

  15. Fluid dynamics and noise in bacterial cell–cell and cell–surface scattering

    PubMed Central

    Drescher, Knut; Dunkel, Jörn; Cisneros, Luis H.; Ganguly, Sujoy; Goldstein, Raymond E.

    2011-01-01

    Bacterial processes ranging from gene expression to motility and biofilm formation are constantly challenged by internal and external noise. While the importance of stochastic fluctuations has been appreciated for chemotaxis, it is currently believed that deterministic long-range fluid dynamical effects govern cell–cell and cell–surface scattering—the elementary events that lead to swarming and collective swimming in active suspensions and to the formation of biofilms. Here, we report direct measurements of the bacterial flow field generated by individual swimming Escherichia coli both far from and near to a solid surface. These experiments allowed us to examine the relative importance of fluid dynamics and rotational diffusion for bacteria. For cell–cell interactions it is shown that thermal and intrinsic stochasticity drown the effects of long-range fluid dynamics, implying that physical interactions between bacteria are determined by steric collisions and near-field lubrication forces. This dominance of short-range forces closely links collective motion in bacterial suspensions to self-organization in driven granular systems, assemblages of biofilaments, and animal flocks. For the scattering of bacteria with surfaces, long-range fluid dynamical interactions are also shown to be negligible before collisions; however, once the bacterium swims along the surface within a few microns after an aligning collision, hydrodynamic effects can contribute to the experimentally observed, long residence times. Because these results are based on purely mechanical properties, they apply to a wide range of microorganisms. PMID:21690349

  16. Transverse Mode Dynamics and Ultrafast Modulation of Vertical-Cavity Surface-Emitting Lasers

    NASA Technical Reports Server (NTRS)

    Ning, Cun-Zheng; Biegel, Bryan A. (Technical Monitor)

    2002-01-01

    We show that multiple transverse mode dynamics of VCSELs (Vertical-Cavity Surface-Emitting Lasers) can be utilized to generate ultrafast intensity modulation at a frequency over 100 GHz, much higher than the relaxation oscillation frequency. Such multimode beating can be greatly enhanced by taking laser output from part of the output facet.

  17. Elasto-dynamic analysis of spinning nanodisks via a surface energy-based model

    NASA Astrophysics Data System (ADS)

    Kiani, Keivan

    2016-07-01

    Using the surface elasticity theory of Gurtin and Murdoch, in-plane vibrations of annular nanodisks due to their rotary motion are explored. By the imposition of non-classical boundary conditions on the innermost and outermost surfaces and employing Hamilton’s principle, the unknown elasto-dynamic fields of the bulk zone are determined via the finite element method. The roles of both nanodisk geometry and surface effect on the natural frequencies are addressed. Subsequently, forced vibrations of spinning nanodisks with fixed-free and free-free boundary conditions are comprehensively examined. The obtained results show that the maximum dynamic elastic fields grow in a parabolic manner as the steady angular velocity increases. By increasing the outermost radius, the maximum dynamic elastic field is magnified and the influence of the surface effect on the results reduced. This work can be considered as a pivotal step towards optimal design and dynamic analysis of nanorotors with disk-like parts, which are one of the basic building blocks of the upcoming advanced nanotechnologies.

  18. Dynamic Image Forces Near a Metal Surface and the Point-Charge Motion

    ERIC Educational Resources Information Center

    Gabovich, A. M.; Voitenko, A. I.

    2012-01-01

    The problem of charge motion governed by image force attraction near a plane metal surface is considered and solved self-consistently. The temporal dispersion of metal dielectric permittivity makes the image forces dynamic and, hence, finite, contrary to the results of the conventional approach. Therefore, the maximal attainable velocity turns out…

  19. Dynamics of formation of Ru, Os, Ir and Au metal nanocrystals on doped graphitic surfaces.

    PubMed

    Pitto-Barry, Anaïs; Sadler, Peter J; Barry, Nicolas P E

    2016-03-11

    The fabrication of precious metal (ruthenium, osmium, gold, and iridium) nanocrystals from single atoms has been studied in real-time. The dynamics of the first stage of the metal nanocrystallisation on a doped (B,S)-graphitic surface are identified, captured, and reported. PMID:26698913

  20. Elasto-dynamic analysis of spinning nanodisks via a surface energy-based model

    NASA Astrophysics Data System (ADS)

    Kiani, Keivan

    2016-07-01

    Using the surface elasticity theory of Gurtin and Murdoch, in-plane vibrations of annular nanodisks due to the