Science.gov

Sample records for advection dispersion sorption

  1. Numerical simulation of advective-dispersive multisolute transport with sorption, ion exchange and equilibrium chemistry

    USGS Publications Warehouse

    Lewis, F.M.; Voss, C.I.; Rubin, Jacob

    1986-01-01

    A model was developed that can simulate the effect of certain chemical and sorption reactions simultaneously among solutes involved in advective-dispersive transport through porous media. The model is based on a methodology that utilizes physical-chemical relationships in the development of the basic solute mass-balance equations; however, the form of these equations allows their solution to be obtained by methods that do not depend on the chemical processes. The chemical environment is governed by the condition of local chemical equilibrium, and may be defined either by the linear sorption of a single species and two soluble complexation reactions which also involve that species, or binary ion exchange and one complexation reaction involving a common ion. Partial differential equations that describe solute mass balance entirely in the liquid phase are developed for each tenad (a chemical entity whose total mass is independent of the reaction process) in terms of their total dissolved concentration. These equations are solved numerically in two dimensions through the modification of an existing groundwater flow/transport computer code. (Author 's abstract)

  2. Coupling the advection-dispersion equation with fully kinetic reversible/irreversible sorption terms to model radiocesium soil profiles in Fukushima Prefecture.

    PubMed

    Kurikami, Hiroshi; Malins, Alex; Takeishi, Minoru; Saito, Kimiaki; Iijima, Kazuki

    2017-02-17

    Radiocesium is an important environmental contaminant in fallout from nuclear reactor accidents and atomic weapons testing. A modified Diffusion-Sorption-Fixation (mDSF) model, based on the advection-dispersion equation, is proposed to describe the vertical migration of radiocesium in soils following fallout. The model introduces kinetics for the reversible binding of radiocesium. We test the model by comparing its results to depth profiles measured in Fukushima Prefecture, Japan, since 2011. The results from the mDSF model are a better fit to the measurement data (as quantified by R(2)) than results from a simple diffusion model and the original DSF model. The introduction of reversible sorption kinetics means that the exponential-shape depth distribution can be reproduced immediately following fallout. The initial relaxation mass depth of the distribution is determined by the diffusion length, which depends on the distribution coefficient, sorption rate and dispersion coefficient. The mDSF model captures the long tails of the radiocesium distribution at large depths, which are caused by different rates for kinetic sorption and desorption. The mDSF model indicates that depth distributions displaying a peak in activity below the surface are possible for soils with high organic matter content at the surface. The mDSF equations thus offers a physical basis for various types of radiocesium depth profiles observed in contaminated environments.

  3. Analytical solution for the advection-dispersion transport equation in layered media

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The advection-dispersion transport equation with first-order decay was solved analytically for multi-layered media using the classic integral transform technique (CITT). The solution procedure used an associated non-self-adjoint advection-diffusion eigenvalue problem that had the same form and coef...

  4. AN EXACT PEAK CAPTURING AND OSCILLATION-FREE SCHEME TO SOLVE ADVECTION-DISPERSION TRANSPORT EQUATIONS

    EPA Science Inventory

    An exact peak capturing and essentially oscillation-free (EPCOF) algorithm, consisting of advection-dispersion decoupling, backward method of characteristics, forward node tracking, and adaptive local grid refinement, is developed to solve transport equations. This algorithm repr...

  5. Environmental dispersion in a tidal wetland with sorption by vegetation

    NASA Astrophysics Data System (ADS)

    Wang, Ping; Chen, G. Q.

    2015-05-01

    Understanding of the solute transport mechanism under the effect of sorption by vegetation in tidal wetland gains its significance for environmental and ecological management. Presented in this paper is a theoretical analysis of effective environmental dispersion in a depth-dominated tidal wetland. Based on the transport in porous media, a linear sorption isotherm model is adopted to account for the sorption by vegetation, and two models for momentum and concentration transport in wetlands are given, respectively. The velocity of flow forced by oscillating pressure is derived, and the effect of dimensionless parameters on velocity pulsation is analyzed. The velocity direction may reverse in the case of pulsation amplitude larger than the mean velocity. Using Aris's method of concentration moments, we investigate the effective environmental dispersivity and concentration distribution. The effective environmental dispersivity increases over time at the initial stage to attain a steady oscillating status, the growth rate of which depends on the distribution coefficient KD . The variations of concentration distribution with typical dimensionless parameters are determined, which turn out to be consistent with those of dispersivity. The sorption by vegetation leads to lowered concentration and delayed contaminant cloud, contributing to the dispersion.

  6. Exact analytical solutions for contaminant transport in rivers 1. The equilibrium advection-dispersion equation

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Analytical solutions of the advection-dispersion equation and related models are indispensable for predicting or analyzing contaminant transport processes in streams and rivers, as well as in other surface water bodies. Many useful analytical solutions originated in disciplines other than surface-w...

  7. A novel method for analytically solving a radial advection-dispersion equation

    NASA Astrophysics Data System (ADS)

    Lai, Keng-Hsin; Liu, Chen-Wuing; Liang, Ching-Ping; Chen, Jui-Sheng; Sie, Bing-Ruei

    2016-11-01

    An analytical solution for solute transport in a radial flow field has a variety of practical applications in the study of the transport in push-pull/divergent/convergent flow tracer tests, aquifer remediation by pumping and aquifer storage and recovery. However, an analytical solution for radial advective-dispersive transport has been proven very difficult to develop and relatively few in subsurface hydrology have made efforts to do so, because variable coefficients in the governing partial differential equations. Most of the solutions for radial advective-dispersive transport presented in the literature have generally been solved semi-analytically with the final concentration values being obtained with the help of a numerical Laplace inversion. This study presents a novel solution strategy for analytically solving the radial advective-dispersive transport problem. A Laplace transform with respect to the time variable and a generalized integral transform technique with respect to the spatial variable are first performed to convert the transient governing partial differential equations into an algebraic equation. Subsequently, the algebraic equation is solved using simple algebraic manipulations, easily yielding the solution in the transformed domain. The solution in the original domain is ultimately obtained by successive applications of the Laplace and corresponding generalized integral transform inversions. A convergent flow tracer test is used to demonstrate the robustness of the proposed method for deriving an exact analytical solution to the radial advective-dispersive transport problem. The developed analytical solution is verified against a semi-analytical solution taken from the literature. The results show perfect agreement between our exact analytical solution and the semi-analytical solution. The solution method presented in this study can be applied to create more comprehensive analytical models for a great variety of radial advective-dispersive

  8. Analytical solutions of the one-dimensional advection-dispersion solute transport equation subject to time-dependent boundary conditions

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Analytical solutions of the advection-dispersion solute transport equation remain useful for a large number of applications in science and engineering. In this paper we extend the Duhamel theorem, originally established for diffusion type problems, to the case of advective-dispersive transport subj...

  9. Approximate Solution of Time-Fractional Advection-Dispersion Equation via Fractional Variational Iteration Method

    PubMed Central

    İbiş, Birol

    2014-01-01

    This paper aims to obtain the approximate solution of time-fractional advection-dispersion equation (FADE) involving Jumarie's modification of Riemann-Liouville derivative by the fractional variational iteration method (FVIM). FVIM provides an analytical approximate solution in the form of a convergent series. Some examples are given and the results indicate that the FVIM is of high accuracy, more efficient, and more convenient for solving time FADEs. PMID:24578662

  10. Passive advection-dispersion in networks of pipes: Effect of connectivity and relationship to permeability

    NASA Astrophysics Data System (ADS)

    Bernabé, Y.; Wang, Y.; Qi, T.; Li, M.

    2016-02-01

    The main purpose of this work is to investigate the relationship between passive advection-dispersion and permeability in porous materials presumed to be statistically homogeneous at scales larger than the pore scale but smaller than the reservoir scale. We simulated fluid flow through pipe network realizations with different pipe radius distributions and different levels of connectivity. The flow simulations used periodic boundary conditions, allowing monitoring of the advective motion of solute particles in a large periodic array of identical network realizations. In order to simulate dispersion, we assumed that the solute particles obeyed Taylor dispersion in individual pipes. When a particle entered a pipe, a residence time consistent with local Taylor dispersion was randomly assigned to it. When exiting the pipe, the particle randomly proceeded into one of the pipes connected to the original one according to probabilities proportional to the outgoing volumetric flow in each pipe. For each simulation we tracked the motion of at least 6000 solute particles. The mean fluid velocity was 10-3 ms-1, and the distance traveled was on the order of 10 m. Macroscopic dispersion was quantified using the method of moments. Despite differences arising from using different types of lattices (simple cubic, body-centered cubic, and face-centered cubic), a number of general observations were made. Longitudinal dispersion was at least 1 order of magnitude greater than transverse dispersion, and both strongly increased with decreasing pore connectivity and/or pore size variability. In conditions of variable hydraulic radius and fixed pore connectivity and pore size variability, the simulated dispersivities increased as power laws of the hydraulic radius and, consequently, of permeability, in agreement with previously published experimental results. Based on these observations, we were able to resolve some of the complexity of the relationship between dispersivity and permeability.

  11. THE INTERPLAY BETWEEN GEOCHEMICAL REACTIONS AND ADVECTION-DISPERSION IN CONTAMINANT TRANSPORT AT A URANIUM MILL TAILINGS SITE

    EPA Science Inventory

    It is well known that the fate and transport of contaminants in the subsurface are controlled by complex processes including advection, dispersion-diffusion, and chemical reactions. However, the interplay between the physical transport processes and chemical reactions, and their...

  12. Analytical solution for one-dimensional advection-dispersion transport equation with distance-dependent coefficients

    NASA Astrophysics Data System (ADS)

    Pérez Guerrero, J. S.; Skaggs, T. H.

    2010-08-01

    SummaryMathematical models describing contaminant transport in heterogeneous porous media are often formulated as an advection-dispersion transport equation with distance-dependent transport coefficients. In this work, a general analytical solution is presented for the linear, one-dimensional advection-dispersion equation with distance-dependent coefficients. An integrating factor is employed to obtain a transport equation that has a self-adjoint differential operator, and a solution is found using the generalized integral transform technique (GITT). It is demonstrated that an analytical expression for the integrating factor exists for several transport equation formulations of practical importance in groundwater transport modeling. Unlike nearly all solutions available in the literature, the current solution is developed for a finite spatial domain. As an illustration, solutions for the particular case of a linearly increasing dispersivity are developed in detail and results are compared with solutions from the literature. Among other applications, the current analytical solution will be particularly useful for testing or benchmarking numerical transport codes because of the incorporation of a finite spatial domain.

  13. Permeability generation and resetting of tracers during metamorphic fluid flow: implications for advection-dispersion models

    NASA Astrophysics Data System (ADS)

    Cartwright, Ian

    Advection-dispersion fluid flow models implicitly assume that the infiltrating fluid flows through an already fluid-saturated medium. However, whether rocks contain a fluid depends on their reaction history, and whether any initial fluid escapes. The behaviour of different rocks may be illustrated using hypothetical marble compositions. Marbles with diverse chemistries (e.g. calcite + dolomite + quartz) are relatively reactive, and will generally produce a fluid during heating. By contrast, marbles with more restricted chemistries (e.g. calcite + quartz or calcite-only) may not. If the rock is not fluid bearing when fluid infiltration commences, mineralogical reactions may produce a reaction-enhanced permeability in calcite + dolomite + quartz or calcite + quartz, but not in calcite-only marbles. The permeability production controls the pattern of mineralogical, isotopic, and geochemical resetting during fluid flow. Tracers retarded behind the mineralogical fronts will probably be reset as predicted by the advection-dispersion models; however, tracers that are expected to be reset ahead of the mineralogical fronts cannot progress beyond the permeability generating reaction. In the case of very unreactive lithologies (e.g. pure calcite marbles, cherts, and quartzites), the first reaction to affect the rocks may be a metasomatic one ahead of which there is little pervasive resetting of any tracer. Centimetre-scale layering may lead to the formation of self-perpetuating fluid channels in rocks that are not fluid saturated due to the juxtaposition of reactants. Such layered rocks may show patterns of mineralogical resetting that are not predicted by advection-dispersion models. Patterns of mineralogical and isotopic resetting in marbles from a number of terrains, for example: Chillagoe, Marulan South, Reynolds Range (Australia); Adirondack Mountains, Old Woman Mountains, Notch Peak (USA); and Stephen Cross Quarry (Canada) vary as predicted by these models.

  14. Least-Squares Spectral Method for the solution of a fractional advection-dispersion equation

    NASA Astrophysics Data System (ADS)

    Carella, Alfredo Raúl; Dorao, Carlos Alberto

    2013-01-01

    Fractional derivatives provide a general approach for modeling transport phenomena occurring in diverse fields. This article describes a Least Squares Spectral Method for solving advection-dispersion equations using Caputo or Riemann-Liouville fractional derivatives. A Gauss-Lobatto-Jacobi quadrature is implemented to approximate the singularities in the integrands arising from the fractional derivative definition. Exponential convergence rate of the operator is verified when increasing the order of the approximation. Solutions are calculated for fractional-time and fractional-space differential equations. Comparisons with finite difference schemes are included. A significant reduction in storage space is achieved by lowering the resolution requirements in the time coordinate.

  15. Dynamic typology of hydrothermal systems: competing effects of advection, dispersion and reactivity

    NASA Astrophysics Data System (ADS)

    Dolejs, David

    2016-04-01

    Genetic interpretation hydrothermal systems relies on recognition of (i) hydrothermal fluid source, (ii) fluid migration pathways, and (iii) deposition site identified by hydrothermal alteration and/or mineralization. Frequently, only the last object is of interest or accessible to direct observation, but constraints on the fluid source (volume) and pathways can be obtained from evaluation of the time-integrated fluid flux during hydrothermal event. Successful interpretation of the petrological record, that is, progress of alteration reactions, relies on identification of individual contributions arising from solute advection (to the deposition site), its lateral dispersion, and reaction efficiency. Although these terms are all applicable in a mass-conservation relationship within the framework of the transport theory, they are rarely considered simultaneously and their relative magnitudes evaluated. These phenomena operate on variable length and time scales, and may in turn provide insight into the system dynamics such as flow, diffusion and reaction rates, or continuous vs. episodic behavior of hydrothermal events. In addition, here we demonstrate that they also affect estimate of the net fluid flux, frequently by several orders of magnitude. The extent of alteration and mineralization reactions between the hydrothermal fluid and the host environment is determined by: (i) temperature, pressure or any other gradients across the mineralization site, (ii) magnitude of disequilibrium at inflow to the mineralization site, which is related to physico-chemical gradient between the fluid source and the mineralization site, and (iii) chemical redistribution (dispersion) within the mineralization site. We introduce quantitative mass-transport descriptors - Péclet and Damköhler II numbers - to introduce division into dispersion-dominated, advection-dominated and reaction-constrained systems. Dispersive systems are characterized by lateral solute redistribution, driven by

  16. Numerical studies of three-dimensional stochastic Darcy's equation and stochastic advection-diffusion-dispersion equation

    SciTech Connect

    Lin, Guang; Tartakovsky, Alexandre M.

    2010-04-01

    In this study, we solve the three-dimensional stochastic Darcy's equation and stochastic advection-diffusion-dispersion equation using a probabilistic collocation method (PCM) on sparse grids. Karhunen-Lo\\`{e}ve (KL) decomposition is employed to represent the three-dimensional log hydraulic conductivity $Y=\\ln K_s$. The numerical examples which demonstrate the convergence of PCM are presented. It appears that the faster convergence rate in the variance can be obtained by using the Jacobi-chaos representing the truncated Gaussian distributions than using the Hermite-chaos for the Gaussian distribution. The effect of dispersion coefficient on the mean and standard deviation of the hydraulic head and solute concentration is investigated. Additionally, we also study how the statistical properties of the hydraulic head and solute concentration vary while using different types of random distributions and different standard deviations of random hydraulic conductivity.

  17. Space-fractional advection-dispersion equations by the Kansa method

    NASA Astrophysics Data System (ADS)

    Pang, Guofei; Chen, Wen; Fu, Zhuojia

    2015-07-01

    The paper makes the first attempt at applying the Kansa method, a radial basis function meshless collocation method, to the space-fractional advection-dispersion equations, which have recently been observed to accurately describe solute transport in a variety of field and lab experiments characterized by occasional large jumps with fewer parameters than the classical models of integer-order derivative. However, because of non-local property of integro-differential operator of space-fractional derivative, numerical solution of these novel models is very challenging and little has been reported in literature. It is stressed that local approximation techniques such as the finite element and finite difference methods lose their sparse discretization matrix due to this non-local property. Thus, the global methods appear to have certain advantages in numerical simulation of these non-local models because of their high accuracy and smaller size resultant matrix equation. Compared with the finite difference method, popular in the solution of fractional equations, the Kansa method is a recent meshless global technique and is promising for high-dimensional irregular domain problems. In this study, the resultant matrix of the Kansa method is accurately calculated by the Gauss-Jacobi quadrature rule. Numerical results show that the Kansa method is highly accurate and computationally efficient for space-fractional advection-dispersion problems.

  18. Advection, dispersion, and filtration of fine particles within emergent vegetation of the Florida Everglades

    USGS Publications Warehouse

    Huang, Y.H.; Saiers, J.E.; Harvey, J.W.; Noe, G.B.; Mylon, S.

    2008-01-01

    The movement of particulate matter within wetland surface waters affects nutrient cycling, contaminant mobility, and the evolution of the wetland landscape. Despite the importance of particle transport in influencing wetland form and function, there are few data sets that illuminate, in a quantitative way, the transport behavior of particulate matter within surface waters containing emergent vegetation. We report observations from experiments on the transport of 1 ??m latex microspheres at a wetland field site located in Water Conservation Area 3A of the Florida Everglades. The experiments involved line source injections of particles inside two 4.8-m-long surface water flumes constructed within a transition zone between an Eleocharis slough and Cladium jamaicense ridge and within a Cladium jamaicense ridge. We compared the measurements of particle transport to calculations of two-dimensional advection-dispersion model that accounted for a linear increase in water velocities with elevation above the ground surface. The results of this analysis revealed that particle spreading by longitudinal and vertical dispersion was substantially greater in the ridge than within the transition zone and that particle capture by aquatic vegetation lowered surface water particle concentrations and, at least for the timescale of our experiments, could be represented as an irreversible, first-order kinetics process. We found generally good agreement between our field-based estimates of particle dispersion and water velocity and estimates determined from published theory, suggesting that the advective-dispersive transport of particulate matter within complex wetland environments can be approximated on the basis of measurable properties of the flow and aquatic vegetation. Copyright 2008 by the American Geophysical Union.

  19. Solution of the advection-dispersion equation: Continuous load of finite duration

    USGS Publications Warehouse

    Runkel, R.L.

    1996-01-01

    Field studies of solute fate and transport in streams and rivers often involve an. experimental release of solutes at an upstream boundary for a finite period of time. A review of several standard references on surface-water-quality modeling indicates that the analytical solution to the constant-parameter advection-dispersion equation for this type of boundary condition has been generally overlooked. Here an exact analytical solution that considers a continuous load of unite duration is compared to an approximate analytical solution presented elsewhere. Results indicate that the exact analytical solution should be used for verification of numerical solutions and other solute-transport problems wherein a high level of accuracy is required. ?? ASCE.

  20. Diffusion related isotopic fractionation effects with one-dimensional advective-dispersive transport.

    PubMed

    Xu, Bruce S; Lollar, Barbara Sherwood; Passeport, Elodie; Sleep, Brent E

    2016-04-15

    Aqueous phase diffusion-related isotope fractionation (DRIF) for carbon isotopes was investigated for common groundwater contaminants in systems in which transport could be considered to be one-dimensional. This paper focuses not only on theoretically observable DRIF effects in these systems but introduces the important concept of constraining "observable" DRIF based on constraints imposed by the scale of measurements in the field, and on standard limits of detection and analytical uncertainty. Specifically, constraints for the detection of DRIF were determined in terms of the diffusive fractionation factor, the initial concentration of contaminants (C0), the method detection limit (MDL) for isotopic analysis, the transport time, and the ratio of the longitudinal mechanical dispersion coefficient to effective molecular diffusion coefficient (Dmech/Deff). The results allow a determination of field conditions under which DRIF may be an important factor in the use of stable carbon isotope measurements for evaluation of contaminant transport and transformation for one-dimensional advective-dispersive transport. This study demonstrates that for diffusion-dominated transport of BTEX, MTBE, and chlorinated ethenes, DRIF effects are only detectable for the smaller molar mass compounds such as vinyl chloride for C0/MDL ratios of 50 or higher. Much larger C0/MDL ratios, corresponding to higher source concentrations or lower detection limits, are necessary for DRIF to be detectable for the higher molar mass compounds. The distance over which DRIF is observable for VC is small (less than 1m) for a relatively young diffusive plume (<100years), and DRIF will not easily be detected by using the conventional sampling approach with "typical" well spacing (at least several meters). With contaminant transport by advection, mechanical dispersion, and molecular diffusion this study suggests that in field sites where Dmech/Deff is larger than 10, DRIF effects will likely not be

  1. An ELLAM Approximation for Advective-Dispersive Transport with Nonlinear Sorption

    DTIC Science & Technology

    2005-02-28

    1, Cass T. Miller a aCenter for the Integrated Study of the Environment, Department of Environmental Sciences and Engineering , University of North...Carolina, Chapel Hill, North Carolina 27599-7431, USA bU.S. Army Engineer Research and Development Center, Coastal and Hydraulics Laboratory, 3909 Halls...Center for Integrated Study of the Environment,Department of Environmental Sciences and Engineering ,Chapel Hill,NC,27599-7431 8. PERFORMING

  2. Approximation of the Lévy Feller advection dispersion process by random walk and finite difference method

    NASA Astrophysics Data System (ADS)

    Liu, Q.; Liu, F.; Turner, I.; Anh, V.

    2007-03-01

    In this paper we present a random walk model for approximating a Lévy-Feller advection-dispersion process, governed by the Lévy-Feller advection-dispersion differential equation (LFADE). We show that the random walk model converges to LFADE by use of a properly scaled transition to vanishing space and time steps. We propose an explicit finite difference approximation (EFDA) for LFADE, resulting from the Grünwald-Letnikov discretization of fractional derivatives. As a result of the interpretation of the random walk model, the stability and convergence of EFDA for LFADE in a bounded domain are discussed. Finally, some numerical examples are presented to show the application of the present technique.

  3. Effects of oil dispersant and oil on sorption and desorption of phenanthrene with Gulf Coast marine sediments.

    PubMed

    Gong, Yanyan; Zhao, Xiao; O'Reilly, S E; Qian, Tianwei; Zhao, Dongye

    2014-02-01

    Effects of a model oil dispersant (Corexit EC9500A) on sorption/desorption of phenanthrene were investigated with two marine sediments. Kinetic data revealed that the presence of the dispersant at 18 mg/L enhanced phenanthrene uptake by up to 7%, whereas the same dispersant during desorption reduced phenanthrene desorption by up to 5%. Sorption isotherms confirmed that at dispersant concentrations of 18 and 180 mg/L, phenanthrene uptake progressively increased for both sediments. Furthermore, the presence of the dispersant during desorption induced remarkable sorption hysteresis. The effects were attributed to added phenanthrene affinity and capacity due to sorption of the dispersant on the sediments. Dual-mode models adequately simulated sorption isotherms and kinetic data in the presence of the dispersant. Water accommodated oil (WAO) and dispersant-enhanced WAO increased phenanthrene sorption by up to 22%. This information is important for understanding roles of oil dispersants on the distribution and transport of petroleum PAHs in seawater-sediments.

  4. High-temperature sorption of cesium and strontium on dispersed kaolinite powders.

    PubMed

    Yoo, Jong-Ik; Shinagawa, Takuya; Wood, Joseph P; Linak, William P; Santoianni, Dawn A; King, Charles J; Seo, Yong-Chil; Wendt, Jost O L

    2005-07-01

    Sorption of cesium and strontium on kaolinite powders was investigated as a means to minimize the emissions of these metals during certain high-temperature processes currently being developed to isolate and dispose of radiological and mixed wastes. In this work, nonradioactive aqueous cesium acetate or strontium acetate was atomized down the center of a natural gas flame supported on a variable-swirl burner in a refractory-lined laboratory-scale combustion facility. Kaolinite powder was injected at a postflame location in the combustor. Cesium readily vaporized in the high-temperature regions of the combustor, but was reactively scavenged onto dispersed kaolinite. Global sorption mechanisms of cesium vapor on kaolinite were quantified, and are related to those available in the literature for sodium and lead. Both metal adsorption and substrate deactivation steps are important, so there is an optimum temperature, between 1400 and 1500 K, at which maximum sorption occurs. The presence of chlorine inhibits cesium sorption. In contrast to cesium, and in the absence of chlorine, strontium was only partially vaporized and was, therefore, only partially scavengeable. The strontium data did not allow quantification of global kinetic mechanisms of interaction, although equilibrium arguments provided insight into the effects of chlorine on strontium sorption. These results have implications for the use of sorbents to control cesium and strontium emissions during high-temperature waste processing including incineration and vitrification.

  5. Water Vapor Sorption and Diffusion in Secondary Dispersion Barrier Coatings: A Critical Comparison with Emulsion Polymers.

    PubMed

    Liu, Yang; Soer, Willem-Jan; Scheerder, Jürgen; Satgurunathan, Guru; Keddie, Joseph L

    2015-06-10

    The conventional method for synthesizing waterborne polymer colloids is emulsion polymerization using surfactants. An emerging method is the use of secondary dispersions (SD) of polymers in water, which avoids the addition of any surfactant. Although there are numerous studies of the water barrier properties (sorption, diffusion, and permeability) of waterborne emulsion (Em) polymer coatings, the properties of SD coatings, in comparison, have not been thoroughly investigated. Here, dynamic water vapor sorption analysis is used to compare the equilibrium sorption isotherms of the two forms of styrene-acrylate copolymers (Em and SD) with the same monomer composition. From an analysis of the kinetics of vapor sorption, the diffusion coefficient of water in the polymer coatings is determined. The combined effects of particle boundaries and surfactant addition were investigated through a comparison of the properties of SD and Em coatings to those of (1) solvent-cast polymer coatings (of the same monomer composition), (2) Em polymers that underwent dialysis to partially remove the water-soluble species, and (3) SD polymers with added surfactants. The results reveal that both the particle boundaries and the surfactants increase vapor sorption. The diffusion coefficients of water are comparable in magnitude in all of the polymer systems but are inversely related to water activity because of molecular clustering. Compared to all of the other waterborne polymer systems, the SD barrier coatings show the lowest equilibrium vapor sorption and permeability coefficients at high relative humidities as well as the lowest water diffusion coefficient at low humidities. These barrier properties make SD coatings an attractive alternative to conventional emulsion polymer coatings.

  6. BEHAVIOR OF SENSITIVITIES IN THE ONE-DIMENSIONAL ADVECTION-DISPERSION EQUATION: IMPLICATIONS FOR PARAMETER ESTIMATION AND SAMPLING DESIGN.

    USGS Publications Warehouse

    Knopman, Debra S.; Voss, Clifford I.

    1987-01-01

    The spatial and temporal variability of sensitivities has a significant impact on parameter estimation and sampling design for studies of solute transport in porous media. Physical insight into the behavior of sensitivities is offered through an analysis of analytically derived sensitivities for the one-dimensional form of the advection-dispersion equation. When parameters are estimated in regression models of one-dimensional transport, the spatial and temporal variability in sensitivities influences variance and covariance of parameter estimates. Several principles account for the observed influence of sensitivities on parameter uncertainty. (1) Information about a physical parameter may be most accurately gained at points in space and time. (2) As the distance of observation points from the upstream boundary increases, maximum sensitivity to velocity during passage of the solute front increases. (3) The frequency of sampling must be 'in phase' with the S shape of the dispersion sensitivity curve to yield the most information on dispersion. (4) The sensitivity to the dispersion coefficient is usually at least an order of magnitude less than the sensitivity to velocity. (5) The assumed probability distribution of random error in observations of solute concentration determines the form of the sensitivities. (6) If variance in random error in observations is large, trends in sensitivities of observation points may be obscured by noise. (7) Designs that minimize the variance of one parameter may not necessarily minimize the variance of other parameters.

  7. Eulerian-Lagrangian numerical scheme for simulating advection, dispersion, and transient storage in streams and a comparison of numerical methods

    USGS Publications Warehouse

    Cox, T.J.; Runkel, R.L.

    2008-01-01

    Past applications of one-dimensional advection, dispersion, and transient storage zone models have almost exclusively relied on a central differencing, Eulerian numerical approximation to the nonconservative form of the fundamental equation. However, there are scenarios where this approach generates unacceptable error. A new numerical scheme for this type of modeling is presented here that is based on tracking Lagrangian control volumes across a fixed (Eulerian) grid. Numerical tests are used to provide a direct comparison of the new scheme versus nonconservative Eulerian numerical methods, in terms of both accuracy and mass conservation. Key characteristics of systems for which the Lagrangian scheme performs better than the Eulerian scheme include: nonuniform flow fields, steep gradient plume fronts, and pulse and steady point source loadings in advection-dominated systems. A new analytical derivation is presented that provides insight into the loss of mass conservation in the nonconservative Eulerian scheme. This derivation shows that loss of mass conservation in the vicinity of spatial flow changes is directly proportional to the lateral inflow rate and the change in stream concentration due to the inflow. While the nonconservative Eulerian scheme has clearly worked well for past published applications, it is important for users to be aware of the scheme's limitations. ?? 2008 ASCE.

  8. Spatial Moment Equations for a Groundwater Plume with Degradation and Rate-Limited Sorption

    EPA Science Inventory

    In this note, we analytically derive the solution for the spatial moments of groundwater solute concentration distributions simulated by a one-dimensional model that assumes advective-dispersive transport with first-order degradation and rate-limited sorption. Sorption kinetics...

  9. Numerical simulation of advection fog formation on multi-disperse aerosols due to combustion-related pollutants

    NASA Technical Reports Server (NTRS)

    Hung, R. J.; Liaw, G. S.

    1980-01-01

    The effects of multi-disperse distribution of the aerosol population are presented. Single component and multi-component aerosol species on the condensation/nucleation processes which affect the reduction in visibility are described. The aerosol population with a high particle concentration provided more favorable conditions for the formation of a denser fog than the aerosol population with a greater particle size distribution when the value of the mass concentration of the aerosols was kept constant. The results were used as numerical predictions of fog formation. Two dimensional observations in horizontal and vertical coordinates, together with time-dependent measurements were needed as initial values for the following physical parameters: (1)wind profiles; (2) temperature profiles; (3) humidity profiles; (4) mass concentration of aerosol particles; (5) particle size distribution of aerosols; and (6) chemical composition of aerosols. Formation and dissipation of advection fog, thus, can be forecasted numerically by introducing initial values obtained from the observations.

  10. Advective-diffusive/dispersive transport of chemically reacting species in hydrothermal systems. Final report, FY83-85

    SciTech Connect

    Lichtner, P.C.; Helgeson, H.C.

    1986-06-20

    A general formulation of multi-phase fluid flow coupled to chemical reactions was developed based on a continuum description of porous media. A preliminary version of the computer code MCCTM was constructed which implemented the general equations for a single phase fluid. The computer code MCCTM incorporates mass transport by advection-diffusion/dispersion in a one-dimensional porous medium coupled to reversible and irreversible, homogeneous and heterogeneous chemical reactions. These reactions include aqueous complexing, oxidation/reduction reactions, ion exchange, and hydrolysis reactions of stoichiometric minerals. The code MCCTM uses a fully implicit finite difference algorithm. The code was tested against analytical calculations. Applications of the code included investigation of the propagation of sharp chemical reaction fronts, metasomatic alteration of microcline at elevated temperatures and pressures, and ion-exchange in a porous column. Finally numerical calculations describing fluid flow in crystalline rock in the presence of a temperature gradient were compared with experimental results for quartzite.

  11. Mixing-Driven Equilibrium Reactions in Multidimensional Fractional Advection Dispersion Systems

    PubMed Central

    Bolster, Diogo; Benson, David A; Meerschaert, MM; Baeumer, Boris

    2013-01-01

    We study instantaneous, mixing-driven, bimolecular equilibrium reactions in a system where transport is governed by a multidimensional space fractional dispersion equation. The superdiffusive, nonlocal nature of the system causes the location and magnitude of reactions that take place to change significantly from a classical Fickian diffusion model. In particular, regions where reaction rates would be zero for the Fickian case become regions where the maximum reaction rate occurs when anomalous dispersion operates. We also study a global metric of mixing in the system, the scalar dissipation rate and compute its asymptotic scaling rates analytically. The scalar dissipation rate scales asymptotically as t−(d+α)/α, where d is the number of spatial dimensions and α is the fractional derivative exponent. PMID:24223468

  12. Derivation of a Multiparameter Gamma Model for Analyzing the Residence-Time Distribution Function for Nonideal Flow Systems as an Alternative to the Advection-Dispersion Equation

    DOE PAGES

    Embry, Irucka; Roland, Victor; Agbaje, Oluropo; ...

    2013-01-01

    A new residence-time distribution (RTD) function has been developed and applied to quantitative dye studies as an alternative to the traditional advection-dispersion equation (AdDE). The new method is based on a jointly combined four-parameter gamma probability density function (PDF). The gamma residence-time distribution (RTD) function and its first and second moments are derived from the individual two-parameter gamma distributions of randomly distributed variables, tracer travel distance, and linear velocity, which are based on their relationship with time. The gamma RTD function was used on a steady-state, nonideal system modeled as a plug-flow reactor (PFR) in the laboratory to validate themore » effectiveness of the model. The normalized forms of the gamma RTD and the advection-dispersion equation RTD were compared with the normalized tracer RTD. The normalized gamma RTD had a lower mean-absolute deviation (MAD) (0.16) than the normalized form of the advection-dispersion equation (0.26) when compared to the normalized tracer RTD. The gamma RTD function is tied back to the actual physical site due to its randomly distributed variables. The results validate using the gamma RTD as a suitable alternative to the advection-dispersion equation for quantitative tracer studies of non-ideal flow systems.« less

  13. The role of advection and dispersion in the rock matrix on the transport of leaking CO2-saturated brine along a fractured zone

    NASA Astrophysics Data System (ADS)

    Ahmad, Nawaz; Wörman, Anders; Sanchez-Vila, Xavier; Bottacin-Busolin, Andrea

    2016-12-01

    CO2 that is injected into a geological storage reservoir can leak in dissolved form because of brine displacement from the reservoir, which is caused by large-scale groundwater motion. Simulations of the reactive transport of leaking CO2aq along a conducting fracture in a clay-rich caprock are conducted to analyze the effect of various physical and geochemical processes. Whilst several modeling transport studies along rock fractures have considered diffusion as the only transport process in the surrounding rock matrix (diffusive transport), this study analyzes the combined role of advection and dispersion in the rock matrix in addition to diffusion (advection-dominated transport) on the migration of CO2aq along a leakage pathway and its conversion in geochemical reactions. A sensitivity analysis is performed to quantify the effect of fluid velocity and dispersivity. Variations in the porosity and permeability of the medium are found in response to calcite dissolution and precipitation along the leakage pathway. We observe that advection and dispersion in the rock matrix play a significant role in the overall transport process. For the parameters that were used in this study, advection-dominated transport increased the leakage of CO2aq from the reservoir by nearly 305%, caused faster transport and increased the mass conversion of CO2aq in geochemical reactions along the transport pathway by approximately 12.20% compared to diffusive transport.

  14. Advection and dispersion heat transport mechanisms in the quantification of shallow geothermal resources and associated environmental impacts.

    PubMed

    Alcaraz, Mar; García-Gil, Alejandro; Vázquez-Suñé, Enric; Velasco, Violeta

    2016-02-01

    Borehole Heat Exchangers (BHEs) are increasingly being used to exploit shallow geothermal energy. This paper presents a new methodology to provide a response to the need for a regional quantification of the geothermal potential that can be extracted by BHEs and the associated environmental impacts. A set of analytical solutions facilitates accurate calculation of the heat exchange of BHEs with the ground and its environmental impacts. For the first time, advection and dispersion heat transport mechanisms and the temporal evolution from the start of operation of the BHE are taken into account in the regional estimation of shallow geothermal resources. This methodology is integrated in a GIS environment, which facilitates the management of input and output data at a regional scale. An example of the methodology's application is presented for Barcelona, in Spain. As a result of the application, it is possible to show the strengths and improvements of this methodology in the development of potential maps of low temperature geothermal energy as well as maps of environmental impacts. The minimum and maximum energy potential values for the study site are 50 and 1800 W/m(2) for a drilled depth of 100 m, proportionally to Darcy velocity. Regarding to thermal impacts, the higher the groundwater velocity and the energy potential, the higher the size of the thermal plume after 6 months of exploitation, whose length ranges from 10 to 27 m long. A sensitivity analysis was carried out in the calculation of heat exchange rate and its impacts for different scenarios and for a wide range of Darcy velocities. The results of this analysis lead to the conclusion that the consideration of dispersion effects and temporal evolution of the exploitation prevent significant differences up to a factor 2.5 in the heat exchange rate accuracy and up to several orders of magnitude in the impacts generated.

  15. Prediction of the moments in advection-diffusion lattice Boltzmann method. I. Truncation dispersion, skewness, and kurtosis

    NASA Astrophysics Data System (ADS)

    Ginzburg, Irina

    2017-01-01

    The effect of the heterogeneity in the soil structure or the nonuniformity of the velocity field on the modeled resident time distribution (RTD) and breakthrough curves is quantified by their moments. While the first moment provides the effective velocity, the second moment is related to the longitudinal dispersion coefficient (kT) in the developed Taylor regime; the third and fourth moments are characterized by their normalized values skewness (Sk) and kurtosis (Ku), respectively. The purpose of this investigation is to examine the role of the truncation corrections of the numerical scheme in kT, Sk, and Ku because of their interference with the second moment, in the form of the numerical dispersion, and in the higher-order moments, by their definition. Our symbolic procedure is based on the recently proposed extended method of moments (EMM). Originally, the EMM restores any-order physical moments of the RTD or averaged distributions assuming that the solute concentration obeys the advection-diffusion equation in multidimensional steady-state velocity field, in streamwise-periodic heterogeneous structure. In our work, the EMM is generalized to the fourth-order-accurate apparent mass-conservation equation in two- and three-dimensional duct flows. The method looks for the solution of the transport equation as the product of a long harmonic wave and a spatially periodic oscillating component; the moments of the given numerical scheme are derived from a chain of the steady-state fourth-order equations at a single cell. This mathematical technique is exemplified for the truncation terms of the two-relaxation-time lattice Boltzmann scheme, using plug and parabolic flow in straight channel and cylindrical capillary with the d2Q9 and d3Q15 discrete velocity sets as simple but illustrative examples. The derived symbolic dependencies can be readily extended for advection by another, Newtonian or non-Newtonian, flow profile in any-shape open-tabular conduits. It is

  16. Prediction of the moments in advection-diffusion lattice Boltzmann method. I. Truncation dispersion, skewness, and kurtosis.

    PubMed

    Ginzburg, Irina

    2017-01-01

    The effect of the heterogeneity in the soil structure or the nonuniformity of the velocity field on the modeled resident time distribution (RTD) and breakthrough curves is quantified by their moments. While the first moment provides the effective velocity, the second moment is related to the longitudinal dispersion coefficient (k_{T}) in the developed Taylor regime; the third and fourth moments are characterized by their normalized values skewness (Sk) and kurtosis (Ku), respectively. The purpose of this investigation is to examine the role of the truncation corrections of the numerical scheme in k_{T}, Sk, and Ku because of their interference with the second moment, in the form of the numerical dispersion, and in the higher-order moments, by their definition. Our symbolic procedure is based on the recently proposed extended method of moments (EMM). Originally, the EMM restores any-order physical moments of the RTD or averaged distributions assuming that the solute concentration obeys the advection-diffusion equation in multidimensional steady-state velocity field, in streamwise-periodic heterogeneous structure. In our work, the EMM is generalized to the fourth-order-accurate apparent mass-conservation equation in two- and three-dimensional duct flows. The method looks for the solution of the transport equation as the product of a long harmonic wave and a spatially periodic oscillating component; the moments of the given numerical scheme are derived from a chain of the steady-state fourth-order equations at a single cell. This mathematical technique is exemplified for the truncation terms of the two-relaxation-time lattice Boltzmann scheme, using plug and parabolic flow in straight channel and cylindrical capillary with the d2Q9 and d3Q15 discrete velocity sets as simple but illustrative examples. The derived symbolic dependencies can be readily extended for advection by another, Newtonian or non-Newtonian, flow profile in any-shape open-tabular conduits. It is

  17. Determination of longitudinal dispersion coefficient and net advection in the tidal hudson river with a large-scale, high resolution SF6 tracer release experiment.

    PubMed

    Ho, David T; Schlosser, Peter; Caplow, Theodore

    2002-08-01

    Physical processes such as advection, dispersion, and air-water gas exchange play important roles in determining the movement and change in concentration of contaminants discharged into rivers. In the following, we report results from a large-scale SF6 tracer release experiment conducted in the tidal Hudson Riverto examine longitudinal dispersion and net advection. SF6 was injected into the Hudson River near Newburgh, NY, and surveyed for 13 days using a new, fully automated, high-resolution SF6 sampling and analysis system. Net down river advection of the water body originally tagged with SF6 was slow, averaging mean displacement rates of about 0.5 +/- 0.2 km d(-1). In contrast, spreading of the tracer was driven by tidal movement, causing rapid mixing of the water up and down river. By examining the change in the second moment of the tracer distribution with time, we determined the mean longitudinal dispersion coefficient to be 70.1 +/- 4.3 m2 s(-1). Temporal evolution of the SF6 inventory indicates an average gas transfer velocity over the period of the experiment of 6.5 +/- 0.5 cm h(-1) (1.56 +/- 0.12 m d(-1)). Vertical profiles show that mixing into the bottom layers of the river, in places reaching more than 53 m, seemed to be rapid.

  18. Sorption of 75% DDT Water-Dispersible Powder on Different Mud Surfaces

    PubMed Central

    Bami, H. L.

    1961-01-01

    The loss of residual insecticide particles on absorbent mud surfaces due to the phenomenon of sorption has been well investigated from various physical, chemical and biological aspects. The present report describes an attempt to correlate the relative sorption capacities of representative Indian and African soils and a synthetic soil with the physicochemical characteristics of these soils and their surfaces. The investigation has further elucidated the mode of sorption of non-volatile residual insecticides on mud surfaces and the role of certain physicochemical factors. PMID:13686503

  19. Aspects of numerical and representational methods related to the finite-difference simulation of advective and dispersive transport of freshwater in a thin brackish aquifer

    USGS Publications Warehouse

    Merritt, M.L.

    1993-01-01

    The simulation of the transport of injected freshwater in a thin brackish aquifer, overlain and underlain by confining layers containing more saline water, is shown to be influenced by the choice of the finite-difference approximation method, the algorithm for representing vertical advective and dispersive fluxes, and the values assigned to parametric coefficients that specify the degree of vertical dispersion and molecular diffusion that occurs. Computed potable water recovery efficiencies will differ depending upon the choice of algorithm and approximation method, as will dispersion coefficients estimated based on the calibration of simulations to match measured data. A comparison of centered and backward finite-difference approximation methods shows that substantially different transition zones between injected and native waters are depicted by the different methods, and computed recovery efficiencies vary greatly. Standard and experimental algorithms and a variety of values for molecular diffusivity, transverse dispersivity, and vertical scaling factor were compared in simulations of freshwater storage in a thin brackish aquifer. Computed recovery efficiencies vary considerably, and appreciable differences are observed in the distribution of injected freshwater in the various cases tested. The results demonstrate both a qualitatively different description of transport using the experimental algorithms and the interrelated influences of molecular diffusion and transverse dispersion on simulated recovery efficiency. When simulating natural aquifer flow in cross-section, flushing of the aquifer occurred for all tested coefficient choices using both standard and experimental algorithms. ?? 1993.

  20. A finite-volume Eulerian-Lagrangian localized adjoint method for solution of the advection-dispersion equation

    USGS Publications Warehouse

    Healy, R.W.; Russell, T.F.

    1993-01-01

    Test results demonstrate that the finite-volume Eulerian-Lagrangian localized adjoint method (FVELLAM) outperforms standard finite-difference methods for solute transport problems that are dominated by advection. FVELLAM systematically conserves mass globally with all types of boundary conditions. Integrated finite differences, instead of finite elements, are used to approximate the governing equation. This approach, in conjunction with a forward tracking scheme, greatly facilitates mass conservation. The mass storage integral is numerically evaluated at the current time level, and quadrature points are then tracked forward in time to the next level. Forward tracking permits straightforward treatment of inflow boundaries, thus avoiding the inherent problem in backtracking of characteristic lines intersecting inflow boundaries. FVELLAM extends previous results by obtaining mass conservation locally on Lagrangian space-time elements. -from Authors

  1. Using DVS-NIR to assess the water sorption behaviour and stability of a griseofulvin/PVP K30 solid dispersion.

    PubMed

    Li, Wanjing; Buckton, Graham

    2015-11-30

    The purpose of this work was to investigate the distribution of water in a physically unstable amorphous solid dispersion (polyvinylpyrrolidone (PVP) and griseofulvin (as a model hydrophobic drug)), both as the sample absorbs water and during prolonged exposure to elevated humidity by use of dynamic vapour sorption combined with near infrared (DVS-NIR). The solid dispersion absorbed much less water than the sum of the water sorption of the individual components. This suggests that griseofulvin hindered PVP from absorbing water through the formation of the solid dispersion. Prolonged storage of the solid dispersion at 75% RH resulted in no significant mass change. Whilst this would usually be interpreted as the absence of crystallization, the NIR spectra demonstrated that crystallization occurred. The reason for the lack of a weight loss was that the expelled water from amorphous griseofulvin was sorbed by PVP, meaning that as the dispersion was broken by the crystallisation of griseofulvin, the PVP was once again free to sorb water (in line with the higher water sorption shown by PVP alone, and in contrast with the lower sorption of water by the solid dispersion). As water is a key factor in the physical stability of amorphous systems, understanding how and where water is absorbed and how this is liable to change is an important advance and offers promise in understanding the mechanism of stabilisation of solid dispersions, and therefore may be useful to predict the stability of new API dispersions.

  2. HIGH TEMPERATURE SORPTION OF CESIUM AND STRONTIUM ON DISPERSED KAOLINITE POWDERS

    EPA Science Inventory

    Sorption of cesium and strontium on kaolinite powders was investigated as a means to minimize the emissions of these metals during certain high-temperature processes currently being developed to isolate and dispose of radiological and mixed wastes. In this work, nonradioactive aq...

  3. STATISTICAL METHODOLOGY FOR ESTIMATING TRANSPORT PARAMETERS: THEORY AND APPLICATIONS TO ONE-DOMENSIONAL ADVECTIVE-DISPERSIVE SYSTEMS.

    USGS Publications Warehouse

    Wagner, Brian J.; Gorelick, Steven M.

    1986-01-01

    A simulation nonlinear multiple-regression methodology for estimating parameters that characterize the transport of contaminants is developed and demonstrated. Finite difference containment transport simulation is combined with a nonlinear weighted least squares multiple-regression procedure. The technique provides optimal parameter estimates and gives statistics for assessing the reliability of these estimates under certain general assumptions about the distributions of the random measurement errors. Monte Carlo analysis is used to estimate parameter reliability for a hypothetical homogeneous soil column for which concentration data contain large random measurement errors. The value of data collected spatially versus data collected temporally was investigated for estimation of velocity, dispersion coefficient, effective porosity, first-order decay rate, and zero-order production. The use of spatial data gave estimates that were 2-3 times more reliable than estimates based on temporal data for all parameters except velocity. (Estimated author abstract) Refs.

  4. An upscaled approach for transport in media with extended tailing due to back-diffusion using analytical and numerical solutions of the advection dispersion equation.

    PubMed

    Parker, Jack C; Kim, Ungtae

    2015-11-01

    The mono-continuum advection-dispersion equation (mADE) is commonly regarded as unsuitable for application to media that exhibit rapid breakthrough and extended tailing associated with diffusion between high and low permeability regions. This paper demonstrates that the mADE can be successfully used to model such conditions if certain issues are addressed. First, since hydrodynamic dispersion, unlike molecular diffusion, cannot occur upstream of the contaminant source, models must be formulated to prevent "back-dispersion." Second, large variations in aquifer permeability will result in differences between volume-weighted average concentration (resident concentration) and flow-weighted average concentration (flux concentration). Water samples taken from wells may be regarded as flux concentrations, while soil samples may be analyzed to determine resident concentrations. While the mADE is usually derived in terms of resident concentration, it is known that a mADE of the same mathematical form may be written in terms of flux concentration. However, when solving the latter, the mathematical transformation of a flux boundary condition applied to the resident mADE becomes a concentration type boundary condition for the flux mADE. Initial conditions must also be consistent with the form of the mADE that is to be solved. Thus, careful attention must be given to the type of concentration data that is available, whether resident or flux concentrations are to be simulated, and to boundary and initial conditions. We present 3-D analytical solutions for resident and flux concentrations, discuss methods of solving numerical models to obtain resident and flux concentrations, and compare results for hypothetical problems. We also present an upscaling method for computing "effective" dispersivities and other mADE model parameters in terms of physically meaningful parameters in a diffusion-limited mobile-immobile model. Application of the latter to previously published studies of

  5. iCFD: Interpreted Computational Fluid Dynamics - Degeneration of CFD to one-dimensional advection-dispersion models using statistical experimental design - The secondary clarifier.

    PubMed

    Guyonvarch, Estelle; Ramin, Elham; Kulahci, Murat; Plósz, Benedek Gy

    2015-10-15

    The present study aims at using statistically designed computational fluid dynamics (CFD) simulations as numerical experiments for the identification of one-dimensional (1-D) advection-dispersion models - computationally light tools, used e.g., as sub-models in systems analysis. The objective is to develop a new 1-D framework, referred to as interpreted CFD (iCFD) models, in which statistical meta-models are used to calculate the pseudo-dispersion coefficient (D) as a function of design and flow boundary conditions. The method - presented in a straightforward and transparent way - is illustrated using the example of a circular secondary settling tank (SST). First, the significant design and flow factors are screened out by applying the statistical method of two-level fractional factorial design of experiments. Second, based on the number of significant factors identified through the factor screening study and system understanding, 50 different sets of design and flow conditions are selected using Latin Hypercube Sampling (LHS). The boundary condition sets are imposed on a 2-D axi-symmetrical CFD simulation model of the SST. In the framework, to degenerate the 2-D model structure, CFD model outputs are approximated by the 1-D model through the calibration of three different model structures for D. Correlation equations for the D parameter then are identified as a function of the selected design and flow boundary conditions (meta-models), and their accuracy is evaluated against D values estimated in each numerical experiment. The evaluation and validation of the iCFD model structure is carried out using scenario simulation results obtained with parameters sampled from the corners of the LHS experimental region. For the studied SST, additional iCFD model development was carried out in terms of (i) assessing different density current sub-models; (ii) implementation of a combined flocculation, hindered, transient and compression settling velocity function; and (iii

  6. Hydrogen Sorption and Transport

    NASA Astrophysics Data System (ADS)

    McNeece, C. J.; Hesse, M. A.

    2015-12-01

    Hydrogen is unique among aqueous ions, both in its importance for geochemical reactions, and in its complex transport behavior through reactive media. The structure of hydrogen reaction fronts can be analyzed in the advective limit of the transport equation. At local chemical equilibrium, sorption of hydrogen onto the media surface (sorption isotherm) controls reaction front morphology. Transport modeling thus necessitates accurate knowledge of surface chemistry. Though motivated by transport, sorption models are often parameterized against batch titration experiments. The validity of these parameterizations, in a transport setting, are seldom tested. The analytic solution to the transport equation gives an algebraic relationship between concentration velocity and equilibrium sorption behavior. In this study, we conduct a suite of column flow experiments through quartz sand. Hydrogen concentration breakthrough curves at the column outlet are used to infer the "transport sorption isotherm." These results are compared to the batch titration derived sorption isotherm. We find excellent agreement between the datasets. Our findings suggest that, for aqueous hydrogen, local chemical equilibrium is a valid assumption. With the goal of a predictive transport model, we parameterize various sorption models against this dataset. Models which incorporate electrostatic effects at the surface predict transport well. Nonelectrostatic models such as the Kd, Langmuir, and Freundlich models fail. These results are particularly compelling as nonelectrostatic models are often employed to predict hydrogen transport in many reactive transport code.

  7. Using a Gas-Phase Tracer Test to Characterize the Impact of Landfill Gas Generation on Advective-Dispersive Transport of VOCs in the Vadose Zone

    PubMed Central

    Monger, Gregg R.; Duncan, Candice Morrison; Brusseau, Mark L.

    2015-01-01

    A gas-phase tracer test (GTT) was conducted at a landfill in Tucson, AZ, to help elucidate the impact of landfill gas generation on the transport and fate of chlorinated aliphatic volatile organic contaminants (VOCs). Sulfur hexafluoride (SF6) was used as the non-reactive gas tracer. Gas samples were collected from a multiport monitoring well located 15.2 m from the injection well, and analyzed for SF6, CH4, CO2, and VOCs. The travel times determined for SF6 from the tracer test are approximately two to ten times smaller than estimated travel times that incorporate transport by only gas-phase diffusion. In addition, significant concentrations of CH4 and CO2 were measured, indicating production of landfill gas. Based on these results, it is hypothesized that the enhanced rates of transport observed for SF6 are caused by advective transport associated with landfill gas generation. The rates of transport varied vertically, which is attributed to multiple factors including spatial variability of water content, refuse mass, refuse permeability, and gas generation. PMID:26380532

  8. Using a Gas-Phase Tracer Test to Characterize the Impact of Landfill Gas Generation on Advective-Dispersive Transport of VOCs in the Vadose Zone.

    PubMed

    Monger, Gregg R; Duncan, Candice Morrison; Brusseau, Mark L

    2014-12-01

    A gas-phase tracer test (GTT) was conducted at a landfill in Tucson, AZ, to help elucidate the impact of landfill gas generation on the transport and fate of chlorinated aliphatic volatile organic contaminants (VOCs). Sulfur hexafluoride (SF6) was used as the non-reactive gas tracer. Gas samples were collected from a multiport monitoring well located 15.2 m from the injection well, and analyzed for SF6, CH4, CO2, and VOCs. The travel times determined for SF6 from the tracer test are approximately two to ten times smaller than estimated travel times that incorporate transport by only gas-phase diffusion. In addition, significant concentrations of CH4 and CO2 were measured, indicating production of landfill gas. Based on these results, it is hypothesized that the enhanced rates of transport observed for SF6 are caused by advective transport associated with landfill gas generation. The rates of transport varied vertically, which is attributed to multiple factors including spatial variability of water content, refuse mass, refuse permeability, and gas generation.

  9. Sorption and transformation of the reactive tracers resazurin and resorufin in natural river sediments

    NASA Astrophysics Data System (ADS)

    Lemke, D.; González-Pinzón, R.; Liao, Z.; Wöhling, T.; Osenbrück, K.; Haggerty, R.; Cirpka, O. A.

    2014-08-01

    Resazurin (Raz) and its reaction product resorufin (Rru) have increasingly been used as reactive tracers to quantify metabolic activity and hyporheic exchange in streams. Previous work has indicated that these compounds undergo sorption in stream sediments. We present laboratory experiments on Raz and Rru transport, sorption, and transformation, consisting of 4 column and 72 batch tests using 2 sediments with different physicochemical properties under neutral (pH = 7) and alkaline (pH = 9) conditions. The study aimed at identifying the key processes of reactive transport of Raz and Rru in streambed sediments and the experimental setup best suited for their determination. Data from column experiments were simulated by a travel-time-based model accounting for physical transport, equilibrium and kinetic sorption, and three first-order reactions. We derived the travel-time distributions directly from the breakthrough curve (BTC) of the conservative tracer, fluorescein, rather than from fitting an advective-dispersive transport model, and inferred from those distributions the transfer functions of Raz and Rru, which provided conclusive approximations of the measured BTCs. The most likely reactive transport parameters and their uncertainty were determined by a Markov chain-Monte Carlo approach. Sorption isotherms of both compounds were obtained from batch experiments. We found that kinetic sorption dominates sorption of both Raz and Rru, with characteristic timescales of sorption in the order of 12 to 298 min. Linear sorption models for both Raz and Rru appeared adequate for concentrations that are typically applied in field tracer tests. The proposed two-site sorption model helps to interpret transient tracer tests using the Raz-Rru system.

  10. Pathways for Advective Transport

    DTIC Science & Technology

    2001-01-19

    the approach is given and an application to the Gulf of Mexico is described where the analysis precisely identifies the boundaries of coherent vortical structures as well as pathways for advective transport.

  11. HEMP advection model

    SciTech Connect

    Sharp, R.W. Jr.; Barton, R.T.

    1981-01-21

    A continuous rezoning procedure has been implemented in the computational cycle of a version of the HEMP two-dimensional, Lagrange, fluid dynamics code. The rezoning problem is divided into two steps. The first step requires the solving of ordinary Lagrange equations of motion; the second step consists of adding equipotential grid relaxation along with an advective remapping scheme.

  12. Dispersal

    USGS Publications Warehouse

    Clobert, J.; Danchin, E.; Dhondt, A.A.; Nichols, J.D.

    2001-01-01

    The ability of species to migrate and disperse is a trait that has interested ecologists for many years. Now that so many species and ecosystems face major environmental threats from habitat fragmentation and global climate change, the ability of species to adapt to these changes by dispersing, migrating, or moving between patches of habitat can be crucial to ensuring their survival. This book provides a timely and wide-ranging overview of the study of dispersal and incorporates much of the latest research. The causes, mechanisms, and consequences of dispersal at the individual, population, species and community levels are considered. The potential of new techniques and models for studying dispersal, drawn from molecular biology and demography, is also explored. Perspectives and insights are offered from the fields of evolution, conservation biology and genetics. Throughout the book, theoretical approaches are combined with empirical data, and care has been taken to include examples from as wide a range of species as possible.

  13. LAYER DEPENDENT ADVECTION IN CMAQ

    EPA Science Inventory

    The advection methods used in CMAQ require that the Courant-Friedrichs-Lewy (CFL) condition be satisfied for numerical stability and accuracy. In CMAQ prior to version 4.3, the ADVSTEP algorithm established CFL-safe synchronization and advection timesteps that were uniform throu...

  14. An Exact Solution for the Assessment of Nonequilibrium Sorption of Radionuclides in the Vadose Zone

    SciTech Connect

    Drake, R. L.; Chen, J-S.

    2002-02-26

    In a report on model evaluation, the authors ran the HYDRUS Code, among other transport codes, to evaluate the impacts of nonequilibrium sorption sites on the time-evolution of 99Tc and 90Sr through the vadose zone. Since our evaluation was based on a rather low, annual recharge rate, many of the numerical results derived from HYDRUS indicated that the nonequilibrium sorption sites, in essence, acted as equilibrium sorption sites. To help explain these results, we considered a ''stripped-down'' version of the HYDRUS system. This ''stripped-down'' version possesses two dependent variables, one for the radionuclides in solution and the other for the radionuclides adsorbed to the nonequilibrium sites; and it possesses constant physical parameters. The resultant governing equation for the radionuclides in solution is a linear, advection-dispersion-reaction (i.e., radioactive decay) partial differential equation containing a history integral term accounting for the nonequilibrium sorption sites. It is this ''stripped-down'' version, which is the subject of this paper. We found an exact solution to this new version of the model. The exact solution is given in terms of a single definite integral of terms involving elementary functions of the independent variables and the system parameters. This integral possesses adequate convergence properties and is easy to evaluate, both in a quantitative matter and in a qualitative manner. The parameters that are considered in the system are as follows: the radionuclide's equilibrium partition coefficient between water and soil, the bulk density of the soil, the fractions of equilibrium/nonequilibrium sorption sites, the volumetric water content, the first order equilibrium adsorption rate constant, the first order radioactive decay rate constant, the liquid water soil tortuosity factor, the molecular diffusion coefficient in water, the longitudinal dispersivity factor, and the Darcian fluid flux density. In addition, the system

  15. [The effect of the application sorption of a fibrous activated charcoal material with highly dispersed iron on the course of a wound process].

    PubMed

    Symorot, M I; Shvets, T M; Kryzyna, P S; Kushchevs'ka, N F; Denys, R O

    1999-09-01

    Results of the experiments carried out show that the use of the activated carbon fibrous material "Dnipro" for medical purposes (ABBM "Dnipro" MP) and the suspension of high-dispersity iron combined in treatment of infected and suppurating wounds is associated with a more pronounced therapeutical effect than application to the wound surfaces of the standard ABBM "Dnipro" MP. The compositional method using ABBM "Dnipro" MP and high-dispersity iron obtainable by thermochemical techniques has a marked antimicrobial action and stimulates the course of the wound process.

  16. Modification of a method-of-characteristics solute-transport model to incorporate decay and equilibrium-controlled sorption or ion exchange

    USGS Publications Warehouse

    Goode, D.J.; Konikow, L.F.

    1989-01-01

    The U.S. Geological Survey computer model of two-dimensional solute transport and dispersion in ground water (Konikow and Bredehoeft, 1978) has been modified to incorporate the following types of chemical reactions: (1) first-order irreversible rate-reaction, such as radioactive decay; (2) reversible equilibrium-controlled sorption with linear, Freundlich, or Langmuir isotherms; and (3) reversible equilibrium-controlled ion exchange for monovalent or divalent ions. Numerical procedures are developed to incorporate these processes in the general solution scheme that uses method-of- characteristics with particle tracking for advection and finite-difference methods for dispersion. The first type of reaction is accounted for by an exponential decay term applied directly to the particle concentration. The second and third types of reactions are incorporated through a retardation factor, which is a function of concentration for nonlinear cases. The model is evaluated and verified by comparison with analytical solutions for linear sorption and decay, and by comparison with other numerical solutions for nonlinear sorption and ion exchange.

  17. Effects of demographic stochasticity on population persistence in advective media.

    PubMed

    Kolpas, Allison; Nisbet, Roger M

    2010-07-01

    Many populations live and disperse in advective media. A fundamental question, known as the "drift paradox" in stream ecology, is how a closed population can survive when it is constantly being transported downstream by the flow. Recent population-level models have focused on the role of diffusive movement in balancing the effects of advection, predicting critical conditions for persistence. Here, we formulate an individual-based stochastic analog of the model described in (Lutscher et al., SIAM Rev. 47(4):749-772, 2005) to quantify the effects of demographic stochasticity on persistence. Population dynamics are modeled as a logistic growth process and dispersal as a position-jump process on a finite domain divided into patches. When there is no correlation in the interpatch movement of residents, stochasticity simply smooths the persistence-extinction boundary. However, when individuals disperse in "packets" from one patch to another and the flow field is memoryless on the timescale of packet transport, the probability of persistence is greatly enhanced. The latter transport mechanism may be characteristic of larval dispersal in the coastal ocean or wind-dispersed seed pods.

  18. Modeling Np and Pu transport with a surface complexation model and spatially variant sorption capacities: Implications for reactive transport modeling and performance assessments of nuclear waste disposal sites

    USGS Publications Warehouse

    Glynn, P.D.

    2003-01-01

    One-dimensional (1D) geochemical transport modeling is used to demonstrate the effects of speciation and sorption reactions on the ground-water transport of Np and Pu, two redox-sensitive elements. Earlier 1D simulations (Reardon, 1981) considered the kinetically limited dissolution of calcite and its effect on ion-exchange reactions (involving 90Sr, Ca, Na, Mg and K), and documented the spatial variation of a 90Sr partition coefficient under both transient and steady-state chemical conditions. In contrast, the simulations presented here assume local equilibrium for all reactions, and consider sorption on constant potential, rather than constant charge, surfaces. Reardon's (1981) seminal findings on the spatial and temporal variability of partitioning (of 90Sr) are reexamined and found partially caused by his assumption of a kinetically limited reaction. In the present work, sorption is assumed the predominant retardation process controlling Pu and Np transport, and is simulated using a diffuse-double-layer-surface-complexation (DDLSC) model. Transport simulations consider the infiltration of Np- and Pu-contaminated waters into an initially uncontaminated environment, followed by the cleanup of the resultant contamination with uncontaminated water. Simulations are conducted using different spatial distributions of sorption capacities (with the same total potential sorption capacity, but with different variances and spatial correlation structures). Results obtained differ markedly from those that would be obtained in transport simulations using constant Kd, Langmuir or Freundlich sorption models. When possible, simulation results (breakthrough curves) are fitted to a constant K d advection-dispersion transport model and compared. Functional differences often are great enough that they prevent a meaningful fit of the simulation results with a constant K d (or even a Langmuir or Freundlich) model, even in the case of Np, a weakly sorbed radionuclide under the

  19. High-resolution two dimensional advective transport

    USGS Publications Warehouse

    Smith, P.E.; Larock, B.E.

    1989-01-01

    The paper describes a two-dimensional high-resolution scheme for advective transport that is based on a Eulerian-Lagrangian method with a flux limiter. The scheme is applied to the problem of pure-advection of a rotated Gaussian hill and shown to preserve the monotonicity property of the governing conservation law.

  20. Evolution and advection of solar mesogranulation

    NASA Technical Reports Server (NTRS)

    Muller, Richard; Auffret, Herve; Roudier, Thierry; Vigneau, Jean; Simon, George W.; Frank, Zoe; Shine, Richard A.; Title, Alan M.

    1992-01-01

    A three-hour sequence of observations at the Pic du Midi observatory has been obtained which shows the evolution of solar mesogranules from appearance to disappearance with unprecedented clarity. It is seen that the supergranules, which are known to advect the granules with their convective motion, also advect the mesogranules to their boundaries. This process controls the evolution and disappearance of mesogranules.

  1. Regenerative Sorption Refrigerator

    NASA Technical Reports Server (NTRS)

    Jones, Jack A.; Wen, Liang-Chi; Bard, Steven

    1991-01-01

    Two-stage sorption refrigerator achieves increased efficiency via regenerative-heating concept in which waste heat from praseodymium/cerium oxide (PCO) chemisorption compressor runs charcoal/krypton (C/Kr) sorption compressor. Waste heat from each PCO sorption compressor used to power surrounding C/Kr sorption compressor. Flows of heat in two compressor modules controlled by gas-gap thermal switches. Has no wearing moving parts other than extremely long life, room-temperature check valves operating about twice per hour. Virtually no measurable vibration, and has potential operating life of at least ten years.

  2. Comparison of neptunium sorption results using batch and column techniques

    SciTech Connect

    Triay, I.R.; Furlano, A.C.; Weaver, S.C.; Chipera, S.J.; Bish, D.L.

    1996-08-01

    We used crushed-rock columns to study the sorption retardation of neptunium by zeolitic, devitrified, and vitric tuffs typical of those at the site of the potential high-level nuclear waste repository at Yucca Mountain, Nevada. We used two sodium bicarbonate waters (groundwater from Well J-13 at the site and water prepared to simulate groundwater from Well UE-25p No. 1) under oxidizing conditions. It was found that values of the sorption distribution coefficient, Kd, obtained from these column experiments under flowing conditions, regardless of the water or the water velocity used, agreed well with those obtained earlier from batch sorption experiments under static conditions. The batch sorption distribution coefficient can be used to predict the arrival time for neptunium eluted through the columns. On the other hand, the elution curves showed dispersivity, which implies that neptunium sorption in these tuffs may be nonlinear, irreversible, or noninstantaneous. As a result, use of a batch sorption distribution coefficient to calculate neptunium transport through Yucca Mountain tuffs would yield conservative values for neptunium release from the site. We also noted that neptunium (present as the anionic neptunyl carbonate complex) never eluted prior to tritiated water, which implies that charge exclusion does not appear to exclude neptunium from the tuff pores. The column experiments corroborated the trends observed in batch sorption experiments: neptunium sorption onto devitrified and vitric tuffs is minimal and sorption onto zeolitic tuffs decreases as the amount of sodium and bicarbonate/carbonate in the water increases.

  3. Evolution and Advection of Solar Mesogranulation

    DTIC Science & Technology

    1992-03-01

    unprecedented clarity. We see that the supergranules, which are known to carry along (advect) the granules with their convective motion, also advect...I Solar mesogranulation, Solar observations, Solar super- 2 granulation 16. PRICE COCE 1i7. SECJ-3T LSiIATO 8 EUITY CLASSIFICA ION 19. SECURITY CLAS...mo~iesý sho~ed that granules are adl~ectedl b• Richard Muller*, Hers& Auffret*, Thierry Roudiert, the larger-scale consectie flowss. and thu, could

  4. Analytical models of the impact of two-phase sorption on subsurface transport of volatile chemicals

    SciTech Connect

    Shoemaker, C.A.; Culver, T.B.; Lion, L.W.; Peterson, M.G. )

    1990-04-01

    Unsaturated zone models incorporating the impact of vapor-phase sorption on transport of volatile organic compounds are presented with closed from solutions for one-and two-dimensional cases. In addition to vapor-phase sorption the models incorporate liquid-phase sorption, liquid advection, gaseous diffusion, and volatilization into soil air spaces and to the atmosphere. The motivation for incorporation of vapor-phase sorption arises from recent experimental results by the authors indicating that vapor-phase sorption may be orders of magnitude higher than liquid-phase sorption under certain soil conditions. The sensitivity analysis suggests that there is considerable interaction among the physical and chemical processes involved in transport of volatile organic compounds. Pollutant concentrations are most affected by the Henry's law constant and gaseous diffusion; the speed of movement of the material depends most upon the pore water velocity and vapor-phase sorption. The incorporation of vapor-phase sorption can significantly reduce model predictions of the transport speed and amount of volatile chemical reaching the groundwater under dry soil conditions. This result is of considerable practical significance since models currently used for remediation and regulation do not include vapor-phase sorption.

  5. Kinetics of the sorption of triterpene saponin by hypercrosslinked polystyrene

    NASA Astrophysics Data System (ADS)

    Mironenko, N. V.; Brezhneva, T. A.; Selemenev, V. F.

    2013-03-01

    The kinetics of sorption of triterpene saponin by the polymer sorbent NM-200 is considered. The influence of the surface activity of glycoside on the rate of formation and structure of the adsorption layer on the sorbent's surface is established. The rate-determining step of sorption is found to be diffusion into the sorbent grain. The value of the activation energy demonstrates the determining role of dispersion forces in the interaction between triterpene saponin and the polymer sorbent MN-200.

  6. Surfzone alongshore advective accelerations: observations and modeling

    NASA Astrophysics Data System (ADS)

    Hansen, J.; Raubenheimer, B.; Elgar, S.

    2014-12-01

    The sources, magnitudes, and impacts of non-linear advective accelerations on alongshore surfzone currents are investigated with observations and a numerical model. Previous numerical modeling results have indicated that advective accelerations are an important contribution to the alongshore force balance, and are required to understand spatial variations in alongshore currents (which may result in spatially variable morphological change). However, most prior observational studies have neglected advective accelerations in the alongshore force balance. Using a numerical model (Delft3D) to predict optimal sensor locations, a dense array of 26 colocated current meters and pressure sensors was deployed between the shoreline and 3-m water depth over a 200 by 115 m region near Duck, NC in fall 2013. The array included 7 cross- and 3 alongshore transects. Here, observational and numerical estimates of the dominant forcing terms in the alongshore balance (pressure and radiation-stress gradients) and the advective acceleration terms will be compared with each other. In addition, the numerical model will be used to examine the force balance, including sources of velocity gradients, at a higher spatial resolution than possible with the instrument array. Preliminary numerical results indicate that at O(10-100 m) alongshore scales, bathymetric variations and the ensuing alongshore variations in the wave field and subsequent forcing are the dominant sources of the modeled velocity gradients and advective accelerations. Additional simulations and analysis of the observations will be presented. Funded by NSF and ASDR&E.

  7. Diffusion and Advection using Cellular Potts Model

    NASA Astrophysics Data System (ADS)

    Dan, Debasis; Glazier, James

    2005-03-01

    The Cellular Potts Model (CPM) is a robust cell level methodology for simulation of biological tissues and morphogenesis. Standard diffusion solvers in the CPM use finite difference methods on the underlying CPM lattice. These methods have difficulty in simulating local advection in the ECM due to physiology and morphogenesis. To circumvent the problem of instabilities we simulate advection-diffusion within the framework of CPM using off-lattice finite-difference methods. We define a set of generalised fluid "cells" or particles which separate advection and diffusion from the lattice. Diffusion occurs between neighboring fluid cells by local averaging rules which approximate the Laplacian. CPM movement of the cells by spin flips handles the advection. The extension allows the CPM to model viscosity explicitly by including a relative velocity constraint on the fluid. The extended CPM correctly reproduces flow profiles of viscous fluids in cylindrical tube, during Stokes flow across a sphere and in flow in concentric cylindrical shells. We illustrate various conditions for diffusion including multiple instantaneous sources, continuous sources, moving sources and different boundary geometries and conditions to validate our approximation by comparing with analytical and established numerical solutions.

  8. 3D Flow Visualization Using Texture Advection

    NASA Technical Reports Server (NTRS)

    Kao, David; Zhang, Bing; Kim, Kwansik; Pang, Alex; Moran, Pat (Technical Monitor)

    2001-01-01

    Texture advection is an effective tool for animating and investigating 2D flows. In this paper, we discuss how this technique can be extended to 3D flows. In particular, we examine the use of 3D and 4D textures on 3D synthetic and computational fluid dynamics flow fields.

  9. Changes in induced polarization associated with the sorption of sodium, lead, and zinc on silica sands.

    PubMed

    Vaudelet, P; Revil, A; Schmutz, M; Franceschi, M; Bégassat, P

    2011-08-15

    Low-frequency dielectric spectroscopy can be measured in terms of a conductance and a phase lag between the electrical current and the electrical field. This conductance and phase lag can be written as into a complex conductivity with both an in-phase and quadrature components that are frequency dependent. In sands, the low-frequency (10 mHz-40 kHz) spectra of the complex conductivity are dominated by the polarization of the electrical double layer (especially the internal part of the electrical double layer called the Stern layer) and the Maxwell-Wagner polarization (typically above 100 Hz). We present a polarization that is able to explain the complex conductivity spectra including the grain size distribution, the porosity, and the complexation of the mineral surface with the ions of the pore water. To test this model, we investigate the sorption of various cations (Na, Pb, Zn) characterized by different affinities with the surface of silica. Sand column experiments were carried out to see the change in the complex conductivity during the advective/dispersive transport of a lead nitrate solution and a zinc sulfate solution, replacing a sodium chloride solution in the pore space of the sand. The complex conductivity model is able to explain the change of the phase over time.

  10. Study of Sorption Properties of Aluminium Oxides and Hydroxides Powders Obtained by Electro-Impulse Methods

    NASA Astrophysics Data System (ADS)

    Zhuravkov, S. P.; Lobanova, G. L.; Martemiyanov, D. V.; Nadeina, L. V.

    2015-04-01

    Experimental results of physicochemical and sorption properties of material samples obtained by electro-spark dispersion in water and by conductor electric explosion in argon are shown in the paper. Due to comparison of investigated samples sorption activity under static conditions, it was able to determine the most effective samples in the process of extraction of Cu2+ ions from aqueous solutions.

  11. Determination of bacterial and viral transport parameters in a gravel aquifer assuming linear kinetic sorption and desorption

    NASA Astrophysics Data System (ADS)

    Mallén, G.; Maloszewski, P.; Flynn, R.; Rossi, P.; Engel, M.; Seiler, K.-P.

    2005-05-01

    The bacteria Escherichia coli and Pseudomonas putida, and the bacteriophage virus H40/1 are examined both for their transport behaviour relative to inert solute tracers and for their modelability under natural flow conditions in a gravel aquifer. The microbes are attenuated in the following sequence: H40/1≥ P. putida≫ E. coli. The latter is desorbed almost completely within a few days. Breakthrough and recovery curves of the simultaneously injected non-reactive tracers are simulated with the 2D and 1D dispersion equation, in order to ascertain longitudinal dispersivity ( αL) and mean flow time ( T0). Mathematical modelling is difficult due to the aquifer heterogeneity, which results in preferential flow paths between injection and observation wells. Therefore, any attempt of fitting the dispersion model (DM) to the entire inert-tracer breakthrough curve (BTC) fails. Adequate fitting of the model to measured data only succeeds using a DM consisting of a superposition of several BTCs, each representing another set of flow paths. This gives rise to a multimodal, rather than a Gaussian groundwater velocity distribution. Only hydraulic parameters derived from the fastest partial curve, which is fitted to the rising part of the Uranine BTC, are suitable to model microbial breakthroughs. The hydraulic parameters found using 2D and 1D models were nearly identical. Their values were put into an analytical solution of 1D advective-dispersive transport combined with two-site reaction model introduced by Cameron and Klute [Cameron, D.R., Klute, A., 1977. Convective-dispersive solute transport with a combined equilibrium and kinetic adsorption model. Water Resour. Res. 13, 183-189], in order to identify reactive transport parameters (sorption/desorption) and attenuation mechanisms for the microbes migration. This shows that the microbes are almost entirely transported through preferential flow paths, which are represented by the first partial curve. Inert tracers, however

  12. Hydrophobic conjugated microporous polymers for sorption of human serum albumin

    NASA Astrophysics Data System (ADS)

    Zheng, Chunli; Du, Miaomiao; Feng, Shanshan; Sun, Hanxue; Li, An; He, Chi; Zhang, TianCheng; Wang, Qiaorui; Wei, Wei

    2016-02-01

    This paper investigated the sorption of human serum albumin (HSA) from water by three kinds of conjugated microporous polymers (CMPs) with surface hydrophobicity and intrinsic porosity. It was found that the three CMPs captured HSA with fast sorption kinetics and good working capacity. Equilibrium was obtained at 80 min for all the tests, and the maximum sorption quantity (qm) ranged from 0.07 to 0.14 mg/mg. With the increase in the particle external surface area of the CMPs, a greater extent of HSA sorption was achieved. Moreover, promoting the dispersion of CMPs in HSA aqueous solution was also beneficial to the extraction. Attenuated Total Reflection Fourier Transform Infrared spectroscopy verified the interactions between the CMPs and the Nsbnd H, Cdbnd O, and Csbnd N groups of HSA. This paper might provide fundamental guidance for the practical application of CMPs to proteins separation and recovery.

  13. Sorption of peat humic acids to multi-walled carbon nanotubes.

    PubMed

    Wang, Xilong; Shu, Liang; Wang, Yanqi; Xu, Bingbing; Bai, Yingchen; Tao, Shu; Xing, Baoshan

    2011-11-01

    Sorption of humic acids (HAs) from a peat soil by multiwalled carbon nanotubes (MWCNTs) was examined in this work. Sorption rate of HAs to MWCNTs was dominantly controlled by their diffusion from liquid-MWCNT boundary to MWCNT surfaces. Size exclusion chromatography analysis did not detect preferential sorption of HA fractions to MWCNTs at equilibrium, whereas the components with lower molecular weight in some HA fractions (e.g., HA1) would more preferentially be sorbed to MWCNTs at the initial sorption stage. Equilibrium sorption intensity of HAs by MWCNTs was dependent on their surface area and a sum of meso- and macropore volume. The surface area and sum of meso- and macroporosity-normalized sorption coefficient (K(d)) values of a given HA by MWCNTs increased with increasing outer diameter of MWCNTs, because MWCNTs with larger outer diameter were more strongly dispersed by HAs thereby making more sorption sites exposed for HA sorption. Van der Waals interaction between the alkyl components rather than the aromatic ones of HAs with MWCNTs was likely the key driving force for their sorption. This study highlights the sorption rate-controlling step of HAs from a same source to MWCNTs and the major factors affecting their sorption intensity at equilibrium.

  14. Solving the advection-diffusion equations in biological contexts using the cellular Potts model

    NASA Astrophysics Data System (ADS)

    Dan, Debasis; Mueller, Chris; Chen, Kun; Glazier, James A.

    2005-10-01

    The cellular Potts model (CPM) is a robust, cell-level methodology for simulation of biological tissues and morphogenesis. Both tissue physiology and morphogenesis depend on diffusion of chemical morphogens in the extra-cellular fluid or matrix (ECM). Standard diffusion solvers applied to the cellular potts model use finite difference methods on the underlying CPM lattice. However, these methods produce a diffusing field tied to the underlying lattice, which is inaccurate in many biological situations in which cell or ECM movement causes advection rapid compared to diffusion. Finite difference schemes suffer numerical instabilities solving the resulting advection-diffusion equations. To circumvent these problems we simulate advection diffusion within the framework of the CPM using off-lattice finite-difference methods. We define a set of generalized fluid particles which detach advection and diffusion from the lattice. Diffusion occurs between neighboring fluid particles by local averaging rules which approximate the Laplacian. Directed spin flips in the CPM handle the advective movement of the fluid particles. A constraint on relative velocities in the fluid explicitly accounts for fluid viscosity. We use the CPM to solve various diffusion examples including multiple instantaneous sources, continuous sources, moving sources, and different boundary geometries and conditions to validate our approximation against analytical and established numerical solutions. We also verify the CPM results for Poiseuille flow and Taylor-Aris dispersion.

  15. Status Of Sorption Cryogenic Refrigeration

    NASA Technical Reports Server (NTRS)

    Jones, Jack A.

    1988-01-01

    Report reviews sorption refrigeration. Developed for cooling infrared detectors, cryogenic research, and other advanced applications, sorption refrigerators have few moving parts, little vibration, and lifetimes of 10 years or more. Describes types of sorption stages, multistage and hybrid refrigeration systems, power requirements, cooling capacities, and advantages and disadvantages of various stages and systems.

  16. Sorption vacuum trap

    NASA Technical Reports Server (NTRS)

    Barrington, A. E.; Caruso, A. J.

    1970-01-01

    Modified sorption trap for use in high vacuum systems contains provisions for online regeneration of sorbent material. Trap is so constructed that it has a number of encapsulated resistance heaters and a valving and pumping device for removing gases from heated sorbing material. Excessive downtime is eliminated with this trap.

  17. Capillary deposition of advected floating particles

    NASA Astrophysics Data System (ADS)

    Dressaire, Emilie; Debaisieux, Aymeric; Gregori, Federico

    2016-11-01

    The deposition and aggregation of particles flowing through a confined environment can dramatically hinder the transport of suspensions. Yet, the mechanisms responsible for the deposition of particles in shear flow are not fully understood. Here, we use an experimental model system in which floating particles are advected on the surface of a water channel and deposited on fixed obstacles through attractive capillary effects. By varying the flow rate of the liquid, the wetting properties and size of the particles and obstacles, we can tune the magnitude of the capillary and hydrodynamic forces that determine the probability of deposition and the equilibrium position on the substrate. We show that arrays of obstacles can be designed to efficiently capture the floating particles advected by the flow.

  18. Distributed Parallel Particle Advection using Work Requesting

    SciTech Connect

    Muller, Cornelius; Camp, David; Hentschel, Bernd; Garth, Christoph

    2013-09-30

    Particle advection is an important vector field visualization technique that is difficult to apply to very large data sets in a distributed setting due to scalability limitations in existing algorithms. In this paper, we report on several experiments using work requesting dynamic scheduling which achieves balanced work distribution on arbitrary problems with minimal communication overhead. We present a corresponding prototype implementation, provide and analyze benchmark results, and compare our results to an existing algorithm.

  19. High Order Semi-Lagrangian Advection Scheme

    NASA Astrophysics Data System (ADS)

    Malaga, Carlos; Mandujano, Francisco; Becerra, Julian

    2014-11-01

    In most fluid phenomena, advection plays an important roll. A numerical scheme capable of making quantitative predictions and simulations must compute correctly the advection terms appearing in the equations governing fluid flow. Here we present a high order forward semi-Lagrangian numerical scheme specifically tailored to compute material derivatives. The scheme relies on the geometrical interpretation of material derivatives to compute the time evolution of fields on grids that deform with the material fluid domain, an interpolating procedure of arbitrary order that preserves the moments of the interpolated distributions, and a nonlinear mapping strategy to perform interpolations between undeformed and deformed grids. Additionally, a discontinuity criterion was implemented to deal with discontinuous fields and shocks. Tests of pure advection, shock formation and nonlinear phenomena are presented to show performance and convergence of the scheme. The high computational cost is considerably reduced when implemented on massively parallel architectures found in graphic cards. The authors acknowledge funding from Fondo Sectorial CONACYT-SENER Grant Number 42536 (DGAJ-SPI-34-170412-217).

  20. Efficient mass transport by optical advection

    PubMed Central

    Kajorndejnukul, Veerachart; Sukhov, Sergey; Dogariu, Aristide

    2015-01-01

    Advection is critical for efficient mass transport. For instance, bare diffusion cannot explain the spatial and temporal scales of some of the cellular processes. The regulation of intracellular functions is strongly influenced by the transport of mass at low Reynolds numbers where viscous drag dominates inertia. Mimicking the efficacy and specificity of the cellular machinery has been a long time pursuit and, due to inherent flexibility, optical manipulation is of particular interest. However, optical forces are relatively small and cannot significantly modify diffusion properties. Here we show that the effectiveness of microparticle transport can be dramatically enhanced by recycling the optical energy through an effective optical advection process. We demonstrate theoretically and experimentally that this new advection mechanism permits an efficient control of collective and directional mass transport in colloidal systems. The cooperative long-range interaction between large numbers of particles can be optically manipulated to create complex flow patterns, enabling efficient and tunable transport in microfluidic lab-on-chip platforms. PMID:26440069

  1. Does phosphate sorption influence soil particle disperdibility?

    NASA Astrophysics Data System (ADS)

    Barberis, Elisabetta; Celi, Luisella

    2010-05-01

    Phosphorus is a limiting element for algae growth, thus contributing to euthrophication. In some regions, agriculture is considered the principal non-point source of P entering surface waters. Most phosphorus transfer from rural watershed towards waters occurs during storm-flow periods and particulate P is often the major form transported because the P is attached to eroding soil particles. Phosphorus transfer is thus closely linked to P accumulation on soil particles, mainly due to elevated P loading, and to detachment and dispersion processes occurring at the soil surface which, in turn, are strongly influenced by soil chemical-physical properties such as soil texture, organic matter (OM) and pH. In addition, soil colloidal particles dispersion is influenced by their surface charge characteristics. Sorption of inorganic or organic P forms on clay particles is known to modify the surface charge which induces clay dispersion or flocculation. The effect of P sorption on particles disperdibility will be discussed at laboratory, plot and catchment scale taking into account the effects of organic matter content, pH and composition of the soil solution.

  2. TECHNETIUM SORPTION MEDIA REVIEW

    SciTech Connect

    DUNCAN JB; KELLY SE; ROBBINS RA; ADAMS RD; THORSON MA; HAASS CC

    2011-08-25

    This report presents information and references to aid in the selection of 99Tc sorption media for feasibility studies regarding the removal of 99Tc from Hanford's low activity waste. The report contains literature search material for sorption media (including ion exchange media) for the most tested media to date, including SuperLig 639, Reillex HPQ, TAM (Kruion), Purolite A520E and A530E, and Dowex 1X8. The U.S. Department of Energy (DOE), Office of River Protection (ORP) is responsible for management and completion of the River Protection Project (RPP) mission, which comprises both the Hanford Site tank farms and the Waste Treatment and Immobilization Plant (WTP). The RPP mission is to store, retrieve and treat Hanford's tank waste; store and dispose of treated wastes; and close the tank farm waste management areas and treatment facilities in a safe, environmentally compliant, cost-effective and energy-effective manner.

  3. Population persistence under advection-diffusion in river networks.

    PubMed

    Ramirez, Jorge M

    2012-11-01

    An integro-differential equation on a tree graph is used to model the time evolution and spatial distribution of a population of organisms in a river network. Individual organisms become mobile at a constant rate, and disperse according to an advection-diffusion process with coefficients that are constant on the edges of the graph. Appropriate boundary conditions are imposed at the outlet and upstream nodes of the river network. The local rates of population growth/decay and that by which the organisms become mobile, are assumed constant in time and space. Imminent extinction of the population is understood as the situation whereby the zero solution to the integro-differential equation is stable. Lower and upper bounds for the eigenvalues of the dispersion operator, and related Sturm-Liouville problems are found. The analysis yields sufficient conditions for imminent extinction and/or persistence in terms of the values of water velocity, channel length, cross-sectional area and diffusivity throughout the river network.

  4. Wind tunnel measurement of turbulent and advective scalar fluxes: a case study on intersection ventilation.

    PubMed

    Kukačka, Libor; Nosek, Štĕpán; Kellnerová, Radka; Jurčáková, Klára; Jaňour, Zbyněk

    2012-01-01

    The objective of this study is to determine processes of pollution ventilation in the X-shaped street intersection in an idealized symmetric urban area for the changing approach flow direction. A unique experimental setup for simultaneous wind tunnel measurement of the flow velocity and the tracer gas concentration in a high temporal resolution is assembled. Advective horizontal and vertical scalar fluxes are computed from averaged measured velocity and concentration data within the street intersection. Vertical advective and turbulent scalar fluxes are computed from synchronized velocity and concentration signals measured in the plane above the intersection. All the results are obtained for five approach flow directions. The influence of the approach flow on the advective and turbulent fluxes is determined. The contribution of the advective and turbulent flux to the ventilation is discussed. Wind direction with the best dispersive conditions in the area is found. The quadrant analysis is applied to the synchronized signals of velocity and concentration fluctuation to determine events with the dominant contribution to the momentum flux and turbulent scalar flux.

  5. Wind Tunnel Measurement of Turbulent and Advective Scalar Fluxes: A Case Study on Intersection Ventilation

    PubMed Central

    Kukačka, Libor; Nosek, Štĕpán; Kellnerová, Radka; Jurčáková, Klára; Jaňour, Zbyněk

    2012-01-01

    The objective of this study is to determine processes of pollution ventilation in the X-shaped street intersection in an idealized symmetric urban area for the changing approach flow direction. A unique experimental setup for simultaneous wind tunnel measurement of the flow velocity and the tracer gas concentration in a high temporal resolution is assembled. Advective horizontal and vertical scalar fluxes are computed from averaged measured velocity and concentration data within the street intersection. Vertical advective and turbulent scalar fluxes are computed from synchronized velocity and concentration signals measured in the plane above the intersection. All the results are obtained for five approach flow directions. The influence of the approach flow on the advective and turbulent fluxes is determined. The contribution of the advective and turbulent flux to the ventilation is discussed. Wind direction with the best dispersive conditions in the area is found. The quadrant analysis is applied to the synchronized signals of velocity and concentration fluctuation to determine events with the dominant contribution to the momentum flux and turbulent scalar flux. PMID:22649290

  6. A computational method for sharp interface advection

    PubMed Central

    Bredmose, Henrik; Jasak, Hrvoje

    2016-01-01

    We devise a numerical method for passive advection of a surface, such as the interface between two incompressible fluids, across a computational mesh. The method is called isoAdvector, and is developed for general meshes consisting of arbitrary polyhedral cells. The algorithm is based on the volume of fluid (VOF) idea of calculating the volume of one of the fluids transported across the mesh faces during a time step. The novelty of the isoAdvector concept consists of two parts. First, we exploit an isosurface concept for modelling the interface inside cells in a geometric surface reconstruction step. Second, from the reconstructed surface, we model the motion of the face–interface intersection line for a general polygonal face to obtain the time evolution within a time step of the submerged face area. Integrating this submerged area over the time step leads to an accurate estimate for the total volume of fluid transported across the face. The method was tested on simple two-dimensional and three-dimensional interface advection problems on both structured and unstructured meshes. The results are very satisfactory in terms of volume conservation, boundedness, surface sharpness and efficiency. The isoAdvector method was implemented as an OpenFOAM® extension and is published as open source. PMID:28018619

  7. Striated populations in disordered environments with advection

    NASA Astrophysics Data System (ADS)

    Chotibut, Thiparat; Nelson, David R.; Succi, Sauro

    2017-01-01

    Growth in static and controlled environments such as a Petri dish can be used to study the spatial population dynamics of microorganisms. However, natural populations such as marine microbes experience fluid advection and often grow up in heterogeneous environments. We investigate a generalized Fisher-Kolmogorov-Petrovsky-Piscounov (FKPP) equation describing single species population subject to a constant flow field and quenched random spatially inhomogeneous growth rates with a fertile overall growth condition. We analytically and numerically demonstrate that the non-equilibrium steady-state population density develops a flow-driven striation pattern. The striations are highly asymmetric with a longitudinal correlation length that diverges linearly with the flow speed and a transverse correlation length that approaches a finite velocity-independent value. Linear response theory is developed to study the statistics of the steady states. Theoretical predictions show excellent agreement with the numerical steady states of the generalized FKPP equation obtained from Lattice Boltzmann simulations. These findings suggest that, although the growth disorder can be spatially uncorrelated, correlated population structures with striations emerge naturally at sufficiently strong advection.

  8. Waves, advection, and cloud patterns on Venus

    NASA Technical Reports Server (NTRS)

    Schinder, Paul J.; Gierasch, Peter J.; Leroy, Stephen S.; Smith, Michael D.

    1990-01-01

    The stable layers adjacent to the nearly neutral layer within the Venus clouds are found to be capable of supporting vertically trapped, horizontally propagating waves with horizontal wavelengths of about 10 km and speeds of a few meters per second relative to the mean wind in the neutral layer. These waves may possibly be excited by turbulence within the neutral layer. Here, the properties of the waves, and the patterns which they might produce within the visible clouds if excited near the subsolar point are examined. The patterns can be in agreement with many features in images. The waves are capable of transferring momentum latitudinally to help maintain the general atmospheric spin, but at present we are not able to evaluate wave amplitudes. We also examine an alternative possibility that the cloud patterns are produced by advection and shearing by the mean zonal and meridional flow of blobs formed near the equator. It is concluded that advection and shearing by the mean flow is the most likely explanation for the general pattern of small scale striations.

  9. Parallel algorithms for semi-lagrangian advection

    NASA Astrophysics Data System (ADS)

    Malevsky, A. V.; Thomas, S. J.

    1997-08-01

    Numerical time step limitations associated with the explicit treatment of advection-dominated problems in computational fluid dynamics are often relaxed by employing Eulerian-Lagrangian methods. These are also known as semi-Lagrangian methods in the atmospheric sciences. Such methods involve backward time integration of a characteristic equation to find the departure point of a fluid particle arriving at a Eulerian grid point. The value of the advected field at the departure point is obtained by interpolation. Both the trajectory integration and repeated interpolation influence accuracy. We compare the accuracy and performance of interpolation schemes based on piecewise cubic polynomials and cubic B-splines in the context of a distributed memory, parallel computing environment. The computational cost and interprocessor communication requirements for both methods are reported. Spline interpolation has better conservation properties but requires the solution of a global linear system, initially appearing to hinder a distributed memory implementation. The proposed parallel algorithm for multidimensional spline interpolation has almost the same communication overhead as local piecewise polynomial interpolation. We also compare various techniques for tracking trajectories given different values for the Courant number. Large Courant numbers require a high-order ODE solver involving multiple interpolations of the velocity field.

  10. Equilibrium sorption of cobalt, cesium, and strontium on Bandelier Tuff: analysis of alternative mathematical modeling

    SciTech Connect

    Polzer, W.L.; Fuentes, H.R.; Essington, E.H.; Roensch, F.R.

    1985-01-01

    Sorption isotherms are derived from batch equilibrium data for cobalt, cesium and strontium on Bandelier Tuff. Experiments were conducted at an average temperature of 23/sup 0/C and equilibrium was defined at 48 hours. The solute concentrations ranged from 0 to 500 mg/L. The radioactive isotopes /sup 60/Co, /sup 137/Cs, and /sup 85/Sr were used to trace the sorption of the stable solutes. The Linear, Langmuir, Freundlich and a Modified Freundlich isotherm equations are evaluated. The Modified Freundlich isotherm equation is validated as a preferred general mathematical tool for representing the sorption of the three solutes. The empirical constants derived from the Modified Freundlich isotherm equation indicate that under dynamic flow conditions strontium will move most rapidly and cobalt least rapidly. On the other hand, chemical dispersion will be greatest for cesium and least for strontium. Hill Plots of the sorption data suggest that in the region of low saturation sorption of all three solutes is impeded by interactions among sorption sites; cobalt exhibits the greatest effect of interactions and strontium shows only a minimal effect. In the saturation region of 50% or more, sorption of cobalt is enhanced slightly by interactions among sorption sites whereas sorption of cesium and strontium appears to be independent of site interactions. 9 references, 4 figures, 2 tables.

  11. A numerical treatment of geodynamic viscous flow problems involving the advection of material interfaces

    NASA Technical Reports Server (NTRS)

    Lenardic, A.; Kaula, W. M.

    1993-01-01

    Effective numerical treatment of multicomponent viscous flow problems involving the advection of sharp interfaces between materials of differing physical properties requires correction techniques to prevent spurious diffusion and dispersion. We develop a particular algorithm, based on modern shock-capture techniques, employing a two-step nonlinear method. The first step involves the global application of a high-order upwind scheme to a hyperbolic advection equation used to model the distribution of distinct material components in a flow field. The second step is corrective and involves the application of a global filter designed to remove dispersion errors that result from the advection of discontinuities (e.g., material interfaces) by high-order, minimally dissipative schemes. The filter introduces no additional diffusion error. Nonuniform viscosity across a material interface is allowed for by the implementation of a compositionally weighted-inverse interface viscosity scheme. The combined method approaches the optimal accuracy of modern shock-capture techniques with a minimal increase in computational time and memory. A key advantage of this method is its simplicity to incorporate into preexisting codes be they finite difference, element, or volume of two or three dimensions.

  12. BUOYANT ADVECTION OF GASES IN UNSATURATED SOIL

    PubMed Central

    Seely, Gregory E.; Falta, Ronald W.; Hunt, James R.

    2010-01-01

    In unsaturated soil, methane and volatile organic compounds can significantly alter the density of soil gas and induce buoyant gas flow. A series of laboratory experiments was conducted in a two-dimensional, homogeneous sand pack with gas permeabilities ranging from 110 to 3,000 darcy. Pure methane gas was injected horizontally into the sand and steady-state methane profiles were measured. Experimental results are in close agreement with a numerical model that represents the advective and diffusive components of methane transport. Comparison of simulations with and without gravitational acceleration permits identification of conditions where buoyancy dominates methane transport. Significant buoyant flow requires a Rayleigh number greater than 10 and an injected gas velocity sufficient to overcome dilution by molecular diffusion near the source. These criteria allow the extension of laboratory results to idealized field conditions for methane as well as denser-than-air vapors produced by volatilizing nonaqueous phase liquids trapped in unsaturated soil. PMID:20396624

  13. Chaotic advection at the pore scale: Mechanisms, upscaling and implications for macroscopic transport

    NASA Astrophysics Data System (ADS)

    Lester, D. R.; Trefry, M. G.; Metcalfe, G.

    2016-11-01

    The macroscopic spreading and mixing of solute plumes in saturated porous media is ultimately controlled by processes operating at the pore scale. Whilst the conventional picture of pore-scale mechanical dispersion and molecular diffusion leading to persistent hydrodynamic dispersion is well accepted, this paradigm is inherently two-dimensional (2D) in nature and neglects important three-dimensional (3D) phenomena. We discuss how the kinematics of steady 3D flow at the pore scale generate chaotic advection-involving exponential stretching and folding of fluid elements-the mechanisms by which it arises and implications of microscopic chaos for macroscopic dispersion and mixing. Prohibited in steady 2D flow due to topological constraints, these phenomena are ubiquitous due to the topological complexity inherent to all 3D porous media. Consequently 3D porous media flows generate profoundly different fluid deformation and mixing processes to those of 2D flow. The interplay of chaotic advection and broad transit time distributions can be incorporated into a continuous-time random walk (CTRW) framework to predict macroscopic solute mixing and spreading. We show how these results may be generalised to real porous architectures via a CTRW model of fluid deformation, leading to stochastic models of macroscopic dispersion and mixing which both honour the pore-scale kinematics and are directly conditioned on the pore-scale architecture.

  14. Vertical barriers with increased sorption capacities

    SciTech Connect

    Bradl, H.B.

    1997-12-31

    Vertical barriers are commonly used for the containment of contaminated areas. Due to the very small permeability of the barrier material which is usually in the order of magnitude of 10-10 m/s or less the advective contaminant transport can be more or less neglected. Nevertheless, there will always be a diffusive contaminant transport through the barrier which is caused by the concentration gradient. Investigations have been made to increase the sorption capacity of the barrier material by adding substances such as organoclays, zeolites, inorganic oxides and fly ashes. The contaminants taken into account where heavy metals (Pb) and for organic contaminants Toluole and Phenantrene. The paper presents results of model calculations and experiments. As a result, barrier materials can be designed {open_quotes}tailor-made{close_quotes} depending on the individual contaminant range of each site (e.g. landfills, gasworks etc.). The parameters relevant for construction such as rheological properties, compressive strength and permeability are not affected by the addition of the sorbents.

  15. Simulation of the advective methane transport and AOM in Shenhu area, the Northern South China Sea

    NASA Astrophysics Data System (ADS)

    Liu, L.; Wu, N.

    2012-04-01

    Anaerobic Oxidation of Methane (AOM) occurs in the transition zone between the presence of sulfate and methane. This reaction is an important process for methane and the global carbon cycle. Methane gas hydrates bearing sediments were recovered in Shenhu Area, the Northern South China Sea, and methane advective transport was detected in this area as well. A one dimension numerical simulation tool was implemented to study the AOM process combined with the advective methane transport in Shenhu Area according to the local drilling data and geochemical information. The modeled results suggest that local methane flux will be consumed in the sediment column via dissolution, sorption and AOM reaction. A portion of methane will enter water column and possibly atmosphere if the methane flux was one order of magnitude higher than current level. Furthermore, the calculated rates of AOM in Shenhu area range similar to that of gas hydrate mounds in Mexico Golf. However, AOM is ability to consume more methane than that in Golf of Mexico due to the lower permeable sediment associated with a deeper sulfate methane transition layer.

  16. Assessment of advective porewater movement affecting mass transfer of hydrophobic organic contaminants in marine intertidal sediment.

    PubMed

    Cho, Yeo-Myoung; Werner, David; Moffett, Kevan B; Luthy, Richard G

    2010-08-01

    Advective porewater movement and molecular diffusion are important factors affecting the mass transfer of hydrophobic organic compounds (HOCs) in marsh and mudflat sediments. This study assessed porewater movement in an intertidal mudflat in South Basin adjacent to Hunters Point Shipyard, San Francisco, CA, where a pilot-scale test of sorbent amendment assessed the in situ stabilization of polychlorinated biphenyls (PCBs). To quantify advective porewater movement within the top 0-60 cm sediment layer, we used temperature as a tracer and conducted heat transport analysis using 14-day data from multidepth sediment temperature logging stations and one-dimensional heat transport simulations. The best-fit conditions gave an average Darcy velocity of 3.8cm/d in the downward vertical direction for sorbent-amended sediment with a plausible range of 0 cm/d to 8 cm/d. In a limiting case with no net advection, the best-fit depth-averaged mechanical dispersion coefficient was 2.2x10(-7) m2/s with a range of 0.9x10(-7) m2/s to 5.6x10(-7) m2/s. The Peclet number for PCB mobilization showed that molecular diffusion would control PCB mass transfer from sediment to sorbent particles for the case of uniform distribution of sorbent. However, the advective flow and mechanical dispersion in the test site would significantly benefit the stabilization effect of heterogeneously distributed sorbent by acting to smooth out the heterogeneities and homogenizing pollutant concentrations across the entire bioactive zone. These measurements and modeling techniques on intertidal sediment porewater transport could be useful for the development of more reliable mass transfer models for the prediction of contaminant release within the sediment bed, the movement of HOCs in the intertidal aquatic environment, and in situ sequestration by sorbent addition.

  17. Sorption isotherms and isosteric heats of sorption of Malaysian paddy.

    PubMed

    Mousa, Wael; Ghazali, Farinazleen Mohamad; Jinap, S; Ghazali, Hasanah Mohd; Radu, Son

    2014-10-01

    Understanding the water sorption characteristics of cereal is extremely essential for optimizing the drying process and ensuring storage stability. Water relation of rough rice was studied at 20, 30, 40 and 50 °C over relative humidity (RH.) between 0.113 and 0.976 using the gravimetric technique. The isotherms displayed the general sigmoid, Type II pattern and exhibited the phenomenon of hysteresis where it was more pronounced at lower temperatures. The sorption characteristics were temperature dependence where the sorption capacity of the paddy increased as the temperature was decreased at fixed (RH). Among the models assessed for their ability to fit the sorption data, Oswin equation was the best followed by the third order polynomial, GAB, Smith, Chung-Pfost, and Henderson models. The monolayer moisture content was higher for desorption than adsorption and tend to decrease with the increase in temperature. Given the temperature dependence of the sorption isotherms the isosteric heats of sorption were calculated using Claussius-Clapeyron equation. The net isosteric heats decreased as the moisture content was increased and heats of desorption were greater than that of adsorption.

  18. Sorption of aniline derivatives on carbon fabric

    NASA Astrophysics Data System (ADS)

    Fazylova, G. F.; Valinurova, E. R.; Khamitov, E. M.; Kudasheva, F. Kh.

    2015-06-01

    The statistical adsorption of the chloro- and nitroderivatives of aniline on carbon fabric UVIS-AK was studied. The sorption isotherms of anilines on carbon fabric and coals were constructed at room temperature and a comparative analysis of their sorption activity was performed. The sorption isotherms were linearized in the coordinates of the Langmuir and Dubinin-Radushkevich equations. The main sorption parameters were calculated: the characteristic adsorption energies of anilines, changes in the Gibbs energies, monolayer capacities, and sorption equilibrium constants.

  19. Advection, diffusion, and delivery over a network.

    PubMed

    Heaton, Luke L M; López, Eduardo; Maini, Philip K; Fricker, Mark D; Jones, Nick S

    2012-08-01

    Many biological, geophysical, and technological systems involve the transport of a resource over a network. In this paper, we present an efficient method for calculating the exact quantity of the resource in each part of an arbitrary network, where the resource is lost or delivered out of the network at a given rate, while being subject to advection and diffusion. The key conceptual step is to partition the resource into material that does or does not reach a node over a given time step. As an example application, we consider resource allocation within fungal networks, and analyze the spatial distribution of the resource that emerges as such networks grow over time. Fungal growth involves the expansion of fluid filled vessels, and such growth necessarily involves the movement of fluid. We develop a model of delivery in growing fungal networks, and find good empirical agreement between our model and experimental data gathered using radio-labeled tracers. Our results lead us to suggest that in foraging fungi, growth-induced mass flow is sufficient to account for long-distance transport, if the system is well insulated. We conclude that active transport mechanisms may only be required at the very end of the transport pathway, near the growing tips.

  20. Sorption isotherm measurements by NMR.

    PubMed

    Leisen, Johannes; Beckham, Haskell W; Benham, Michael

    2002-01-01

    An experimental setup is described for the automated recording of sorption isotherms by NMR experiments at precisely defined levels of relative humidity (RH). Implementation is demonstrated for a cotton fabric; Bloch decays. T1 and T2* relaxation times were measured at predefined steps of increasing and decreasing relative humidities (RHs) so that a complete isotherm of NMR properties was obtained. Bloch decays were analyzed by fitting to relaxation functions consisting or a slow- and a fast-relaxing component. The fraction of slow-relaxing component was greater than the fraction of sorbed moisture determined from gravimetric sorption data. The excess slow-relaxing component was attributed to plasticized segments of the formerly rigid cellulose matrix. T1 and T2* sorption isotherms exhibit hysteresis similar to gravimetric sorption isotherms. However, correlating RH to moisture content (MC) reveals that both relaxation constants depend only on MC, and not on the history of moisture exposure.

  1. Silica Precipitation and Lithium Sorption

    SciTech Connect

    Jay Renew

    2015-09-20

    This file contains silica precipitation and lithium sorption data from the project. The silica removal data is corrected from the previous submission. The previous submission did not take into account the limit of detection of the ICP-MS procedure.

  2. Linearity of iodine sorption and sorption capacities for seven soils

    SciTech Connect

    Sheppard, M.I.; Hawkins, J.L.; Smith, P.A.

    1996-11-01

    Iodine, a soluble and prevalent element in spent nuclear fuel and a pivotal element in the assessment of Canada`s nuclear fuel waste disposal option, sorbs to soils rich in organics and hydrous oxides. Biotic factors, such as microbes, enzymes and plant exudates, have been implicated in the retention of I to soils. Anion exchange of I{sup {minus}} or IO{sub 3}{sup {minus}} and chemical or biological oxidation to I{sub 2} followed by reactions with the soil organic matter are possible retention mechanisms. We have carried out sorption and desorption studies across a wide range of soil solution concentrations (10{sup {minus}7} to 10{sup 5} mg I/L, 10{sup {minus}12} to 1 M) for seven soils typical of upland and lowland soils of the Canadian Precambrian Shield. Soil solid-liquid partition values (K{sub d}), required for impact assessments, varied from 60 to 1800 L/kg and were significantly correlated with extractable Al oxide content, and background I and organic matter content. Freundlich isotherm fits show that sorption of I across our intentionally large concentration range is nonlinear; however, sorption of I across our intentionally large concentration range is nonlinear; however, sorption of I at environmental concentrations (<0.1 mg I/L soil solution) is linear and can be described by the K{sub d} model. Sorption of I was not related to peroxidase enzyme activity. Desorption percentages were small implying sorption was not easily reversed, even with a strong electrolyte, KNO{sub 3}. Desorption results and simple correlations of I sorption to soil properties suggest that the oxidation of I{sup {minus}} to I{sub 2} and complexation to organic functional groups or oxides are the major processes for I retention in Shield soils. 52 refs., 2 figs., 2 tabs.

  3. On a free boundary problem for a reaction-diffusion-advection logistic model in heterogeneous environment

    NASA Astrophysics Data System (ADS)

    Monobe, Harunori; Wu, Chang-Hong

    2016-12-01

    In this paper, we investigate a reaction-diffusion-advection equation with a free boundary which models the spreading of an invasive species in one-dimensional heterogeneous environments. We assume that the species has a tendency to move upward along the resource gradient in addition to random dispersal, and the spreading mechanism of species is determined by a Stefan-type condition. Investigating the sign of the principal eigenvalue of the associated linearized eigenvalue problem, under certain conditions we obtain the sharp criteria for spreading and vanishing via system parameters. Also, we establish the long-time behavior of the solution and the asymptotic spreading speed. Finally, some biological implications are discussed.

  4. Anisotropic Turbulent Advection of a Passive Vector Field: Effects of the Finite Correlation Time

    NASA Astrophysics Data System (ADS)

    Antonov, N. V.; Gulitskiy, N. M.

    2016-02-01

    The turbulent passive advection under the environment (velocity) field with finite correlation time is studied. Inertial-range asymptotic behavior of a vector (e.g., magnetic) field, passively advected by a strongly anisotropic turbulent flow, is investigated by means of the field theoretic renormalization group and the operator product expansion. The advecting velocity field is Gaussian, with finite correlation time and prescribed pair correlation function. The inertial-range behavior of the model is described by two regimes (the limits of vanishing or infinite correlation time) that correspond to nontrivial fixed points of the RG equations and depend on the relation between the exponents in the energy energy spectrum ɛ ∝ k⊥1-ξ and the dispersion law ω ∝ k⊥2-η . The corresponding anomalous exponents are associated with the critical dimensions of tensor composite operators built solely of the passive vector field itself. In contrast to the well-known isotropic Kraichnan model, where various correlation functions exhibit anomalous scaling behavior with infinite sets of anomalous exponents, here the dependence on the integral turbulence scale L has a logarithmic behavior: instead of power-like corrections to ordinary scaling, determined by naive (canonical) dimensions, the anomalies manifest themselves as polynomials of logarithms of L. Due to the presence of the anisotropy in the model, all multiloop diagrams are equal to zero, thus this result is exact.

  5. Designing for chaos: applications of chaotic advection at the microscale.

    PubMed

    Stremler, Mark A; Haselton, F R; Aref, Hassan

    2004-05-15

    Chaotic advection can play an important role in efficient microfluidic mixers. We discuss a design paradigm that exploits chaotic advection and illustrate by two recent examples, namely enhancing gene expression profiling and constructing an in-line microfluidic mixing channel, how application of this paradigm has led to successful micromixers. We suggest that 'designing for chaos', that is, basing practical mixer design on chaotic advection analysis, is a promising approach to adopt in this developing field which otherwise has little to guide it and is constrained by issues of scale and manufacturability.

  6. Clay with Desiccation Cracks is an Advection Dominated Environment

    NASA Astrophysics Data System (ADS)

    Baram, S.; Kurtzman, D.; Sher, Y.; Ronen, Z.; Dahan, O.

    2012-04-01

    , indicating deep soil evaporation. Daily fluctuation of the air temperature in the desiccation cracks supported thermally induced air convection within the cracks void and could explain the deep soil salinization process. Combination of all the abovementioned observations demonstrated that the formation of desiccation cracks network in dispersive clay sediments generates a bulk advection dominated environment for both air and water flow, and that the reference to clay sediments as "hydrologically safe" should to be reconsidered.

  7. Anomalous scaling of a scalar field advected by turbulence

    SciTech Connect

    Kraichnan, R.H.

    1995-12-31

    Recent work leading to deduction of anomalous scaling exponents for the inertial range of an advected passive field from the equations of motion is reviewed. Implications for other turbulence problems are discussed.

  8. Overcoming diffusion-limited processes using enhanced advective fields

    SciTech Connect

    Rasmussen, T.C.

    1995-12-31

    Many subsurface cleanup activities focus on the remediation of organic contaminants using induced advective fields. Subsurface heterogeneities cause most advective transport to occur in more permeable zones, with transport from the lower permeability units being limited by diffusion to the higher permeable units. While diffusion rates can be enhanced using thermal sources, many of the treatment strategies, including pump and treat, vapor extraction and bioremediation, are limited by mass exchange rates between the higher and lower permeability sand and clay mixtures. Instead of relying on the enhancement of diffusion rates, it is proposed that remediation strategies should focus on the enhancement of induced advective transport rates through the lower permeability units. Injection-extraction strategies using crosshole and huff-and-puff methods are presented for maximizing advective transport through lower permeability units. Optimization of the design can incorporate diffusion-enhancement technologies, bionourishment, capillary confinement in the unsaturated zone, and DNAPL slurping.

  9. Dynamic micro-mapping of CO2 sorption in coal

    SciTech Connect

    Radlinski, Andrzej Pawell; Melnichenko, Yuri B; Cheng, Gang; Mastalerz, Maria

    2009-01-01

    We have applied X-ray and neutron small-angle scattering techniques (SAXS, SANS and USANS) to study the interaction between fluids and porous media in the particular case of sub- and super-critical CO2 sorption in coal. These techniques are demonstrated to give unique, pore-size-specific insights into the kinetics of CO2 sorption in a wide range of coal pores (nano to meso), and to provide data that may be used to determine the density of the sorbed CO2. We observed densification of the adsorbed CO2 by a factor up to five compared to the free fluid at the same (p,T) conditions. Our results indicate that details of CO2 sorption into coal pores differ greatly between different coals and depend on the amount of mineral matter dispersed in the coal matrix: a purely organic matrix absorbs more CO2 per unit volume than one contaminated with mineral matter, but mineral matter markedly accelerates the sorption kinetics.

  10. Modeling of sorption characteristics of backfill materials

    SciTech Connect

    Chitra, S.; Sasidhar, P.; Lal, K.B.; Ahmed, J.

    1998-06-01

    Sorption data analysis was carried out using the Freundlich, Langmuir, and Modified Freundlich isotherms for the uptake of sodium and potassium in an initial concentration range of 10--100 mg/L on backfill materials, viz., bentonite, vermiculite, and soil samples. The soil samples were collected from a shallow land disposal facility at Kalpakkam. The Freundlich isotherm equation is validated as a preferred general mathematical tool for representing the sorption of K{sup +} by all the selected backfill materials. The Modified Freundlich isotherm equation is validated as a preferred mathematical tool for representing the sorption of Na{sup +} by the soil samples. Since a negative sorption was observed for the uptake of Na{sup +} by commercial clay minerals (vermiculite and bentonite clay in the laboratory experiments), sorption analysis could not be carried out using the above-mentioned isotherm equations. Hill plots of the sorption data suggest that in the region of low saturation (10--40 mg/L), sorption of K{sup +} by vermiculite is impeded by interaction among sorption sites. In the region of higher saturation (60--100 mg/L), sorption of K{sup +} by all three backfill materials is enhanced by interaction among sorption sites. The Hill plot of the sorption data for Na{sup +} by soil suggests that irrespective of Na{sup +} concentration, sorption of Na{sup +} at one exchange size enhances sorption at other exchange sites.

  11. Iodine sorption by highly weathered soils

    NASA Astrophysics Data System (ADS)

    Bruns, W. A.; Bruns, M. R.; Kaplan, D. I.; Murphy, T.; Roberts, K.; Thompson, A.; Seaman, J. C.

    2009-12-01

    Radioactive iodine (I) isotopes such as I-129 are widely distributed throughout Department of Energy (DOE) and other nuclear sites as a result of past enrichment activities. While natural-abundance I serves an important role in thyroid function in human beings, anthropogenic I can cause thyroid cancer. Predominant I species are anionic and generally assumed to move conservatively through typical negatively-charged subsurface material with the mobile water phase. However, many of the 129I contaminated soils and subsurface materials on the DOE Savannah River Site (SRS) near Aiken, SC, contain significant positive charge, which could retain I-129. A series of batch and column experiments were performed in order to determine sorption of three different I species (iodide, iodate, and an organic I compound, 4-iodaniline) over a range of aqueous concentrations (10^-4 to 10^-8 M) onto surface and subsurface soils from SRS. Total aqueous I in solution after equilibration was measured using ICP-MS and used to calculate the partitioning coefficient (Kd). Kd values for all three species were much higher at lower dissolved I concentrations (i.e., non-linear partitioning), and correlated with CDB-extractable Fe and Al and well as soil organic matter content. For the species and concentrations that exhibited high Kd values (>5), we conducted column experiments to evaluate partitioning under dynamic advective systems, using tritium for comparison as a conservative hydrologic tracer. We tracked pH, EC, and hydraulic head in real-time, and the effluent was collected for I analysis as described above. The results indicate a complex pattern of I movement in the natural environment affected by isotope concentration, speciation, and soil characteristics.

  12. Constraints upon water advection in sediments of the Mariana Trough

    SciTech Connect

    Abbott, D.H.; Menke, W.; Morin, R.

    1983-02-10

    Thermal gradient measurements, consolidation tests, and pore water compositions from the Mariana Trough imply that water is moving through the sediments in areas with less than about 100 m of sediment cover. The maximum advection rates implied by the thermal measurements and consolidation tests may be as high as 10/sup -5/ cm s/sup -1/ but are most commonly in the range of 1 to 5 x 10/sup -6/ cm s/sup -1/. Theoretical calculations of the effect of the highest advection rates upon carbonate dissolution indicate that dissolution may be impeded or enhanced (depending upon the direction of flow) by a factor of 2 to 5 times the rate for diffusion alone. The average percentage of carbonate is consistently higher in two cores from the area with no advection or upward advection than the average percentage of carbonate in three cores from the area with downward advection. This increase in average amount of carbonate in cores with upward moving water or no movement cannot be attributed solely to differences in water depth or in amount of terrigenous dilution. If the sediment column acts as a passive boundary layer, then the water velocities necessary to affect chemical gradients of silica are in the range 10/sup -9/ to 10/sup -10/ cm s/sup -1/. However, if dissolution of silica occurs within the sediment column, then the advection velocities needed to affect chemical gradients are at least 3 x 10/sup -8/ cm s/sup -1/ and may be as high as 3 x 10/sup -6/ cm s/sup -1/. This order of magnitude increase in advection velocities when chemical reactions occur within the sediments is probably applicable to other cations in addition to silica. If so, then the advection velocities needed to affect heat flow (>10/sup -8/ cm s/sup -1/) and pore water chemical gradients are much nearer in magnitude than previously assumed.

  13. Advection around ventilated U-shaped burrows: A model study

    NASA Astrophysics Data System (ADS)

    Brand, Andreas; Lewandowski, JöRg; Hamann, Enrico; Nützmann, Gunnar

    2013-05-01

    Advective transport in the porous matrix of sediments surrounding burrows formed by fauna such as Chironomus plumosus has been generally neglected. A positron emission tomography study recently revealed that the pumping activity of the midge larvae can indeed induce fluid flow in the sediment. We present a numerical model study which explores the conditions at which advective transport in the sediment becomes relevant. A 0.15 m deep U-shaped burrow with a diameter of 0.002 m within the sediment was represented in a 3-D domain. Fluid flow in the burrow was calculated using the Navier-Stokes equation for incompressible laminar flow in the burrow, and flow in the sediment was described by Darcy's law. Nonreactive and reactive transport scenarios were simulated considering diffusion and advection. The pumping activity of the model larva results in considerable advective flow in the sediment at reasonable high permeabilities with flow velocities of up to 7.0 × 10-6 m s-1 close to the larva for a permeability of 3 × 10-12 m2. At permeabilities below 7 × 10-13 m2 advection is negligible compared to diffusion. Reactive transport simulations using first-order kinetics for oxygen revealed that advective flux into the sediment downstream of the pumping larva enhances sedimentary uptake, while the advective flux into the burrow upstream of the larvae inhibits diffusive sedimentary uptake. Despite the fact that both effects cancel each other with respect to total solute uptake, the advection-induced asymmetry in concentration distribution can lead to a heterogeneous solute and redox distribution in the sediment relevant to complex reaction networks.

  14. Measurement of clay surface areas by polyvinylpyrrolidone (PVP) sorption and its use for quantifying illite and smectite abundance

    USGS Publications Warehouse

    Blum, A.E.; Eberl, D.D.

    2004-01-01

    A new method has been developed for quantifying smectite abundance by sorbing polyvinylpyrrolidone (PVP) on smectite particles dispersed in aqueous solution. The sorption density of PVP-55K on a wide range of smectites, illites and kaolinites is ???0.99 mg/m2, which corresponds to ???0.72 g of PVP-55K per gram of montmorillonite. Polyvinylpyrrolidone sorption on smectites is independent of layer charge and solution pH. PVP sorption on Si02, Fe 2O3 and ZnO normalized to the BET surface area is similar to the sorption densities on smectites. ??-Al 2O3, amorphous Al(OH)3 and gibbsite have no PVP sorption over a wide range of pH, and sorption of PVP by organics is minimal. The insensitivity of PVP sorption densities to mineral layer charge, solution pH and mineral surface charge indicates that PVP sorption is not localized at charged sites, but is controlled by more broadly distributed sorption mechanisms such as Van der Waals' interactions and/or hydrogen bonding. Smectites have very large surface areas when dispersed as single unit-cell-thick particles (???725 m2/g) and usually dominate the total surface areas of natural samples in which smectites are present. In this case, smectite abundance is directly proportional to PVP sorption. In some cases, however, the accurate quantification of smectite abundance by PVP sorption may require minor corrections for PVP uptake by other phases, principally illite and kaolinite. Quantitative XRD can be combined with PVP uptake measurements to uniquely determine the smectite concentration in such sample. ?? 2004, The Clay Minerals Society.

  15. Sorption of boron trifluoride by activated carbons

    SciTech Connect

    Polevoi, A.S.; Petrenko, A.E.

    1988-01-10

    The sorption of born trifluoride on AG-3, SKT, SKT-3, SKT-7, SKT-4A, SKT-6A, and SKT-2B carbons was investigated. The sorption isotherms for both vapors and gas were determined volumetrically. The coefficients of two equations described the sorption of BF/sub 3/ in the sorption of BF/sub 3/ on active carbons. Heats of sorption of BF/sub 3/ on the activated carbons are shown and the sorption isotherms and temperature dependences of the equilibrium pressure of BF/sub 3/ for activated carbons were presented. The values of the heats of sorption indicated the weak character of the reaction of BF/sub 3/ with the surface of the carbons. The equations can be used for calculating the phase equilibrium of BF/sub 3/ on carbons in a wider range of temperatures and pressures.

  16. Assessment of nitrate transport parameters using the advection-diffusion cell.

    PubMed

    Aljazzar, Taiseer; Al-Qinna, Mohammed

    2016-11-01

    This study aimed to better understand nitrate transport in the soil system in a part of the state of North Rhine-Westphalia, in Germany, and to aid in the development of groundwater protection plans. An advection-diffusion (AD) cell was used in a miscible displacement experiment setup to characterize nitrate transport in 12 different soil samples from the study area. The three nitrate sorption isotherms were tested to define the exact nitrate interaction with the soil matrix. Soils varied in their properties which in its turn explain the variations in nitrate transport rates. Soil texture and organic matter content showed to have the most important effect on nitrate recovery and retardation. The miscible displacement experiment indicated a decrease in retardation by increasing sand fraction, and an increase in retardation by increasing soil organic matter content. Soil samples with high sand fractions (up to 94 %) exhibited low nitrate sorption capacity of less than 10 %, while soils with high organic matter content showed higher sorption of about 30 %. Based on parameterization for nitrate transport equation, the pore water velocity for both sandy and loamy soils were significantly different (P < 0.001). Pore water velocity in sandy soil (about 4 × 10(-3) m/s) was about 100 to 1000 larger than in loamy soils (8.7 × 10(-5) m/s). On the other hand, the reduction in nitrate transport in soils associated with high organic matter was due to fine pore pathways clogged by fine organic colloids. It is expected that the existing micro-phobicity increased the nitrate recovery from 9 to 32 % resulting in maximum diffusion rates of about 3.5 × 10(-5) m/s(2) in sandy soils (sample number CS-04) and about 1.4 × 10(-7) m/s(2) in silt loam soils (sample number FS-02).

  17. Advecting Procedural Textures for 2D Flow Animation

    NASA Technical Reports Server (NTRS)

    Kao, David; Pang, Alex; Moran, Pat (Technical Monitor)

    2001-01-01

    This paper proposes the use of specially generated 3D procedural textures for visualizing steady state 2D flow fields. We use the flow field to advect and animate the texture over time. However, using standard texture advection techniques and arbitrary textures will introduce some undesirable effects such as: (a) expanding texture from a critical source point, (b) streaking pattern from the boundary of the flowfield, (c) crowding of advected textures near an attracting spiral or sink, and (d) absent or lack of textures in some regions of the flow. This paper proposes a number of strategies to solve these problems. We demonstrate how the technique works using both synthetic data and computational fluid dynamics data.

  18. Concentration polarization, surface currents, and bulk advection in a microchannel

    NASA Astrophysics Data System (ADS)

    Nielsen, Christoffer P.; Bruus, Henrik

    2014-10-01

    We present a comprehensive analysis of salt transport and overlimiting currents in a microchannel during concentration polarization. We have carried out full numerical simulations of the coupled Poisson-Nernst-Planck-Stokes problem governing the transport and rationalized the behavior of the system. A remarkable outcome of the investigations is the discovery of strong couplings between bulk advection and the surface current; without a surface current, bulk advection is strongly suppressed. The numerical simulations are supplemented by analytical models valid in the long channel limit as well as in the limit of negligible surface charge. By including the effects of diffusion and advection in the diffuse part of the electric double layers, we extend a recently published analytical model of overlimiting current due to surface conduction.

  19. [Intrapleural sorption detoxication in the combined treatment of acute destructive pneumonia in children].

    PubMed

    Kravchuk, B A; Sokur, P P; Makarov, A V; Spivak, N Ia; Nogareva, E M; Ganova, L A

    1993-01-01

    The pathogenetic substantiation and technique of intrapleural sorption detoxication (IPSD) based on the use of high-dispersed silicone dioxide (trade mark "AEROSIL") are presented. Use of IPSD in the complex of treatment of 25 children with complicated forms of acute destructive pneumonia permitted to shorten the duration of intoxication syndrome, sanation of suppurative foci, stay of the patients at a hospital.

  20. Optimal Stretching in Advection-Reaction-Diffusion Systems

    NASA Astrophysics Data System (ADS)

    Nevins, Thomas D.; Kelley, Douglas H.

    2016-10-01

    We investigate growth of the excitable Belousov-Zhabotinsky reaction in chaotic, time-varying flows. In slow flows, reacted regions tend to lie near vortex edges, whereas fast flows restrict reacted regions to vortex cores. We show that reacted regions travel toward vortex centers faster as flow speed increases, but nonreactive scalars do not. For either slow or fast flows, reaction is promoted by the same optimal range of the local advective stretching, but stronger stretching causes reaction blowout and can hinder reaction from spreading. We hypothesize that optimal stretching and blowout occur in many advection-diffusion-reaction systems, perhaps creating ecological niches for phytoplankton in the ocean.

  1. Optimal Stretching in Advection-Reaction-Diffusion Systems.

    PubMed

    Nevins, Thomas D; Kelley, Douglas H

    2016-10-14

    We investigate growth of the excitable Belousov-Zhabotinsky reaction in chaotic, time-varying flows. In slow flows, reacted regions tend to lie near vortex edges, whereas fast flows restrict reacted regions to vortex cores. We show that reacted regions travel toward vortex centers faster as flow speed increases, but nonreactive scalars do not. For either slow or fast flows, reaction is promoted by the same optimal range of the local advective stretching, but stronger stretching causes reaction blowout and can hinder reaction from spreading. We hypothesize that optimal stretching and blowout occur in many advection-diffusion-reaction systems, perhaps creating ecological niches for phytoplankton in the ocean.

  2. Jet Magnetically Accelerated from Advection Dominated Accretion Flow

    NASA Astrophysics Data System (ADS)

    Gong, Xiao-Long; Jiang, Zhi-Xiong

    2014-08-01

    A jet model for the jet power arising from a steady, optically thin, advection dominated accretion flow (ADAF) around a Kerr black hole (BH) is proposed. We investigate the typical numerical solutions of ADAF, and calculate the jet power from an ADAF using a general relativistic version of electronic circuit theory. It is shown that the jet power concentrates in the inner region of the accretion flow, and the higher the degree to which the flow advection-dominated is, the lower the jet power from the ADAF is.

  3. Fast multigrid solution of the advection problem with closed characteristics

    SciTech Connect

    Yavneh, I.; Venner, C.H.; Brandt, A.

    1996-12-31

    The numerical solution of the advection-diffusion problem in the inviscid limit with closed characteristics is studied as a prelude to an efficient high Reynolds-number flow solver. It is demonstrated by a heuristic analysis and numerical calculations that using upstream discretization with downstream relaxation-ordering and appropriate residual weighting in a simple multigrid V cycle produces an efficient solution process. We also derive upstream finite-difference approximations to the advection operator, whose truncation terms approximate {open_quotes}physical{close_quotes} (Laplacian) viscosity, thus avoiding spurious solutions to the homogeneous problem when the artificial diffusivity dominates the physical viscosity.

  4. Sorption Characteristics of Organic Powder Sorption Material in Fluidized Bed with a Cooling Pipe

    NASA Astrophysics Data System (ADS)

    Horibe, Akihiko; Husain, Syahrul; Inaba, Hideo; Haruki, Naoto

    The dynamic sorption characteristics of organic sorbent materials have been studied by using fluidized bed with a cooling pipe. The organic powder type sorbent made from a bridged complex of sodium polyacrylate which is one of the sorption polymers is adopted in this study. Sorption rate of water vapor and the variation of temperature in the sorbent bed with time were measured under various conditions. As a result, sorption ratio increases and the completion time for the sorption process decreases by using a cooling pipe. Furthermore, the non-dimensional correlation equations were obtained for water vapor mass transfer under sorption process in terms of relevant non-dimensional parameters.

  5. Hydrodynamic dispersion within porous biofilms

    NASA Astrophysics Data System (ADS)

    Davit, Y.; Byrne, H.; Osborne, J.; Pitt-Francis, J.; Gavaghan, D.; Quintard, M.

    2013-01-01

    Many microorganisms live within surface-associated consortia, termed biofilms, that can form intricate porous structures interspersed with a network of fluid channels. In such systems, transport phenomena, including flow and advection, regulate various aspects of cell behavior by controlling nutrient supply, evacuation of waste products, and permeation of antimicrobial agents. This study presents multiscale analysis of solute transport in these porous biofilms. We start our analysis with a channel-scale description of mass transport and use the method of volume averaging to derive a set of homogenized equations at the biofilm-scale in the case where the width of the channels is significantly smaller than the thickness of the biofilm. We show that solute transport may be described via two coupled partial differential equations or telegrapher's equations for the averaged concentrations. These models are particularly relevant for chemicals, such as some antimicrobial agents, that penetrate cell clusters very slowly. In most cases, especially for nutrients, solute penetration is faster, and transport can be described via an advection-dispersion equation. In this simpler case, the effective diffusion is characterized by a second-order tensor whose components depend on (1) the topology of the channels' network; (2) the solute's diffusion coefficients in the fluid and the cell clusters; (3) hydrodynamic dispersion effects; and (4) an additional dispersion term intrinsic to the two-phase configuration. Although solute transport in biofilms is commonly thought to be diffusion dominated, this analysis shows that hydrodynamic dispersion effects may significantly contribute to transport.

  6. Indium Sorption to Iron Oxides

    NASA Astrophysics Data System (ADS)

    White, S. J.; Sacco, S. A.; Hemond, H.; Hussain, F. A.; Runkel, R. L.; Walton-Day, K. E.; Kimball, B. A.; Shine, J. P.

    2014-12-01

    Indium is an increasingly important metal in semiconductors and electronics, and its use is growing rapidly as a semiconductive coating (as indium tin oxide) for liquid crystal displays (LCDs) and flat panel displays. It also has uses in important energy technologies such as light emitting diodes (LEDs) and photovoltaic cells. Despite its rapid increase in use, very little is known about the environmental behavior of indium, and concerns are being raised over the potential health effects of this emerging metal contaminant. One source of indium to the environment is acid mine drainage from the mining of lead, zinc, and copper sulfides. In our previous studies of a stream in Colorado influenced by acid mine drainage from lead and zinc mining activities, indium concentrations were found to be 10,000 times those found in uncontaminated rivers. However, the speciation and mobility of indium could not be reliably modeled because sorption constants to environmental sorbents have not been determined. In this study, we generate sorption constants for indium to ferrihydrite in the laboratory over a range of pHs, sorbent to sorbate ratios, and ionic strengths. Ferrihydrite is one of the most important sorbents in natural systems, and sorption to amorphous iron oxides such as ferrihydrite is thought to be one of the main removal mechanisms of metals from the dissolved phase in aqueous environments. Because of its relatively low solubility, we also find that indium hydroxide precipitation can dominate indium's partitioning at micromolar concentrations of indium. This precipitation may be important in describing indium's behavior in our study stream in Colorado, where modeling sorption to iron-oxides does not explain the complete removal of indium from the dissolved phase when the pH of the system is artificially raised to above 8. This study contributes much-needed data about indium's aqueous behavior, in order to better understand its fate, transport, and impacts in the

  7. Tidal Mixing and Buoyancy Advection: Joint Influences on Lobster Distribution in Coastal Maine

    NASA Astrophysics Data System (ADS)

    Brooks, D. A.

    2004-12-01

    The Eastern Maine Coastal Current (EMCC) flows southwestward from the mouth of the Bay of Fundy to Penobscot Bay on the central Maine coast. Maximum non-tidal surface speeds reach 20-30 cm/s about 20 km offshore during April-May when the outflow from the Saint John River is strongest. Vigorous tides cause strong vertical and horizontal mixing, so that dispersal of neutral particles is influenced both by advection and tidal mixing. To survive, planktonic lobsters carried southwestward in the surface flow must settle to a nearshore cobble substrate. Larvae hatched near the Bay of Fundy can be advected to the central coast in 2-3 weeks, roughly the time needed to reach settlement stage. Over the same period, transverse tidal mixing is sufficient to raise nearshore larval concentrations to about half that offshore in the axis of the EMCC. Both processes may be necessary to explain the observed lobster distribution, which exhibits a distinct maximum in the central coastal region. The seasonal development of the EMCC is also influenced by winds and the larger circulation of the Gulf of Maine. This work is part of a multidisciplinary synthesis study funded by the NOAA Coastal Ocean Program.

  8. Invasions in heterogeneous habitats in the presence of advection.

    PubMed

    Vergni, Davide; Iannaccone, Sandro; Berti, Stefano; Cencini, Massimo

    2012-05-21

    We investigate invasions from a biological reservoir to an initially empty, heterogeneous habitat in the presence of advection. The habitat consists of a periodic alternation of favorable and unfavorable patches. In the latter the population dies at fixed rate. In the former it grows either with the logistic or with an Allee effect type dynamics, where the population has to overcome a threshold to grow. We study the conditions for successful invasions and the speed of the invasion process, which is numerically and analytically investigated in several limits. Generically advection enhances the downstream invasion speed but decreases the population size of the invading species, and can even inhibit the invasion process. Remarkably, however, the rate of population increase, which quantifies the invasion efficiency, is maximized by an optimal advection velocity. In models with Allee effect, differently from the logistic case, above a critical unfavorable patch size the population localizes in a favorable patch, being unable to invade the habitat. However, we show that advection, when intense enough, may activate the invasion process.

  9. Theory of advection-driven long range biotic transport

    Technology Transfer Automated Retrieval System (TEKTRAN)

    We propose a simple mechanistic model to examine the effects of advective flow on the spread of fungal diseases spread by wind-blown spores. The model is defined by a set of two coupled non-linear partial differential equations for spore densities. One equation describes the long-distance advectiv...

  10. Black Hole Advective Accretion Disks with Optical Depth Transition

    SciTech Connect

    Artemove, Y.V.; Bisnovatyi-Kogan, G.S.; Igumenshchev, I.V.; Novikov, I.D.

    2006-02-01

    We have constructed numerically global solutions of advective accretion disks around black holes that describe a continuous transition between the effectively optically thick outer and optically thin inner disk regions. We have concentrated on models of accretion flows with large mass accretion rates, and we have employed a bridging formula for radiative losses at high and low effective optical depths.

  11. PCB Congener Sorption To Carbonaceous Sediment Components: Macroscopic Comparison And Characterization Of Sorption Kinetics And Mechanism

    EPA Science Inventory

    Sorption of polychlorinated biphenyls (PCBs) to sediment is a key process in determining their mobility, bioavailability, and chemical decomposition in aquatic environments. In order to examine the validity of currently used interpretation approaches for PCBs sorption, comparati...

  12. Quantification of Cation Sorption to Engineered Barrier Materials Under Extreme Conditions

    SciTech Connect

    Powell, Brian; Schlautman, Mark; Rao, Linfeng; Nitsche, Heino; Gregorich, Kenneth

    2016-02-02

    The objective of this research is to examine mechanisms and thermodynamics of actinide sorption to engineered barrier materials (iron (oxyhydr)oxides and bentonite clay) for nuclear waste repositories under high temperature and high ionic strength conditions using a suite of macroscopic and microscopic techniques which will be coupled with interfacial reaction models. Gaining a mechanistic understanding of interfacial processes governing the sorption/sequestration of actinides at mineral-water interfaces is fundamental for the accurate prediction of actinide behavior in waste repositories. Although macroscale sorption data and various spectroscopic techniques have provided valuable information regarding speciation of actinides at solid-water interfaces, significant knowledge gaps still exist with respect to sorption mechanisms and the ability to quantify sorption, particularly at high temperatures and ionic strengths. This objective is addressed through three major tasks: (1) influence of oxidation state on actinide sorption to iron oxides and clay minerals at elevated temperatures and ionic strengths; (2) calorimetric titrations of actinide-mineral suspensions; (3) evaluation of bentonite performance under repository conditions. The results of the work will include a qualitative conceptual model and a quantitative thermodynamic speciation model describing actinide partitioning to minerals and sediments, which is based upon a mechanistic understanding of specific sorption processes as determined from both micro-scale and macroscale experimental techniques. The speciation model will be a thermodynamic aqueous and surface complexation model of actinide interactions with mineral surfaces that is self-consistent with macroscopic batch sorption data, calorimetric and potentiometric titrations, X-ray absorption Spectroscopy (XAS, mainly Extended X-ray Absorption Fine Structure (EXAFS)), and electron microscopy analyses. The novelty of the proposed work lies largely in

  13. Advective velocity and energy dissipation rate in an oscillatory flow.

    PubMed

    Haider, Ziaul; Hondzo, Miki; Porte-Agel, Fernando

    2005-07-01

    Characterizing the transport processes at the sediment-water interface along sloping boundaries in lakes and reservoirs is of fundamental interest in lake and reservoir water quality management. The turbulent bottom boundary layer (TBBL) along a slope, induced by the breaking of internal waves in a linearly stratified fluid, was investigated through laboratory measurements. Fast response micro-scale conductivity and temperature probes in conjunction with laser-Doppler velocimetry were used to measure the time series of salinity, temperature, and velocity along a sloping boundary. Turbulent energy spectra were computed from the velocity data using a time-dependent advective velocity and Taylor's hypothesis. The energy spectra were used to estimate the energy dissipation rate at different positions in the TBBL. The advective velocity in this near-zero mean shear flow is based on an integral time scale (T(int)). The integral time scale is related to the average frequency of the spectral energy density of the flow velocity. The energy dissipation rate estimated from the variable advective velocity with an averaging time window equal to the integral time scale (T=T(int)) was 43% higher than the energy dissipation rate estimated from a constant advective velocity. The estimated dissipation rates with T=T(int) were comparable to values obtained by curve-fitting a theoretical Batchelor spectrum for the temperature gradient spectra. This study proposes the integral time scale to be used for the oscillatory flows as (a) a time-averaging window to estimate the advective velocity and associated energy dissipation level, and (b) a normalizing parameter in the energy spectrum.

  14. Persistence of cluster synchronization under the influence of advection.

    PubMed

    Guirey, Emma; Bees, Martin; Martin, Adrian; Srokosz, Meric

    2010-05-01

    We present a study on the emergence of spatial structure in plankton dynamics under the influence of stirring and mixing. A distribution of plankton is represented as a lattice of nonidentical, interacting, oscillatory plankton populations. Each population evolves according to (i) the internal biological dynamics represented by an NPZ model with population-specific phytoplankton growth rate, (ii) sub-grid-cell stirring and mixing parameterized by a nearest-neighbor coupling, and (iii) explicit advection resulting from a constant horizontal shear. Using the methods of synchronization theory, the emergent spatial structure of the simulation is investigated as a function of the coupling strength and rate of advection. Previous work using similar methods has neglected the effects of explicit stirring (i.e., at scales larger than the grid cell), leaving as an open question the relevance of the work to real marine systems. Here, we show that persistent spatial structure emerges for a range of coupling strengths for all realistic levels of surface ocean shear. Spatially, this corresponds to the formation of temporally evolving clusters of local synchronization. Increasing shear alters the spatial characteristics of this clustering by stretching and narrowing patches of synchronized dynamics. These patches are not stretched into stripes of synchronized abundance aligned with the flow, as may be expected, but instead lie at an angle to the flow. This study shows that advection does not diminish the relevance of conclusions from previous studies of spatial structure in plankton simulations. In fact, the inclusion of advection adds characteristic filamental structure, as observed in real-world plankton distributions. The results also show that the ability of coupled oscillators to synchronize depends strongly on the spatial arrangement of oscillator natural frequencies; under the influence of advection, therefore, the impact of the coupling strength on the emergent spatial

  15. Manganese Nitride Sorption Joule-Thomson Refrigerator

    NASA Technical Reports Server (NTRS)

    Jones, Jack A.; Phillips, Wayne M.

    1992-01-01

    Proposed sorption refrigeration system of increased power efficiency combines MnxNy sorption refrigeration stage with systems described in "Regenerative Sorption Refrigerator" (NPO-17630). Measured pressure-vs-composition isotherms for reversible chemisorption of N2 in MnxNy suggest feasibility to incorporate MnxNy chemisorption stage in Joule-Thomson cryogenic system. Discovery represents first known reversible nitrogen chemisorption compression system. Has potential in nitrogen-isotope separation, nitrogen purification, or contamination-free nitrogen compression.

  16. Current status of laboratory sorption studies

    SciTech Connect

    Vine, E.N.; Wolfsberg, K.; Bayhurst, B.P.; Daniels, W.R.; DeVilliers, S.J.; Erdal, B.R.; Lawrence, F.O.

    1980-01-01

    LASL batch sorption methodology was used to obtain data on granite, argillite, and tuff samples. Effects of solution-to-solid ratio, isotope concentration, atmosphere, and mineralogy were investigated for the elements strontium, cesium, barium, cerium, europium, technetium, uranium, plutonium, and americium. A circulating system was used in making sorption measurements for comparison with conventional batch techniques. The mineralogy of several tuff, granite, and argillite samples was studied and compared with sorption ratios. A significant correlation between sorption of strontium, cesium, and barium and major rock phases was observed.

  17. Surface complexation model of uranyl sorption on Georgia kaolinite

    USGS Publications Warehouse

    Payne, T.E.; Davis, J.A.; Lumpkin, G.R.; Chisari, R.; Waite, T.D.

    2004-01-01

    The adsorption of uranyl on standard Georgia kaolinites (KGa-1 and KGa-1B) was studied as a function of pH (3-10), total U (1 and 10 ??mol/l), and mass loading of clay (4 and 40 g/l). The uptake of uranyl in air-equilibrated systems increased with pH and reached a maximum in the near-neutral pH range. At higher pH values, the sorption decreased due to the presence of aqueous uranyl carbonate complexes. One kaolinite sample was examined after the uranyl uptake experiments by transmission electron microscopy (TEM), using energy dispersive X-ray spectroscopy (EDS) to determine the U content. It was found that uranium was preferentially adsorbed by Ti-rich impurity phases (predominantly anatase), which are present in the kaolinite samples. Uranyl sorption on the Georgia kaolinites was simulated with U sorption reactions on both titanol and aluminol sites, using a simple non-electrostatic surface complexation model (SCM). The relative amounts of U-binding >TiOH and >AlOH sites were estimated from the TEM/EDS results. A ternary uranyl carbonate complex on the titanol site improved the fit to the experimental data in the higher pH range. The final model contained only three optimised log K values, and was able to simulate adsorption data across a wide range of experimental conditions. The >TiOH (anatase) sites appear to play an important role in retaining U at low uranyl concentrations. As kaolinite often contains trace TiO2, its presence may need to be taken into account when modelling the results of sorption experiments with radionuclides or trace metals on kaolinite. ?? 2004 Elsevier B.V. All rights reserved.

  18. Analytical solution of advection-diffusion equation in heterogeneous infinite medium using Green's function method

    NASA Astrophysics Data System (ADS)

    Sanskrityayn, Abhishek; Kumar, Naveen

    2016-12-01

    Some analytical solutions of one-dimensional advection-diffusion equation (ADE) with variable dispersion coefficient and velocity are obtained using Green's function method (GFM). The variability attributes to the heterogeneity of hydro-geological media like river bed or aquifer in more general ways than that in the previous works. Dispersion coefficient is considered temporally dependent, while velocity is considered spatially and temporally dependent. The spatial dependence is considered to be linear and temporal dependence is considered to be of linear, exponential and asymptotic. The spatio-temporal dependence of velocity is considered in three ways. Results of previous works are also derived validating the results of the present work. To use GFM, a moving coordinate transformation is developed through which this ADE is reduced into a form, whose analytical solution is already known. Analytical solutions are obtained for the pollutant's mass dispersion from an instantaneous point source as well as from a continuous point source in a heterogeneous medium. The effect of such dependence on the mass transport is explained through the illustrations of the analytical solutions.

  19. Novel Non-invasive Estimation of Coronary Blood Flow using Contrast Advection in Computed Tomography Angiography

    NASA Astrophysics Data System (ADS)

    Eslami, Parastou; Seo, Jung-Hee; Rahsepar, Amirali; George, Richard; Lardo, Albert; Mittal, Rajat

    2014-11-01

    Coronary computed tomography angiography (CTA) is a promising tool for assessment of coronary stenosis and plaque burden. Recent studies have shown the presence of axial contrast concentration gradients in obstructed arteries, but the mechanism responsible for this phenomenon is not well understood. We use computational fluid dynamics to study intracoronary contrast dispersion and the correlation of concentration gradients with intracoronary blood flow and stenotic severity. Data from our CFD patient-specific simulations reveals that contrast dispersions are generated by intracoronary advection effects, and therefore, encode the coronary flow velocity. This novel method- Transluminal Attenuation Flow Encoding (TAFE) - is used to estimate the flowrate in phantom studies as well as preclinical experiments. Our results indicate a strong correlation between the values estimated from TAFE and the values measured in these experiments. The flow physics of contrast dispersion associated with TAFE will be discussed. This work is funded by grants from Coulter Foundation and Maryland Innovation Initiative. The authors have pending patents in this technology and RM and ACL have other financial interests associated with TAFE.

  20. In situ measurements of advective solute transport in permeable shelf sands

    NASA Astrophysics Data System (ADS)

    Reimers, Clare E.; Stecher, Hilmar A.; Taghon, Gary L.; Fuller, Charlotte M.; Huettel, Markus; Rusch, Antje; Ryckelynck, Natacha; Wild, Christian

    2004-01-01

    Solute transport rates within the uppermost 2 cm of a rippled continental shelf sand deposit, with a mean grain size of 400-500 μm and permeabilities of 2.0-2.4×10 -11 m 2, have been measured in situ by detecting the breakthrough of a pulse of iodide after its injection into the bottom water. These tracer experiments were conducted on the USA Middle Atlantic Bight shelf at a water depth of ˜13 m using a small tethered tripod that carried a close-up video camera, acoustic current meter, motorized 1.5 liter "syringe", and a microprofiling system for positioning and operating a solid-state voltammetric microelectrode. When triggered on shipboard, the syringe delivered a 0.21 M solution of potassium iodide and red dye through five nozzles positioned around and above the buried tip of the voltammetric sensor for 0.65-5 min. Bottom turbulence rapidly mixed and dispersed the tracer, which then was carried into the bed by interfacial water flows associated with ripple topography. The advective downward transport to the sensor tip was timed by a sequence of repetitive voltammetric scans. The distance-averaged vertical velocity, expressed as the depth of the sensor tip in the sand divided by the time to iodide breakthrough, was found to vary from 6 to 53 cm h -1 and generally to decrease with sediment depth. Because of episodic pumping and dispersion associated with the greatest 5% of wave heights and current speeds recorded, some concentration vs. time responses showed evidence of uneven solute migration. For reasons of mass balance, the advective flow field in the surface layers of permeable beds includes regions of water intrusion, horizontal pore-water flow and upwelling which also may explain some of the observed uneven migration. Pore-water advection was also evident in oxygen profiles measured before and after tracer injection with the voltammetric sensor. These profiles showed irregular distributions and oxygen penetration depths of 4-4.5 cm. Sand cores from the

  1. Plutonium sorption and desorption behavior on bentonite.

    PubMed

    Begg, James D; Zavarin, Mavrik; Tumey, Scott J; Kersting, Annie B

    2015-03-01

    Understanding plutonium (Pu) sorption to, and desorption from, mineral phases is key to understanding its subsurface transport. In this work we study Pu(IV) sorption to industrial grade FEBEX bentonite over the concentration range 10(-7)-10(-16) M to determine if sorption at typical environmental concentrations (≤10(-12) M) is the same as sorption at Pu concentrations used in most laboratory experiments (10(-7)-10(-11) M). Pu(IV) sorption was broadly linear over the 10(-7)-10(-16) M concentration range during the 120 d experimental period; however, it took up to 100 d to reach sorption equilibrium. At concentrations ≥10(-8) M, sorption was likely affected by additional Pu(IV) precipitation/polymerization reactions. The extent of sorption was similar to that previously reported for Pu(IV) sorption to SWy-1 Na-montmorillonite over a narrower range of Pu concentrations (10(-11)-10(-7) M). Sorption experiments with FEBEX bentonite and Pu(V) were also performed across a concentration range of 10(-11)-10(-7) M and over a 10 month period which allowed us to estimate the slow apparent rates of Pu(V) reduction on a smectite-rich clay. Finally, a flow cell experiment with Pu(IV) loaded on FEBEX bentonite demonstrated continued desorption of Pu over a 12 day flow period. Comparison with a desorption experiment performed with SWy-1 montmorillonite showed a strong similarity and suggested the importance of montorillonite phases in controlling Pu sorption/desorption reactions on FEBEX bentonite.

  2. Application of the Space-Time Conservation Element and Solution Element Method to One-Dimensional Advection-Diffusion Problems

    NASA Technical Reports Server (NTRS)

    Wang, Xiao-Yen; Chow, Chuen-Yen; Chang, Sin-Chung

    1999-01-01

    Test problems are used to examine the performance of several one-dimensional numerical schemes based on the space-time conservation and solution element (CE/SE) method. Investigated in this paper are the CE/SE schemes constructed previously for solving the linear unsteady advection-diffusion equation and the schemes derived here for solving the nonlinear viscous and inviscid Burgers equations. In comparison with the numerical solutions obtained using several traditional finite-difference schemes with similar accuracy, the CE/SE solutions display much lower numerical dissipation and dispersion errors.

  3. A finite analytic method for solving the 2-D time-dependent advection diffusion equation with time-invariant coefficients

    NASA Astrophysics Data System (ADS)

    Lowry, Thomas; Li, Shu-Guang

    2005-02-01

    Difficulty in solving the transient advection-diffusion equation (ADE) stems from the relationship between the advection derivatives and the time derivative. For a solution method to be viable, it must account for this relationship by being accurate in both space and time. This research presents a unique method for solving the time-dependent ADE that does not discretize the derivative terms but rather solves the equation analytically in the space-time domain. The method is computationally efficient and numerically accurate and addresses the common limitations of numerical dispersion and spurious oscillations that can be prevalent in other solution methods. The method is based on the improved finite analytic (IFA) solution method [Lowry TS, Li S-G. A characteristic based finite analytic method for solving the two-dimensional steady-state advection-diffusion equation. Water Resour Res 38 (7), 10.1029/2001WR000518] in space coupled with a Laplace transformation in time. In this way, the method has no Courant condition and maintains accuracy in space and time, performing well even at high Peclet numbers. The method is compared to a hybrid method of characteristics, a random walk particle tracking method, and an Eulerian-Lagrangian Localized Adjoint Method using various degrees of flow-field heterogeneity across multiple Peclet numbers. Results show the IFALT method to be computationally more efficient while producing similar or better accuracy than the other methods.

  4. Phase Segregation of Passive Advective Particles in an Active Medium

    NASA Astrophysics Data System (ADS)

    Das, Amit; Polley, Anirban; Rao, Madan

    2016-02-01

    Localized contractile configurations or asters spontaneously appear and disappear as emergent structures in the collective stochastic dynamics of active polar actomyosin filaments. Passive particles which (un)bind to the active filaments get advected into the asters, forming transient clusters. We study the phase segregation of such passive advective scalars in a medium of dynamic asters, as a function of the aster density and the ratio of the rates of aster remodeling to particle diffusion. The dynamics of coarsening shows a violation of Porod behavior; the growing domains have diffuse interfaces and low interfacial tension. The phase-segregated steady state shows strong macroscopic fluctuations characterized by multiscaling and intermittency, signifying rapid reorganization of macroscopic structures. We expect these unique nonequilibrium features to manifest in the actin-dependent molecular clustering at the cell surface.

  5. Chaotic Advection in a Bounded 3-Dimensional Potential Flow

    NASA Astrophysics Data System (ADS)

    Metcalfe, Guy; Smith, Lachlan; Lester, Daniel

    2012-11-01

    3-dimensional potential, or Darcy flows, are central to understanding and designing laminar transport in porous media; however, chaotic advection in 3-dimensional, volume-preserving flows is still not well understood. We show results of advecting passive scalars in a transient 3-dimensional potential flow that consists of a steady dipole flow and periodic reorientation. Even for the most symmetric reorientation protocol, neither of the two invarients of the motion are conserved; however, one invarient is closely shadowed by a surface of revolution constructed from particle paths of the steady flow, creating in practice an adiabatic surface. A consequence is that chaotic regions cover 3-dimensional space, though tubular regular regions are still transport barriers. This appears to be a new mechanism generating 3-dimensional chaotic orbits. These results contast with the experimental and theoretical results for chaotic scalar transport in 2-dimensional Darcy flows. Wiggins, J. Fluid Mech. 654 (2010).

  6. Aerosol particles and the formation of advection fog

    NASA Technical Reports Server (NTRS)

    Hung, R. J.; Liaw, G. S.; Vaughan, O. H., Jr.

    1979-01-01

    A study of numerical simulation of the effects of concentration, particle size, mass of nuclei, and chemical composition on the dynamics of warm fog formation, particularly the formation of advection fog, is presented. This formation is associated with the aerosol particle characteristics, and both macrophysical and microphysical processes are considered. In the macrophysical model, the evolution of wind components, water vapor content, liquid water content, and potential temperature under the influences of vertical turbulent diffusion, turbulent momentum, and turbulent energy transfers are taken into account. In the microphysical model, the supersaturation effect is incorporated with the surface tension and hygroscopic material solution. It is shown that the aerosol particles with the higher number density, larger size nuclei, the heavier nuclei mass, and the higher ratio of the Van't Hoff factor to the molecular weight favor the formation of the lower visibility advection fogs with stronger vertical energy transfer during the nucleation and condensation time period.

  7. Advective-diffusive contaminant migration in unsaturated sand and gravel

    SciTech Connect

    Rowe, R.K.; Badv, K.

    1996-12-01

    A method is presented for estimating the diffusion coefficients for chloride and sodium in unsaturated coarse sand and fine gravel based on parameters obtained from saturated diffusion tests conducted for similar material. The method is tested by comparing the observed and predicted diffusion profiles through unsaturated soil. The method is shown to work well for predicting the advective-diffusive migration of chloride and sodium through a two-layer soil system consisting of a compacted clayey silt underlain by an unsaturated fine gravel. Over the range of conditions examined, it is concluded that existing solute transport theory along with the proposed procedure for estimating the unsaturated diffusion coefficients can adequately predict chloride and sodium diffusion through both unsaturated coarse sand and fine gravel as well as predict advective-diffusive transport through a compacted clayey layer and underlying unsaturated fine gravel.

  8. Alginate and Algal-Based Beads for the Sorption of Metal Cations: Cu(II) and Pb(II)

    PubMed Central

    Wang, Shengye; Vincent, Thierry; Faur, Catherine; Guibal, Eric

    2016-01-01

    Alginate and algal-biomass (Laminaria digitata) beads were prepared by homogeneous Ca ionotropic gelation. In addition, glutaraldehyde-crosslinked poly (ethyleneimine) (PEI) was incorporated into algal beads. The three sorbents were characterized by scanning electron microscopy (SEM) coupled with energy dispersive X-ray analysis (EDX): the sorption occurs in the whole mass of the sorbents. Sorption experiments were conducted to evaluate the impact of pH, sorption isotherms, and uptake kinetics. A special attention was paid to the effect of drying (air-drying vs. freeze-drying) on the mass transfer properties. For alginate, freeze drying is required for maintaining the porosity of the hydrogel, while for algal-based sorbents the swelling of the material minimizes the impact of the drying procedure. The maximum sorption capacities observed from experiments were 415, 296 and 218 mg Pb g−1 and 112, 77 and 67 mg Cu g−1 for alginate, algal and algal/PEI beads respectively. Though the sorption capacities of algal-beads decreased slightly (compared to alginate beads), the greener and cheaper one-pot synthesis of algal beads makes this sorbent more competitive for environmental applications. PEI in algal beads decreases the sorption properties in the case of the sorption of metal cations under selected experimental conditions. PMID:27598128

  9. Integrated processing of anthracite into sorption materials

    SciTech Connect

    Sych, N.V.; Kartel, N.T.; Nikolaichuk, A.D.; Strelko, V.V.; Tsyba, N.N.; Denisovich, V.A.

    2006-05-15

    The possibility of using anthracite to produce activated carbon in the form of microporous and mesoporous anthracite, a cation exchanger, and composite sorption materials was analyzed and the porometric properties of a variety of sorption materials based on anthracite from the Donets coal basin were studied. A flowsheet for integrated processing of anthracite to give a set of four products was composed.

  10. Regenerative sorption compressors for cryogenic refrigeration

    NASA Technical Reports Server (NTRS)

    Bard, Steven; Jones, Jack A.

    1990-01-01

    Dramatic efficiency improvements for sorption coolers appear possible with use of compressor heat regeneration techniques. The general theory of sorption compressor heat regeneration is discussed in this paper, and several design concepts are presented. These designs result in long-life, low-vibration cryocoolers that potentially have efficiencies comparable to Stirling refrigerators for 65 to 90 K spacecraft instrument cooling applications.

  11. Spectral Theory of Advective Diffusion in the Ocean

    DTIC Science & Technology

    2013-09-19

    to study this enhancement of sea ice thermal conductivity and better understand temperature data collected during a 2007 Antarctic expedition. 15...conductivity and better understand temperature data collected during a 2007 Antarctic expedition. Activities and Findings: 1. Advection-enhanced...critically on the properties of this Hilbert space. More specifically, it is only on a special subset of this space that the random operator is Hermitian

  12. Lattice Boltzmann method for the fractional advection-diffusion equation.

    PubMed

    Zhou, J G; Haygarth, P M; Withers, P J A; Macleod, C J A; Falloon, P D; Beven, K J; Ockenden, M C; Forber, K J; Hollaway, M J; Evans, R; Collins, A L; Hiscock, K M; Wearing, C; Kahana, R; Villamizar Velez, M L

    2016-04-01

    Mass transport, such as movement of phosphorus in soils and solutes in rivers, is a natural phenomenon and its study plays an important role in science and engineering. It is found that there are numerous practical diffusion phenomena that do not obey the classical advection-diffusion equation (ADE). Such diffusion is called abnormal or superdiffusion, and it is well described using a fractional advection-diffusion equation (FADE). The FADE finds a wide range of applications in various areas with great potential for studying complex mass transport in real hydrological systems. However, solution to the FADE is difficult, and the existing numerical methods are complicated and inefficient. In this study, a fresh lattice Boltzmann method is developed for solving the fractional advection-diffusion equation (LabFADE). The FADE is transformed into an equation similar to an advection-diffusion equation and solved using the lattice Boltzmann method. The LabFADE has all the advantages of the conventional lattice Boltzmann method and avoids a complex solution procedure, unlike other existing numerical methods. The method has been validated through simulations of several benchmark tests: a point-source diffusion, a boundary-value problem of steady diffusion, and an initial-boundary-value problem of unsteady diffusion with the coexistence of source and sink terms. In addition, by including the effects of the skewness β, the fractional order α, and the single relaxation time τ, the accuracy and convergence of the method have been assessed. The numerical predictions are compared with the analytical solutions, and they indicate that the method is second-order accurate. The method presented will allow the FADE to be more widely applied to complex mass transport problems in science and engineering.

  13. The LEM exponential integrator for advection-diffusion-reaction equations

    NASA Astrophysics Data System (ADS)

    Caliari, Marco; Vianello, Marco; Bergamaschi, Luca

    2007-12-01

    We implement a second-order exponential integrator for semidiscretized advection-diffusion-reaction equations, obtained by coupling exponential-like Euler and Midpoint integrators, and computing the relevant matrix exponentials by polynomial interpolation at Leja points. Numerical tests on 2D models discretized in space by finite differences or finite elements, show that the Leja-Euler-Midpoint (LEM) exponential integrator can be up to 5 times faster than a classical second-order implicit solver.

  14. Lattice Boltzmann method for the fractional advection-diffusion equation

    NASA Astrophysics Data System (ADS)

    Zhou, J. G.; Haygarth, P. M.; Withers, P. J. A.; Macleod, C. J. A.; Falloon, P. D.; Beven, K. J.; Ockenden, M. C.; Forber, K. J.; Hollaway, M. J.; Evans, R.; Collins, A. L.; Hiscock, K. M.; Wearing, C.; Kahana, R.; Villamizar Velez, M. L.

    2016-04-01

    Mass transport, such as movement of phosphorus in soils and solutes in rivers, is a natural phenomenon and its study plays an important role in science and engineering. It is found that there are numerous practical diffusion phenomena that do not obey the classical advection-diffusion equation (ADE). Such diffusion is called abnormal or superdiffusion, and it is well described using a fractional advection-diffusion equation (FADE). The FADE finds a wide range of applications in various areas with great potential for studying complex mass transport in real hydrological systems. However, solution to the FADE is difficult, and the existing numerical methods are complicated and inefficient. In this study, a fresh lattice Boltzmann method is developed for solving the fractional advection-diffusion equation (LabFADE). The FADE is transformed into an equation similar to an advection-diffusion equation and solved using the lattice Boltzmann method. The LabFADE has all the advantages of the conventional lattice Boltzmann method and avoids a complex solution procedure, unlike other existing numerical methods. The method has been validated through simulations of several benchmark tests: a point-source diffusion, a boundary-value problem of steady diffusion, and an initial-boundary-value problem of unsteady diffusion with the coexistence of source and sink terms. In addition, by including the effects of the skewness β , the fractional order α , and the single relaxation time τ , the accuracy and convergence of the method have been assessed. The numerical predictions are compared with the analytical solutions, and they indicate that the method is second-order accurate. The method presented will allow the FADE to be more widely applied to complex mass transport problems in science and engineering.

  15. Stability of explicit advection schemes. The balance point location rule

    NASA Astrophysics Data System (ADS)

    Leonard, B. P.

    2002-02-01

    This paper introduces the balance point location rule, providing specific necessary and sufficient conditions for constructing unconditionally stable explicit advection schemes, in both semi-Lagrangian and flux-form Eulerian formulations. The rule determines how the spatial stencil is placed on the computational grid. It requires the balance point (the center of the stencil in index space) to be located in the same patch as the departure point for semi-Lagrangian schemes or the same cell as the sweep point for Eulerian schemes. Centering the stencil in this way guarantees stability, regardless of the size of the time step. In contrast, the original Courant-Friedrichs-Lewy (CFL) condition requiring the stencil merely to include the departure (sweep) point, although necessary, is not sufficient for guaranteeing stability. The CFL condition is of limited practical value, whereas the balance point location rule always gives precise and easily implemented prescriptions for constructing stable algorithms. The rule is also helpful in correcting a number of misconceptions that have arisen concerning explicit advection schemes. In particular, explicit Eulerian schemes are widely believed to be inefficient because of stability constraints on the time step, dictated by a narrow interpretation of the CFL condition requiring the Courant number to be less than or equal to one. However, such constraints apply only to a particular class of advection schemes resulting for centering the stencil on the arrival point, when in fact the sole function of the stencil is to estimate the departure (sweep) point value - the arrival point has no relevance in determining the placement of the stencil. Unconditionally stable explicit Eulerian advection schemes are efficient and accurate, comparable in operation count to semi-Lagrangian schemes of the same order, but because of their flux-based formulation, they have the added advantage of being inherently conservative. Copyright

  16. Sorption kinetics of ofloxacin in soils and mineral particles.

    PubMed

    Pan, Bo; Wang, Peng; Wu, Min; Li, Jing; Zhang, Di; Xiao, Di

    2012-12-01

    The environmental behavior of antibiotics is not well known and the precise environmental risk assessment is not practical. This study investigated the sorption kinetics of ofloxacin, a widely used antibiotics, on soil particles with different organic carbon contents as well as soil components (a humic acid, ferric oxide and kaolinite). Two-compartment sorption kinetics were mathematically recognized (except ferric oxide because of its very fast sorption). The apparent sorption rate and the contribution of fast sorption compartment decreased with the increased organic carbon content with the exception of humic acid, suggesting that the slow sorption sites were partially located in organo-mineral complex. The OFL concentration-dependent sorption kinetics suggested that the slow sorption compartment was not controlled by diffusion process as indicated by slower sorption at higher OFL loading. The difference between OFL sorption kinetics and those of hydrophobic organic contaminants was discussed and possible mechanism of OFL two-compartment sorption was proposed.

  17. Microbial effects on nickel and cadmium sorption and transport in volcanic tuff

    SciTech Connect

    Brown, R.L.; Bowman, R.S.; Kieft, T.L.

    1994-07-01

    We performed sorption and transport experiments to determine how vadose-zone microbes affect sorption of Ni{sup 2+} and Cd{sup 2+} on crushed volcanic tuff and transport of Ni{sup 2+} in the same medium. Sorption of Ni{sup 2+} and Cd{sup 2+} to the tuff was less in samples inoculated with microbes than in sterile samples. Since Ni{sup 2+} sorption was the same both in the presence and absence of microbes when a buffer was used, microbes appear to decrease sorption by decreasing solution pH. Samples with Bacillus megaterium decreased Ni{sup 2+} sorption the most of the 14 subsurface microbial strains tested. Nickel isotherms were linear up to initial concentrations of 10 mg L{sup -1} with an average distribution coefficient (k{sub d}) of 7.4 L kg{sup -1} for samples with freeze-dried B. megaterium and 50 L kg{sup -1} for sterile samples containing 1 g L{sup -1} NaN{sub 3}. Sterile samples without NaN{sub 3} had a higher k{sub d} (185-265 L kg{sup -1}). We therefore predicted that the retardation of Ni{sup 2+} in inoculated columns would be law than in sterile columns. A transport experiment with both inoculated (inoculum consisted of freeze-dried B. megaterium) and sterile (solutions contained NaN{sub 3}) columns indicated that retardation (R) of Ni{sup 2+} was less for columns with microbes (R = 205) than for sterile columns (R = 307), but retardation was higher than predicted by batch sorption experiments in both groups of columns. Dispersion was lower in inoculated columns, possibly due to microbial clogging of secondary pores. The results indicate that microbes can increase the mobility of cationic metals in subsurface environments. 25 refs., 7 figs., 5 tabs.

  18. Model coupling intraparticle diffusion/sorption, nonlinear sorption, and biodegradation processes

    USGS Publications Warehouse

    Karapanagioti, Hrissi K.; Gossard, Chris M.; Strevett, Keith A.; Kolar, Randall L.; Sabatini, David A.

    2001-01-01

    Diffusion, sorption and biodegradation are key processes impacting the efficiency of natural attenuation. While each process has been studied individually, limited information exists on the kinetic coupling of these processes. In this paper, a model is presented that couples nonlinear and nonequilibrium sorption (intraparticle diffusion) with biodegradation kinetics. Initially, these processes are studied independently (i.e., intraparticle diffusion, nonlinear sorption and biodegradation), with appropriate parameters determined from these independent studies. Then, the coupled processes are studied, with an initial data set used to determine biodegradation constants that were subsequently used to successfully predict the behavior of a second data set. The validated model is then used to conduct a sensitivity analysis, which reveals conditions where biodegradation becomes desorption rate-limited. If the chemical is not pre-equilibrated with the soil prior to the onset of biodegradation, then fast sorption will reduce aqueous concentrations and thus biodegradation rates. Another sensitivity analysis demonstrates the importance of including nonlinear sorption in a coupled diffusion/sorption and biodegradation model. While predictions based on linear sorption isotherms agree well with solution concentrations, for the conditions evaluated this approach overestimates the percentage of contaminant biodegraded by as much as 50%. This research demonstrates that nonlinear sorption should be coupled with diffusion/sorption and biodegradation models in order to accurately predict bioremediation and natural attenuation processes. To our knowledge this study is unique in studying nonlinear sorption coupled with intraparticle diffusion and biodegradation kinetics with natural media.

  19. Different effects of copper (II), cadmium (II) and phosphate on the sorption of phenanthrene on the biomass of cyanobacteria.

    PubMed

    Tao, Yuqiang; Li, Wei; Xue, Bin; Zhong, Jicheng; Yao, Shuchun; Wu, Qinglong

    2013-10-15

    Due to the large surface area and high organic carbon content of cyanobacteria, organic contaminants can be readily sorbed on cyanobacteria during algal blooms, and then be transferred to the food web. This process is likely to be affected by the coexisting metals and nutrients, however, the possible impacts remain unclear. Effects of Cu(2+), Cd(2+), and phosphate on the sorption of phenanthrene on cyanobacterial biomass collected from an algal bloom were therefore studied. Continuous decrease in phenanthrene sorption was observed in the presence of low concentrations of Cu(2+), and Cd(2+) (<0.04 mmol L(-1)), because Cu(2+) and Cd(2+) were coadsorbed with phenanthrene on the surface of cyanobacteria as suggested by scanning electron microscopy-energy dispersive X-ray (SEM-EDX) and Fourier transform infrared (FTIR) analyses. Phenanthrene sorption began to increase with the further increase in Cu(2+) concentration, but remained lower than that in the absence of Cu(2+). This increase in sorption was ascribed to the cation-π interaction between Cu(2+) and phenanthrene, as suggested by the enhanced ultraviolet absorbance at 251 nm. In contrast, sorption rebounding of phenanthrene did not occur in the presence of higher concentrations of Cd(2+). The different effects of Cu(2+) and Cd(2+) on phenanthrene sorption were attributed to that Cd(2+) required much more energy than Cu(2+) to form cation-π complexes with phenanthrene in the solutions. Phenanthrene sorption decreased continuously with the increase in phosphate concentration. Phosphate blocked the binding sites, modified the cell morphology, and increased the negative charge as well as the hydrophilicity of the cyanobacterial surface, thereby suppressing phenanthrene sorption. This study indicates that sorption of aromatic organic compounds by cyanobacteria could be significantly alerted by concentrations and properties of the coexisting transition metals and phosphates, which may subsequently affect their

  20. A subordinated advection model for uniform bed load transport from local to regional scales

    NASA Astrophysics Data System (ADS)

    Zhang, Yong; Martin, Raleigh L.; Chen, Dong; Baeumer, Boris; Sun, Hongguang; Chen, Li

    2014-12-01

    Sediment tracers moving as bed load can exhibit anomalous dispersion behavior deviating from Fickian diffusion. The presence of heavy-tailed resting time distributions and thin-tailed step length distributions motivate adoption of fractional-derivative models (FDMs) to describe sediment dispersion, but these models require many parameters that are difficult to quantify. Here we propose a considerably simplified FDM for anomalous transport of uniformly sized grains along straight channels, the subordinated advection equation (SAE), which is based on the concept of time subordination. Unlike previous FDM models with time index γ between 0 and 1, our SAE model adopts a value of γ between 1 and 2. This γ describes random velocities deviating significantly from the mean velocity and models both long resting periods and relatively fast displacements. We show that the model quantifies the dynamics of four bed load transport experiments recorded in the literature. In addition to γ, SAE model parameters—velocity and capacity coefficient—are related to the mean and variance of particle velocities, respectively. Successful application of the SAE model also implies a universal probability density for the heavy-tailed waiting time distribution (with finite mean) and a relatively lighter tailed step length distribution for uniform bed load transport from local to regional scales.

  1. A travel time-based approach to model kinetic sorption in highly heterogeneous porous media via reactive hydrofacies

    NASA Astrophysics Data System (ADS)

    Finkel, Michael; Grathwohl, Peter; Cirpka, Olaf A.

    2016-12-01

    We present a semianalytical model for the transport of solutes being subject to sorption in porous aquifers. We couple a travel time-based model of advective transport with a spherical diffusion model of kinetic sorption in nonuniform material mixtures. The model is formulated in the Laplace domain and transformed to the time domain by numerical inversion. By this, three-dimensional transport of solutes undergoing mass transfer between aqueous and solid phases can be simulated very efficiently. The model addresses both hydraulic and reactive heterogeneity of porous aquifers by means of hydrofacies, which function as homogeneous but nonuniform subunits. The total exposure time to each of these subunits controls the magnitude of sorption effects, whereas the particular sequence of facies through which the solute passes is irrelevant. We apply the model to simulate the transport of phenanthrene in a fluvio-glacial aquifer, for which the hydrofacies distribution is known at high resolution, the lithological composition of each facies has been analyzed, and sorption properties of the lithological components are available. Taking the fully resolved hydrofacies model as reference, we evaluate different approximations referring to lower information levels, reflecting shortcomings in typical modeling projects. The most important feature for a good description of both the main breakthrough and tailing of phenanthrene is the nonuniformity of the porous medium. While spatial heterogeneity of chemical properties might be neglected without introducing a large error, an approximation of the facies' composition in terms of a uniform substitute material considerably compromises the quality of the modeling result.

  2. Sorption equilibria of ethanol on cork.

    PubMed

    Lequin, Sonia; Chassagne, David; Karbowiak, Thomas; Bellat, Jean-Pierre

    2013-06-05

    We report here for the first time a thermodynamic study of gaseous ethanol sorption on raw cork powder and plate. Our study aims at a better understanding of the reactivity of this material when used as a stopper under enological conditions, thus in close contact with a hydroethanolic solution, wine. Sorption−desorption isotherms were accurately measured by thermogravimetry at 298 K in a large range of relative pressures. Sorption enthalpies were determined by calorimetry as a function of loading. Sorption−desorption isotherms exhibit a hysteresis loop probably due to the swelling of the material and the absorption of ethanol. Surprisingly, the sorption enthalpy of ethanol becomes lower than the liquefaction enthalpy as the filling increases. This result could be attributed to the swelling of the material, which would generate endothermic effects. Sorption of SO₂ on cork containing ethanol was also studied. When the ethanol content in cork is 2 wt %, the amount of SO₂ sorbed is divided by 2. Thus, ethanol does not enhance the sorption rate for SO₂ but, on the contrary, decreases the SO₂ sorption activity onto cork, probably because of competitive sorption mechanisms.

  3. Differential patterns of divergence in ocean drifters: Implications for larval flatfish advection and recruitment

    NASA Astrophysics Data System (ADS)

    Wilderbuer, Thomas; Duffy-Anderson, Janet T.; Stabeno, Phyllis; Hermann, Albert

    2016-05-01

    In an effort to better understand the physics of the eastern Bering Sea shelf current as it relates to flatfish advection to favorable near-shore areas, sets of multiple, satellite-tracked, oceanic drifters were released in 2010, 2012 and 2013. The release sites and dates were chosen to coincide with known spawning locations for northern rock sole (Lepidopsetta polyxystra) and known time of larval emergence. The drifters were drogued 5-each at 20 and 40 m in 2010 and 2012, and 4 at 40 m and 2 at 20 m in 2013. The locations of drifters were used to calculate divergence over a 90-day period that corresponds to the larval pelagic duration of Bering Sea shelf northern rock sole. Results indicate that there are alternating periods of positive and negative divergence with an overall trend toward drifter separation after 90 days, roughly the end of the rock sole planktonic larval period. Examination of the drifter behavior at the hourly scale indicates that semi-daily tidal forcing is the primary mechanism of drifter divergence and convergence. Field observations of early-stage northern rock sole larval distributions over the same period indicate that predominant oceanographic advection is northerly over the continental shelf among preflexion stages, though juveniles are predominantly found in nursery areas located ~ 400 km eastward and inshore. Evidence from drifter deployments suggests that behavioral movements during the postflexion and early juvenile larval phases that optimize eastward periodicity of tidal cycles is a viable mechanism to enhance eastward movement of northern rock sole larvae to favorable nursery grounds. A regional ocean modeling system (ROMS) was implemented to track the different rates of dispersion in simulations both with and without tidal forcing, and was used to estimate effective horizontal eddy diffusion in the case of both isobaric (fixed-depth) and Lagrangian (neutrally buoyant) particles. The addition of tidal forcing had a pronounced

  4. Analyzing critical propagation in a reaction-diffusion-advection model using unstable slow waves.

    PubMed

    Kneer, Frederike; Obermayer, Klaus; Dahlem, Markus A

    2015-02-01

    The effect of advection on the propagation and in particular on the critical minimal speed of traveling waves in a reaction-diffusion model is studied. Previous theoretical studies estimated this effect on the velocity of stable fast waves and predicted the existence of a critical advection strength below which propagating waves are not supported anymore. In this paper, an analytical expression for the advection-velocity relation of the unstable slow wave is derived. In addition, the critical advection strength is calculated taking into account the unstable slow wave solution. We also analyze a two-variable reaction-diffusion-advection model numerically in a wide parameter range. Due to the new control parameter (advection) we can find stable wave propagation in the otherwise non-excitable parameter regime, if the advection strength exceeds a critical value. Comparing theoretical predictions to numerical results, we find that they are in good agreement. Theory provides an explanation for the observed behaviour.

  5. Hybrid Multiscale Finite Volume Method for Advection-Diffusion Equations Subject to Heterogeneous Reactive Boundary Conditions

    SciTech Connect

    Barajas-Solano, David A.; Tartakovsky, A. M.

    2016-10-13

    We present a hybrid scheme for the coupling of macro and microscale continuum models for reactive contaminant transport in fractured and porous media. The transport model considered is the advection-dispersion equation, subject to linear heterogeneous reactive boundary conditions. The Multiscale Finite Volume method (MsFV) is employed to define an approximation to the microscale concentration field defined in terms of macroscopic or \\emph{global} degrees of freedom, together with local interpolator and corrector functions capturing microscopic spatial variability. The macroscopic mass balance relations for the MsFV global degrees of freedom are coupled with the macroscopic model, resulting in a global problem for the simultaneous time-stepping of all macroscopic degrees of freedom throughout the domain. In order to perform the hybrid coupling, the micro and macroscale models are applied over overlapping subdomains of the simulation domain, with the overlap denoted as the handshake subdomain $\\Omega^{hs}$, over which continuity of concentration and transport fluxes between models is enforced. Continuity of concentration is enforced by posing a restriction relation between models over $\\Omega^{hs}$. Continuity of fluxes is enforced by prolongating the macroscopic model fluxes across the boundary of $\\Omega^{hs}$ to microscopic resolution. The microscopic interpolator and corrector functions are solutions to local microscopic advection-diffusion problems decoupled from the global degrees of freedom and from each other by virtue of the MsFV decoupling ansatz. The error introduced by the decoupling ansatz is reduced iteratively by the preconditioned GMRES algorithm, with the hybrid MsFV operator serving as the preconditioner.

  6. Sorption of methylxanthines by different sorbents

    NASA Astrophysics Data System (ADS)

    Dmitrienko, S. G.; Andreeva, E. Yu.; Tolmacheva, V. V.; Terent'eva, E. A.

    2013-05-01

    Sorption of caffeine, theophylline, theobromine, diprophylline, and pentoxyphylline on different sorbents (supercross-linked polystyrene, surface-modified copolymer of styrene and divinylbenzene Strata-X, and carbon nanomaterials Taunit and Diasorb-100-C16T) was studied in a static mode in an effort to find new sorbents suitable for sorption isolation and concentration of methylxanthines. The peculiarities of sorption of methylxanthines were explained in relation to the solution acidity, the nature of the sorbates and their concentration, the nature of the solvent, and the structural characteristics of the sorbents.

  7. Visualizing Vector Fields Using Line Integral Convolution and Dye Advection

    NASA Technical Reports Server (NTRS)

    Shen, Han-Wei; Johnson, Christopher R.; Ma, Kwan-Liu

    1996-01-01

    We present local and global techniques to visualize three-dimensional vector field data. Using the Line Integral Convolution (LIC) method to image the global vector field, our new algorithm allows the user to introduce colored 'dye' into the vector field to highlight local flow features. A fast algorithm is proposed that quickly recomputes the dyed LIC images. In addition, we introduce volume rendering methods that can map the LIC texture on any contour surface and/or translucent region defined by additional scalar quantities, and can follow the advection of colored dye throughout the volume.

  8. Update on Advection-Diffusion Purge Flow Model

    NASA Technical Reports Server (NTRS)

    Brieda, Lubos

    2015-01-01

    Gaseous purge is commonly used in sensitive spacecraft optical or electronic instruments to prevent infiltration of contaminants and/or water vapor. Typically, purge is sized using simplistic zero-dimensional models that do not take into account instrument geometry, surface effects, and the dependence of diffusive flux on the concentration gradient. For this reason, an axisymmetric computational fluid dynamics (CFD) simulation was recently developed to model contaminant infiltration and removal by purge. The solver uses a combined Navier-Stokes and Advection-Diffusion approach. In this talk, we report on updates in the model, namely inclusion of a particulate transport model.

  9. Subsurface barrier design alternatives for confinement and controlled advection flow

    SciTech Connect

    Phillips, S.J.; Stewart, W.E.; Alexander, R.G.; Cantrell, K.J.; McLaughlin, T.J.

    1994-02-01

    Various technologies and designs are being considered to serve as subsurface barriers to confine or control contaminant migration from underground waste storage or disposal structures containing radioactive and hazardous wastes. Alternatives including direct-coupled flood and controlled advection designs are described as preconceptual examples. Prototype geotechnical equipment for testing and demonstration of these alternative designs tested at the Hanford Geotechnical Development and Test Facility and the Hanford Small-Tube Lysimeter Facility include mobile high-pressure injectors and pumps, mobile transport and pumping units, vibratory and impact pile drivers, and mobile batching systems. Preliminary laboratory testing of barrier materials and additive sequestering agents have been completed and are described.

  10. Is Chaotic Advection Inherent to Porous Media Flow?

    NASA Astrophysics Data System (ADS)

    Lester, Daniel; Metcalfe, Guy; Trefry, Mike

    2013-11-01

    All porous media, including granular and packed media, fractured and open networks, are typified by the inherent topological complexity of the pore-space. This topological complexity admits a large number density of stagnation points under steady Stokes flow, which in turn generates a 3D fluid mechanical analouge of the Bakers map, termed the Baker's flow. We demonstrate that via this mechanism, chaotic advection at the pore-scale is inherent to almost all porous media under reasonable conditions, and such dynamics have significant implications for a range of fluid-borne processes including transport and mixing, chemical reactions and biological activity.

  11. Vortex emission accompanies the advection of optical localized structures.

    PubMed

    Haudin, F; Rojas, R G; Bortolozzo, U; Clerc, M G; Residori, S

    2011-02-11

    We show that the advection of optical localized structures is accompanied by the emission of vortices, with phase singularities appearing in the wake of the drifting structure. Localized structures are obtained in a light-valve experiment and made to drift by a mirror tilt in the feedback loop. Pairs of oppositely charged vortices are detected for small drifts, whereas for large drifts a vortex array develops. Observations are supported by numerical simulations and linear stability analysis of the system equations and are expected to be generic for a large class of translated optical patterns.

  12. A convexity preserving scheme for conservative advection transport

    NASA Astrophysics Data System (ADS)

    Xiao, Feng; Peng, Xindong

    2004-08-01

    A simple and practical scheme for advection transport equation is presented. The scheme, namely piecewise rational method (PRM), is a variant of the existing piecewise parabolic method (PPM) of Colella and Woodward (1984). Instead of the parabolic function, a rational function is used for the reconstruction. Making use of the convexity preserving nature of the rational function enables us to obtain oscillation-less numerical solutions, but avoids the adjustments of the cell-interface values to enforce the monotonicity in PPM. The PRM is very simple and computationally efficient. Our numerical results show that PRM is competitive to the PPM in many aspects, such as numerical accuracy and shape-preserving property.

  13. COSOLVENT EFFECTS ON SORPTION ISOTHERM LINEARITY

    EPA Science Inventory

    Sorption-desorption hysteresis, slow desorption kinetics, and other nonideal phenomena have been attributed to the differing sorptive characteristics of the natural organic polymers associated with soils and sediments. In this study, aqueous and mixed solvent systems were used t...

  14. Cobalt sorption in silica-pillared clays.

    PubMed

    Sampieri, A; Fetter, G; Bosch, P; Bulbulian, S

    2006-01-03

    Silicon pillared samples were prepared following conventional and microwave irradiation methods. The samples were characterized and tested in cobalt sorption. Ethylenediammine was added before cobalt addition to improve the amount of cobalt retained. The amount of cobalt introduced in the original clay in the presence of ethylenediammine was the highest. In calcined pillared clays the cobalt retention with ethylenediammine was lower (ca. 40%). In all cases the presence of ethylenediammine increased twice the amount of cobalt sorption measured for aqueous solutions.

  15. Horizontal advection, diffusion and plankton spectra at the sea surface.

    NASA Astrophysics Data System (ADS)

    Bracco, A.; Clayton, S.; Pasquero, C.

    2009-04-01

    Plankton patchiness is ubiquitous in the oceans, and various physical and biological processes have been proposed as its generating mechanisms. However, a coherent statement on the problem is missing, due to both a small number of suitable observations and to an incomplete understanding of the properties of reactive tracers in turbulent media. Abraham (1998) suggested that horizontal advection may be the dominant process behind the observed distributions of phytoplankton and zooplankton, acting to mix tracers with longer reaction times (Rt) down to smaller scales. Conversely, Mahadevan and Campbell (2002) attributed the relative distributions of sea surface temperature and phytoplankton to small scale upwelling, where tracers with longer Rt are able to homogenize more than those with shorter reaction times. Neither of the above mechanisms can explain simultaneously the (relative) spectral slopes of temperature, phytoplankton and zooplankton. Here, with a simple advection model and a large suite of numerical experiments, we concentrate on some of the physical processes influencing the relative distributions of tracers at the ocean surface, and we investigate: 1) the impact of the spatial scale of tracer supply; 2) the role played by coherent eddies on the distribution of tracers with different Rt; 3) the role of diffusion (so far neglected). We show that diffusion determines the distribution of temperature, regardless of the nature of the forcing. We also find that coherent structures together with differential diffusion of tracers with different Rt impact the tracer distributions. This may help in understanding the highly variable nature of observed plankton spectra.

  16. Advection-Based Sparse Data Management for Visualizing Unsteady Flow.

    PubMed

    Guo, Hanqi; Zhang, Jiang; Liu, Richen; Liu, Lu; Yuan, Xiaoru; Huang, Jian; Meng, Xiangfei; Pan, Jingshan

    2014-12-01

    When computing integral curves and integral surfaces for large-scale unsteady flow fields, a major bottleneck is the widening gap between data access demands and the available bandwidth (both I/O and in-memory). In this work, we explore a novel advection-based scheme to manage flow field data for both efficiency and scalability. The key is to first partition flow field into blocklets (e.g. cells or very fine-grained blocks of cells), and then (pre)fetch and manage blocklets on-demand using a parallel key-value store. The benefits are (1) greatly increasing the scale of local-range analysis (e.g. source-destination queries, streak surface generation) that can fit within any given limit of hardware resources; (2) improving memory and I/O bandwidth-efficiencies as well as the scalability of naive task-parallel particle advection. We demonstrate our method using a prototype system that works on workstation and also in supercomputing environments. Results show significantly reduced I/O overhead compared to accessing raw flow data, and also high scalability on a supercomputer for a variety of applications.

  17. Local and nonlocal advection of a passive scalar

    NASA Astrophysics Data System (ADS)

    Scott, R. K.

    2006-11-01

    Passive and active scalar mixing is examined in a simple one-parameter family of two-dimensional flows based on quasi-geostrophic dynamics, in which the active scalar, the quasi-geostrophic potential vorticity, is confined to a single horizontal surface (so-called surface quasi-geostrophic dynamics) and in which a passive scalar field is also advected by the (horizontal, two-dimensional) velocity field at a finite distance from the surface. At large distances from the surface the flow is determined by the largest horizontal scales, the flow is spectrally nonlocal, and a chaotic advection-type regime dominates. At small distances, z, scaling arguments suggest a transition wavenumber kc˜1/2z, where the slope of the passive scalar spectrum changes from k-5/3, determined by local dynamics, to k-1, determined by nonlocal dynamics, analogous to the transition to a k-1 slope in the Batchelor regime in three-dimensional turbulence. Direct numerical simulations reproduce the qualitative aspects of this transition. Other characteristics of the simulated scalar fields, such as the relative dominance of coherent or filamentary structures, are also shown to depend strongly on the degree of locality.

  18. THE ADVECTION OF SUPERGRANULES BY THE SUN'S AXISYMMETRIC FLOWS

    SciTech Connect

    Hathaway, David H.; Williams, Peter E.; Rosa, Kevin Dela; Cuntz, Manfred E-mail: peter.williams@nasa.go

    2010-12-10

    We show that the motions of supergranules are consistent with a model in which they are simply advected by the axisymmetric flows in the Sun's surface shear layer. We produce a 10 day series of simulated Doppler images at a 15 minute cadence that reproduces most spatial and temporal characteristics seen in the SOHO/MDI Doppler data. Our simulated data have a spectrum of cellular flows with just two components-a granule component that peaks at spherical wavenumbers of about 4000 and a supergranule component that peaks at wavenumbers of about 110. We include the advection of these cellular components by the axisymmetric flows-differential rotation and meridional flow-whose variations with latitude and depth (wavenumber) are consistent with observations. We mimic the evolution of the cellular pattern by introducing random variations to the phases of the spectral components at rates that reproduce the levels of cross-correlation as functions of time and latitude. Our simulated data do not include any wave-like characteristics for the supergranules yet can reproduce the rotation characteristics previously attributed to wave-like behavior. We find rotation rates which appear faster than the actual rotation rates and attribute this to projection effects. We find that the measured meridional flow does accurately represent the actual flow and that the observations indicate poleward flow to 65{sup 0}-70{sup 0} latitude with equatorward countercells in the polar regions.

  19. Space-fractional advection-diffusion and reflective boundary condition.

    PubMed

    Krepysheva, Natalia; Di Pietro, Liliana; Néel, Marie-Christine

    2006-02-01

    Anomalous diffusive transport arises in a large diversity of disordered media. Stochastic formulations in terms of continuous time random walks (CTRWs) with transition probability densities showing space- and/or time-diverging moments were developed to account for anomalous behaviors. A broad class of CTRWs was shown to correspond, on the macroscopic scale, to advection-diffusion equations involving derivatives of noninteger order. In particular, CTRWs with Lévy distribution of jumps and finite mean waiting time lead to a space-fractional equation that accounts for superdiffusion and involves a nonlocal integral-differential operator. Within this framework, we analyze the evolution of particles performing symmetric Lévy flights with respect to a fluid moving at uniform speed . The particles are restricted to a semi-infinite domain limited by a reflective barrier. We show that the introduction of the boundary condition induces a modification in the kernel of the nonlocal operator. Thus, the macroscopic space-fractional advection-diffusion equation obtained is different from that in an infinite medium.

  20. Transient responses to spatial perturbations in advective systems.

    PubMed

    Anderson, Kurt E; Nisbet, Roger M; McCauley, Edward

    2008-07-01

    We study the transient dynamics, following a spatially-extended perturbation of models describing populations residing in advective media such as streams and rivers. Our analyses emphasize metrics that are independent of initial perturbations-resilience, reactivity, and the amplification envelope-and relate them to component spatial wavelengths of the perturbation using spatial Fourier transforms of the state variables. This approach offers a powerful way of understanding the influence of spatial scale on the initial dynamics of a population following a spatially variable environmental perturbation, an important property in determining the ecological implications of transient dynamics in advective systems. We find that asymptotically stable systems may exhibit transient amplification of perturbations (i.e., have positive reactivity) for some spatial wavelengths and not others. Furthermore, the degree and duration of amplification varies strongly with spatial wavelength. For two single-population models, there is a relationship between transient dynamics and the response length that characterizes the steady state response to spatial perturbations: a long response length implies that peak amplification of perturbations is small and occurs fast. This relationship holds less generally in a specialist consumer-resource model, likely due to the model's tendency for flow-induced instabilities at an alternative characteristic spatial scale.

  1. A cryogenic circulating advective multi-pass absorption cell

    NASA Astrophysics Data System (ADS)

    Stockett, M. H.; Lawler, J. E.

    2012-03-01

    A novel absorption cell has been developed to enable a spectroscopic survey of a broad range of polycyclic aromatic hydrocarbons (PAH) under astrophysically relevant conditions and utilizing a synchrotron radiation continuum to test the still controversial hypothesis that these molecules or their ions could be carriers of the diffuse interstellar bands. The cryogenic circulating advective multi-pass absorption cell resembles a wind tunnel; molecules evaporated from a crucible or injected using a custom gas feedthrough are entrained in a laminar flow of cryogenically cooled buffer gas and advected into the path of the synchrotron beam. This system includes a multi-pass optical White cell enabling absorption path lengths of hundreds of meters and a detection sensitivity to molecular densities on the order of 107 cm-3. A capacitively coupled radio frequency dielectric barrier discharge provides ionized and metastable buffer gas atoms for ionizing the candidate molecules via charge exchange and the Penning effect. Stronger than expected clustering of PAH molecules has slowed efforts to record gas phase PAH spectra at cryogenic temperatures, though such clusters may play a role in other interstellar phenomena.

  2. A cryogenic circulating advective multi-pass absorption cell.

    PubMed

    Stockett, M H; Lawler, J E

    2012-03-01

    A novel absorption cell has been developed to enable a spectroscopic survey of a broad range of polycyclic aromatic hydrocarbons (PAH) under astrophysically relevant conditions and utilizing a synchrotron radiation continuum to test the still controversial hypothesis that these molecules or their ions could be carriers of the diffuse interstellar bands. The cryogenic circulating advective multi-pass absorption cell resembles a wind tunnel; molecules evaporated from a crucible or injected using a custom gas feedthrough are entrained in a laminar flow of cryogenically cooled buffer gas and advected into the path of the synchrotron beam. This system includes a multi-pass optical White cell enabling absorption path lengths of hundreds of meters and a detection sensitivity to molecular densities on the order of 10(7) cm(-3). A capacitively coupled radio frequency dielectric barrier discharge provides ionized and metastable buffer gas atoms for ionizing the candidate molecules via charge exchange and the Penning effect. Stronger than expected clustering of PAH molecules has slowed efforts to record gas phase PAH spectra at cryogenic temperatures, though such clusters may play a role in other interstellar phenomena.

  3. Observation of Magnetic Reconnection Driven by Granular Scale Advection

    NASA Astrophysics Data System (ADS)

    Zeng, Zhichen; Cao, W.; Ji, H.

    2013-07-01

    We report the first evidence of magnetic reconnection driven by advection in a rapidly developing large granule, using high spatial resolution observations of a small surge event (base size 4‧‧ by 4‧‧) with the 1.6 meter aperture New Solar Telescope (NST) at Big Bear Solar Observatory. The observations were carried out in narrow-band (0.5 Å) Helium I 10830 Å and broad-band (10 Å) TiO 7057 Å. Since He I 10830 Å triplet has very high excitation level and is optically thin, its filtergrams enable us to investigate the surge from the photosphere through the chromosphere into the lower corona. Simultaneous space data from Atmospheric Imaging Assembly (AIA) and Helioseismic and Magnetic Imager (HMI) on board the Solar Dynamics Observatory (SDO) were used in the analysis. It is shown that the surge is spatio-temporally associated with magnetic flux emergence in the rapidly developing large granule. During the development of the granule, its advecting flow ( 2 km/ s) squeezed the magnetic flux into an intergranular lane area, where a magnetic flux concentration was formed and the neighboring flux with opposite magnetic polarity was cancelled. During the cancellation, the surge was produced as absorption in He I 10830 Å filtergrams while simultaneous EUV brightening occurred at its base. The observations clearly indicate evidence of finest-scale reconnection process driven by the granule’s motion.

  4. Observation of Magnetic Reconnection Driven by Granular Scale Advection

    NASA Astrophysics Data System (ADS)

    Zeng, Zhicheng; Cao, Wenda; Ji, Haisheng

    2013-06-01

    We report the first evidence of magnetic reconnection driven by advection in a rapidly developing large granule using high spatial resolution observations of a small surge event (base size ~ 4'' × 4'') with the 1.6 m aperture New Solar Telescope at the Big Bear Solar Observatory. The observations were carried out in narrowband (0.5 Å) He I 10830 Å and broadband (10 Å) TiO 7057 Å. Since He I 10830 Å triplet has a very high excitation level and is optically thin, its filtergrams enable us to investigate the surge from the photosphere through the chromosphere into the lower corona. Simultaneous space data from the Atmospheric Imaging Assembly and Helioseismic and Magnetic Imager on board the Solar Dynamics Observatory were used in the analysis. It is shown that the surge is spatio-temporally associated with magnetic flux emergence in the rapidly developing large granule. During the development of the granule, its advecting flow (~2 km s-1) squeezed the magnetic flux into an intergranular lane area, where a magnetic flux concentration was formed and the neighboring flux with opposite magnetic polarity was canceled. During the cancellation, the surge was produced as absorption in He I 10830 Å filtergrams while simultaneous EUV brightening occurred at its base. The observations clearly indicate evidence of a finest-scale reconnection process driven by the granule's motion.

  5. Positivity-preserving numerical schemes for multidimensional advection

    NASA Technical Reports Server (NTRS)

    Leonard, B. P.; Macvean, M. K.; Lock, A. P.

    1993-01-01

    This report describes the construction of an explicit, single time-step, conservative, finite-volume method for multidimensional advective flow, based on a uniformly third-order polynomial interpolation algorithm (UTOPIA). Particular attention is paid to the problem of flow-to-grid angle-dependent, anisotropic distortion typical of one-dimensional schemes used component-wise. The third-order multidimensional scheme automatically includes certain cross-difference terms that guarantee good isotropy (and stability). However, above first-order, polynomial-based advection schemes do not preserve positivity (the multidimensional analogue of monotonicity). For this reason, a multidimensional generalization of the first author's universal flux-limiter is sought. This is a very challenging problem. A simple flux-limiter can be found; but this introduces strong anisotropic distortion. A more sophisticated technique, limiting part of the flux and then restoring the isotropy-maintaining cross-terms afterwards, gives more satisfactory results. Test cases are confined to two dimensions; three-dimensional extensions are briefly discussed.

  6. A cryogenic circulating advective multi-pass absorption cell

    SciTech Connect

    Stockett, M. H.; Lawler, J. E.

    2012-03-15

    A novel absorption cell has been developed to enable a spectroscopic survey of a broad range of polycyclic aromatic hydrocarbons (PAH) under astrophysically relevant conditions and utilizing a synchrotron radiation continuum to test the still controversial hypothesis that these molecules or their ions could be carriers of the diffuse interstellar bands. The cryogenic circulating advective multi-pass absorption cell resembles a wind tunnel; molecules evaporated from a crucible or injected using a custom gas feedthrough are entrained in a laminar flow of cryogenically cooled buffer gas and advected into the path of the synchrotron beam. This system includes a multi-pass optical White cell enabling absorption path lengths of hundreds of meters and a detection sensitivity to molecular densities on the order of 10{sup 7} cm{sup -3}. A capacitively coupled radio frequency dielectric barrier discharge provides ionized and metastable buffer gas atoms for ionizing the candidate molecules via charge exchange and the Penning effect. Stronger than expected clustering of PAH molecules has slowed efforts to record gas phase PAH spectra at cryogenic temperatures, though such clusters may play a role in other interstellar phenomena.

  7. Chaotic advection in 2D anisotropic porous media

    NASA Astrophysics Data System (ADS)

    Varghese, Stephen; Speetjens, Michel; Trieling, Ruben; Toschi, Federico

    2015-11-01

    Traditional methods for heat recovery from underground geothermal reservoirs employ a static system of injector-producer wells. Recent studies in literature have shown that using a well-devised pumping scheme, through actuation of multiple injector-producer wells, can dramatically enhance production rates due to the increased scalar / heat transport by means of chaotic advection. However the effect of reservoir anisotropy on kinematic mixing and heat transport is unknown and has to be incorporated and studied for practical deployment in the field. As a first step, we numerically investigate the effect of anisotropy (both magnitude and direction) on (chaotic) advection of passive tracers in a time-periodic Darcy flow within a 2D circular domain driven by periodically reoriented diametrically opposite source-sink pairs. Preliminary results indicate that anisotropy has a significant impact on the location, shape and size of coherent structures in the Poincare sections. This implies that the optimal operating parameters (well spacing, time period of well actuation) may vary strongly and must be carefully chosen so as to enhance subsurface transport. This work is part of the research program of the Foundation for Fundamental Research on Matter (FOM), which is part of Netherlands Organisation for Scientific Research (NWO). This research program is co-financed by Shell Global Solutions International B.V.

  8. Evaluating phenanthrene sorption on various wood chars

    USGS Publications Warehouse

    James, G.; Sabatini, D.A.; Chiou, C.T.; Rutherford, D.; Scott, A.C.; Karapanagioti, H.K.

    2005-01-01

    A certain amount of wood char or soot in a soil or sediment sample may cause the sorption of organic compounds to deviate significantly from the linear partitioning commonly observed with soil organic matter (SOM). Laboratory produced and field wood chars have been obtained and analyzed for their sorption isotherms of a model solute (phenanthrene) from water solution. The uptake capacities and nonlinear sorption effects with the laboratory wood chars are similar to those with the field wood chars. For phenanthrene aqueous concentrations of 1 ??gl-1, the organic carbon-normalized sorption coefficients (log Koc) ranging from 5.0 to 6.4 for field chars and 5.4-7.3 for laboratory wood chars, which is consistent with literature values (5.6-7.1). Data with artificial chars suggest that the variation in sorption potential can be attributed to heating temperature and starting material, and both the quantity and heterogeneity of surface-area impacts the sorption capacity. These results thus help to corroborate and explain the range of log Koc values reported in previous research for aquifer materials containing wood chars. ?? 2004 Elsevier Ltd. All rights reserved.

  9. [Aluminum dissolution and changes of pH in soil solution during sorption of copper by aggregates of paddy soil].

    PubMed

    Xu, Hai-Bo; Zhao, Dao-Yuan; Qin, Chao; Li, Yu-Jiao; Dong, Chang-Xun

    2014-01-01

    Size fractions of soil aggregates in Lake Tai region were collected by the low-energy ultrasonic dispersion and the freeze-desiccation methods. The dissolution of aluminum and changes of pH in soil solution during sorption of Cu2+ and changes of the dissolution of aluminum at different pH in the solution of Cu2+ by aggregates were studied by the equilibrium sorption method. The results showed that in the process of Cu2+ sorption by aggregates, the aluminum was dissoluted and the pH decreased. The elution amount of aluminum and the decrease of pH changed with the sorption of Cu2+, both increasing with the increase of Cu2+ sorption. Under the same conditions, the dissolution of aluminum and the decrease of pH were in the order of coarse silt fraction > silt fraction > sand fraction > clay fraction, which was negatively correlated with the amount of iron oxide, aluminum and organic matter. It suggested that iron oxide, aluminum and organic matters had inhibitory and buffering effect on the aluminum dissolution and the decrease of pH during the sorption of Cu2+.

  10. Characteristics and oil sorption effectiveness of kapok fibre, sugarcane bagasse and rice husks: oil removal suitability matrix.

    PubMed

    Ali, Norizan; El-Harbawi, Mohanad; Jabal, Ayman Abo; Yin, Chun-Yang

    2012-01-01

    The characteristics and water/oil sorption effectiveness ofkapok fibre, sugarcane bagasse and rice husks have been compared. The three biomass types were subjected to field emission scanning electron microscopy-energy dispersive X-ray spectroscopy and surface tension analyses for liquid-air and oil-water systems were conducted. Both kapok fibre and sugarcane bagasse exhibit excellent oil sorption capabilities for diesel, crude, new engine and used engine oils as their oil sorption capacities all exceed 10 g/g. The synthetic sorbent exhibits oil sorption capacities comparable with sugarcane bagasse, while rice husks exhibit the lowest oil sorption capacities among all the sorbents. Kapok fibre shows overwhelmingly high oil-to-water sorption (O/W) ratios ranging from 19.35 to 201.53 while sugarcane bagasse, rice husks and synthetic sorbent have significantly lower O/W ratios (0.76-2.69). This suggests that kapok fibre is a highly effective oil sorbent even in well-mixed oil-water media. An oil sorbent suitability matrix is proposed to aid stakeholders in evaluating customized oil removal usage of the natural sorbents.

  11. Investigation of structure and properties of novel multi-layer clay nanocomposite films produced controllably by continuous chaotic advection blending

    NASA Astrophysics Data System (ADS)

    Mahesha, Chaitra

    A unique processing technique based on chaotic advection developed at Clemson University and shown to controllably produce structured materials in the past was employed to produce structured nanocomposites with a high degree of clay orientation as well as localization of platelets within layers of nanoscale thicknesses. Continuous lengths of nanocomposites with different clay contents were extruded in the form of films by feeding separately melts of virgin polyamide-6 polymer and polyamide 6-clay masterbatch into a continuous chaotic advection blender. A variety of composite structures were producible at fixed clay compositions. The internal structure was characterized by transmission electron microscopy (TEM), x-ray diffraction (XRD) and differential scanning calorimetry (DSC). Nanocomposites with novel in-situ multi-layered structures and a high degree of platelet orientation were formed by the recursive stretching and folding of the melt domains due to chaotic advection. Clay platelets were localized within discrete regions to form alternating virgin and platelet-rich layers leading to a hierarchical structure with multiple nano-scales. The thicknesses of the layers reduced with prolonged chaotic advection, eventually leading to nanocomposites in which the multi-layering was no longer discernible. The oriented platelets appeared to be homogenously dispersed through the bulk of the nanocomposite. Investigation of the morphology of the matrix by XRD showed that the homogeneity of the crystalline phase and the orientation of polymer chains parallel to the film surface increased with increased chaotic advection. Also, as the layer thickness reduced, the number of polymer chains restricted by clay platelets increased causing the gamma-crystalline fraction to increase. While XRD results suggested a change in total crystallinity with chaotic advection and clay content but without a specific trend, no change in crystallinity was measured by DSC. Such contradictions are

  12. Herschel flight models sorption coolers

    NASA Astrophysics Data System (ADS)

    Duband, L.; Clerc, L.; Ercolani, E.; Guillemet, L.; Vallcorba, R.

    2008-03-01

    The Herschel and Planck satellites will be jointly launched on an ARIANE 5 in 2008. The Herschel payload consists of three instruments built by international scientific consortia, heterodyne instrument for first (HIFI), photo-conductor array camera and spectrometer (PACS) and spectral and photometric imaging receiver (SPIRE). The spacecraft provides the environment for astronomical observations in the infrared and sub-millimeter wavelength range requiring cryogenic temperatures for the cold focal plane units. The spectral and photometric imaging receiver (SPIRE) will cover the 200-670 μm spectral range using bolometric detectors, as the photo-conductor array camera and spectrometer (PACS) will cover the 60-210 μm spectral range. Both instruments SPIRE and PACS feature detectors operating at 300 mK. This cooling will be effected by two helium sorption coolers developed at the Service des Basses Températures of the Commissariat à l'Energie Atomique (CEA-SBT). These coolers based on an evaporative cooling cycle features no moving parts and can be recycled indefinitely pending the availability of a cold heat sink at temperature below 3 K. Several models were developed in the course of the Herschel program and this paper deals with the design, manufacturing and qualification of the flight model coolers.

  13. Bacterial sorption of heavy metals

    SciTech Connect

    Mullen, M.D.; Wolf, D.C.; Ferris, F.G.; Beveridge, T.J.; Flemming, C.A.

    1989-01-01

    Four bacteria, Bacillus cereus, B. subtilis, Escherichia coli, and Pseudomonas aeruginosa, were examined for the ability to remove Ag{sup +}, Cd{sup 2+}, Cu{sup 2+}, and La{sup 3+} from solution by batch equilibration methods. Cd and Cu sorption over the concentration range 0.001 to 1 mM was described by Freundlich isotherms. At 1 mM concentrations of both Cd{sup 2+} and Cu{sup 2+}, P. aeruginosa and B. cereus were the most and least efficient at metal removal, respectively. Freundlich K constants indicated that E. coli was most efficient at Cd{sup 2+} removal and B. subtilis removed the most Cu{sup 2+}. Removal of Ag{sup +} from solution by bacteria was very efficient; an average of 89% of the total Ag{sup +} was removed from the 1 mM solution, whereas only 12, 29, and 27% of the total Cd{sup 2+}, Cu{sup 2+}, and La{sup 3+}, respectively, were sorbed from 1 mM solutions. Electron microscopy indicated that La{sup 3+} accumulated at the cell surface as needlelike, crystalline precipitates. Silver precipitated as discrete colloidal aggregates at the cell surface and occasionally in the cytoplasma. The results indicate that bacterial cells are capable of binding large quantities of different metals.

  14. Colloid particle size-dependent dispersivity

    NASA Astrophysics Data System (ADS)

    Chrysikopoulos, C. V.; Katzourakis, V. E.

    2014-12-01

    Laboratory and field studies have demonstrated that dispersion coefficients evaluated by fitting advection-dispersion transport models to nonreactive tracer breakthrough curves do not adequately describe colloid transport under the same flow field conditions. Here an extensive laboratory study was undertaken to assess whether the dispersivity, which traditionally has been considered to be a property of the porous medium, is dependent on colloid particle size and interstitial velocity. A total of 49 colloid transport experiments were performed in columns packed with glass beads under chemically unfavorable colloid attachment conditions. Nine different colloid diameters, and various flow velocities were examined. The breakthrough curves were successfully simulated with a mathematical model describing colloid transport in homogeneous, water saturated porous media. The results demonstrated that the dispersivity is positively correlated with colloid particle size, and increases with increasing velocity.

  15. Competitive sorption of organic contaminants in chalk

    NASA Astrophysics Data System (ADS)

    Graber, E. R.; Borisover, M.

    2003-12-01

    In the Negev desert, Israel, a chemical industrial complex is located over fractured Eocene chalk formations where transfer of water and solutes between fracture voids and matrix pores affects migration of contaminants in the fractures due to diffusion into the chalk matrix. This study tests sorption and sorption competition between contaminants in the chalk matrix to make it possible to evaluate the potential for contaminant attenuation during transport in fractures. Single solute sorption isotherms on chalk matrix material for five common contaminants ( m-xylene, ametryn, 1,2-dichloroethane, phenanthrene, and 2,4,6-tribromophenol) were found to be nonlinear, as confirmed in plots of Kd versus initial solution concentration. Over the studied concentration ranges, m-xylene Kd varied by more than a factor of 100, ametryn Kd by a factor of 4, 1,2-dichloroethane Kd by more than a factor of 3, phenanthrene Kd by about a factor of 2, and 2,4,6-tribromophenol Kd by a factor of 10. It was earlier found that sorption is to the organic matter component of the chalk matrix and not to the mineral phases (Chemosphere 44 (2001) 1121). Nonlinear sorption isotherms indicate that there is at least some finite sorption domain. Bi-solute competition experiments with 2,4,6-tribromophenol as the competitor were designed to explore the nature of the finite sorption domain. All of the isotherms in the bi-solute experiments are more linear than in the single solute experiments, as confirmed by smaller variations in Kd as a function of initial solution concentration. For both m-xylene and ametryn, there is a small nonlinear component or domain that was apparently not susceptible to competition by 2,4,6-tribromophenol. The nonlinear sorption domain(s) is best expressed at low solution concentrations. Inert-solvent-normalized single and bi-solute sorption isotherms demonstrate that ametryn undergoes specific force interactions with the chalk sorbent. The volume percent of phenanthrene

  16. Sorption of inorganic salts on carbon nanomaterials and magnetite

    NASA Astrophysics Data System (ADS)

    Lyu, Sh. T.; Troshkina, I. D.; Rakov, E. G.

    2016-11-01

    Magnetic composites based on graphene oxides and functionalized carbon nanotubes containing magnetite nanoparticles are synthesized. The dispersing ability of these composites in water at different pH values is studied. It is shown that the solubility of Fe3O4 composites is constant in the pH range of 3.5-10, though these composites are unstable at both lower and higher pH values. Magnetic sorbents for extracting Ce(NO3)3 and La(NO3)3 from solutions are tested. Dependences of the volume on the sorbent's composition, pH value, and salt concentration in the solution are found. Maximum sorption capacity in relation to Ce3+ and La3+ at pH 7.5 and 8.5 are found to be 1040 and 920 mg/g respectively.

  17. Sorption of chlorophenols on microporous minerals: mechanism and influence of metal cations, solution pH, and humic acid.

    PubMed

    Yang, Hui; Hu, Yuanan; Cheng, Hefa

    2016-10-01

    Sorption of 2-chlorophenol (2-CP), 2,4-dichlorophenol (2,4-DCP), and 2,4,6-trichlorophenol (2,4,6-TCP) on a range of dealuminated zeolites were investigated to understand the mechanism of their sorption on microporous minerals, while the influence of common metal cations, solution pH, and humic acid was also studied. Sorption of chlorophenols was found to increase with the hydrophobicity of the sorbates and that of the microporous minerals, indicating the important role of hydrophobic interactions, while sorption was also stronger in the micropores of narrower sizes because of greater enhancement of the dispersion interactions. The presence of metal cations could enhance chlorophenol sorption due to the additional electrostatic attraction between metal cations exchanged into the mineral micropores and the chlorophenolates, and this effect was apparent on the mineral sorbent with a high density of surface cations (2.62 sites/nm(2)) in its micropores. Under circum-neutral or acidic conditions, neutral chlorophenol molecules adsorbed into the hydrophobic micropores through displacing the "loosely bound" water molecules, while their sorption was negligible under moderately alkaline conditions due to electrostatic repulsion between the negatively charged zeolite framework and anionic chlorophenolates. The influence of humic acid on sorption of chlorophenols on dealuminated Y zeolites suggests that its molecules did not block the micropores but created a secondary sorption sites by forming a "coating layer" on the external surface of the zeolites. These mechanistic insights could help better understand the interactions of ionizable chlorophenols and metal cations in mineral micropores and guide the selection and design of reusable microporous mineral sorbents for sorptive removal of chlorophenols from aqueous stream.

  18. Thermally driven advection for radioxenon transport from an underground nuclear explosion

    NASA Astrophysics Data System (ADS)

    Sun, Yunwei; Carrigan, Charles R.

    2016-05-01

    Barometric pumping is a ubiquitous process resulting in migration of gases in the subsurface that has been studied as the primary mechanism for noble gas transport from an underground nuclear explosion (UNE). However, at early times following a UNE, advection driven by explosion residual heat is relevant to noble gas transport. A rigorous measure is needed for demonstrating how, when, and where advection is important. In this paper three physical processes of uncertain magnitude (oscillatory advection, matrix diffusion, and thermally driven advection) are parameterized by using boundary conditions, system properties, and source term strength. Sobol' sensitivity analysis is conducted to evaluate the importance of all physical processes influencing the xenon signals. This study indicates that thermally driven advection plays a more important role in producing xenon signals than oscillatory advection and matrix diffusion at early times following a UNE, and xenon isotopic ratios are observed to have both time and spatial dependence.

  19. Sorption of Pahs To Soil Minerals and Subsurface Soil

    NASA Astrophysics Data System (ADS)

    Mueller, S.; Totsche, K. U.; Koegel-Knabner, I.

    In subsurface soil horizons, the sorption of hydrophobic organic contaminants may primarily be controlled by the composition and the properties of the soil minerals. Therefore this study aimed to elucidate the sorption and the sorption kinetics of hydrophobic organic contaminants to different inorganic soil constituents and subsurface soil horizons. Batch sorption experiments are conducted with three poly- cyclic aromatic hydrocarbons (PAHS; phenanthrene, pyrene and benzo(a)pyrene), with the model minerals quartz sand, quartz sand coated with goethite and a quartz sand - mont- morillonite mixture, and with b and c horizons of different soil types developped in the temperate climate. Batch experiments show a considerable sorption of PAHS to all soil minerals and soil horizons except for the sorption of phenanthrene to quartz sand. The sorption process of PAHS to single minerals is rapid and completed after 4 hours of contact time. The sorption to subsurface soil horizons, however, is not in equilibrium after 120h of contact time and shows a considerable sorption kinetic. Sorption capacity is higher for clay minerals and iron oxides than for quartz sand which corresponds with a higher sorption capacity of soil horizons with a high clay content. Sorption isotherms of the soil minerals are best described by a nonlinear isotherm whereas the sorption isotherms of the subsurface soil horizons are more or less linear indicating different sorption mechanisms for mineral sorbents and soil horizons.

  20. Dual-mode sorption model for single- and multisolute sorption onto organoclays

    SciTech Connect

    Huh, J.K.; Song, D.I.; Jeon, Y.W.

    1999-02-01

    The dual-mode sorption model (DSM) was applied to the single-solute sorption of 2-chlorophenol, 3-cyanophenol, and 4-nitrophenol from water onto organoclays. The three parameters contained in the DSM were determined for each solute by fitting to the single-solute isotherm data and subsequently utilized in competitive multisolute sorptions. A systematic method to determine the parameters for each solute was also suggested. The ideal adsorbed solution theory (IAST) coupled with the single-solute DSM and the competitive dual-mode sorption model (CDSM) extended to describe multisolute sorption were used to predict multisolute sorption onto organoclays and compared with the data to determine the predictive capabilities. The DSM was found to describe well single-solute sorption from water onto organoclays. The predictions from the CDSM and the IAST based on the DSM, though rather poor for some solutes, were generally in agreement with the multisolute sorption data. However,the authors could not tell at this stage which of the two competitive models is better.

  1. Ocular dispersion

    NASA Astrophysics Data System (ADS)

    Hammer, Daniel X.; Noojin, Gary D.; Thomas, Robert J.; Stolarski, David J.; Rockwell, Benjamin A.; Welch, Ashley J.

    1999-06-01

    Spectrally resolved white-light interferometry (SRWLI) was used to measure the wavelength dependence of refractive index (i.e., dispersion) for various ocular components. The accuracy of the technique was assessed by measurement of fused silica and water, the refractive indices of which have been measured at several different wavelengths. The dispersion of bovine and rabbit aqueous and vitreous humor was measured from 400 to 1100 nm. Also, the dispersion was measured from 400 to 700 nm for aqueous and vitreous humor extracted from goat and rhesus monkey eyes. For the humors, the dispersion did not deviate significantly from water. In an additional experiment, the dispersion of aqueous and vitreous humor that had aged up to a month was compared to freshly harvested material. No difference was found between the fresh and aged media. An unsuccessful attempt was also made to use the technique for dispersion measurement of bovine cornea and lens. Future refinement may allow measurement of the dispersion of cornea and lens across the entire visible and near-infrared wavelength band. The principles of white- light interferometry including image analysis, measurement accuracy, and limitations of the technique, are discussed. In addition, alternate techniques and previous measurements of ocular dispersion are reviewed.

  2. Unification of some advection schemes in two dimensions

    NASA Technical Reports Server (NTRS)

    Sidilkover, D.; Roe, P. L.

    1995-01-01

    The relationship between two approaches towards construction of genuinely two-dimensional upwind advection schemes is established. One of these approaches is of the control volume type applicable on structured cartesian meshes. It resulted in the compact high resolution schemes capable of maintaining second order accuracy in both homogeneous and inhomogeneous cases. Another one is the fluctuation splitting approach, which is well suited for triangular (and possibly) unstructured meshes. Understanding the relationship between these two approaches allows us to formulate here a new fluctuation splitting high resolution (i.e. possible use of artificial compression, while maintaining positivity property) scheme. This scheme is shown to be linearity preserving in inhomogeneous as well as homogeneous cases.

  3. Mobile scintillometry to study heat advection over heterogeneous surfaces

    NASA Astrophysics Data System (ADS)

    Kleissl, J.

    2007-12-01

    Large Aperture Scintillometer (LAS) receivers measure the structure parameter of the refractive index from intensity fluctuations of the transmitter beam. Due to the spatial averaging over 1-4 km employed by this emerging technique the constraints for long temporal averaging (15-30 min) and associated uncertainties that have to be met by other flux measurement techniques do not apply for LASs. In this paper the constraints for temporal averaging of LASs will be examined as a function of environmental conditions and transect geometry. Moreover, analysis of data from a mobile LAS measurement across a surface gradient from rough and dry to smoother and wet will be presented. In this experiment the LAS was mounted on a pickup truck, allowing for quick redeployment of the transect after meaurement. The potential for the use of LAS to study local advection of heat in riparian or irrigated areas in the semi-arid southwest will be evaluated.

  4. Microscale chaotic advection enables robust convective DNA replication.

    PubMed

    Priye, Aashish; Hassan, Yassin A; Ugaz, Victor M

    2013-11-05

    The ability of chaotic advection under microscale confinement to direct chemical processes along accelerated kinetic pathways has been recognized for some time. However, practical applications have been slow to emerge because optimal results are often counterintuitively achieved in flows that appear to possess undesirably high disorder. Here we present a 3D time-resolved analysis of polymerase chain reaction (PCR)-mediated DNA replication across a broad ensemble of geometric states. The resulting parametric map reveals an unexpectedly wide operating regime where reaction rates remain constant over 2 orders of magnitude of the Rayleigh number, encompassing virtually any realistic PCR condition (temperature, volume, gravitational alignment), a level of robustness previously thought unattainable in the convective format.

  5. Dependence of advection-diffusion-reaction on flow coherent structures

    NASA Astrophysics Data System (ADS)

    Tang, Wenbo; Luna, Christopher

    2013-10-01

    A study on an advection-diffusion-reaction system is presented. Variability of the reaction process in such a system triggered by a highly localized source is quantified. It is found, for geophysically motivated parameter regimes, that the difference in bulk concentration subject to realizations of different source locations is highly correlated with the local flow topology of the source. Such flow topologies can be highlighted by Lagrangian coherent structures. Reaction is relatively enhanced in regions of strong stretching, and relatively suppressed in regions where vortices are present. In any case, the presence of a divergence-free background flow helps speed up the reaction process, especially when the flow is time-dependent. Probability density of various quantities characterizing the reaction processes is also obtained. This reveals the inherent complexity of the reaction-diffusion process subject to nonlinear background stirring.

  6. Advection in polar and sub-polar environments: Impacts on high latitude marine ecosystems

    NASA Astrophysics Data System (ADS)

    Hunt, George L.; Drinkwater, Kenneth F.; Arrigo, Kevin; Berge, Jørgen; Daly, Kendra L.; Danielson, Seth; Daase, Malin; Hop, Haakon; Isla, Enrique; Karnovsky, Nina; Laidre, Kristin; Mueter, Franz J.; Murphy, Eugene J.; Renaud, Paul E.; Smith, Walker O.; Trathan, Philip; Turner, John; Wolf-Gladrow, Dieter

    2016-12-01

    We compare and contrast the ecological impacts of atmospheric and oceanic circulation patterns on polar and sub-polar marine ecosystems. Circulation patterns differ strikingly between the north and south. Meridional circulation in the north provides connections between the sub-Arctic and Arctic despite the presence of encircling continental landmasses, whereas annular circulation patterns in the south tend to isolate Antarctic surface waters from those in the north. These differences influence fundamental aspects of the polar ecosystems from the amount, thickness and duration of sea ice, to the types of organisms, and the ecology of zooplankton, fish, seabirds and marine mammals. Meridional flows in both the North Pacific and the North Atlantic oceans transport heat, nutrients, and plankton northward into the Chukchi Sea, the Barents Sea, and the seas off the west coast of Greenland. In the North Atlantic, the advected heat warms the waters of the southern Barents Sea and, with advected nutrients and plankton, supports immense biomasses of fish, seabirds and marine mammals. On the Pacific side of the Arctic, cold waters flowing northward across the northern Bering and Chukchi seas during winter and spring limit the ability of boreal fish species to take advantage of high seasonal production there. Southward flow of cold Arctic waters into sub-Arctic regions of the North Atlantic occurs mainly through Fram Strait with less through the Barents Sea and the Canadian Archipelago. In the Pacific, the transport of Arctic waters and plankton southward through Bering Strait is minimal. In the Southern Ocean, the Antarctic Circumpolar Current and its associated fronts are barriers to the southward dispersal of plankton and pelagic fishes from sub-Antarctic waters, with the consequent evolution of Antarctic zooplankton and fish species largely occurring in isolation from those to the north. The Antarctic Circumpolar Current also disperses biota throughout the Southern Ocean

  7. Examination of the evolution of radiation and advection fogs. Final report

    SciTech Connect

    Orgill, M.M.

    1993-01-01

    A literature study was done on radiation and advection fog evolution. For radiation fog, six stages of fog evolution have been identified -- (1) precursor, (2) sunset, (3) conditioning, (4) mature, (5) sunrise, and (6) dissipation. The evolution of advection fog models has been in parallel with radiation fog models, but no identified stages in the evolution of advection fog have been proposed: (1) precursor, (2) initiation, (3) mature, and (4) dissipation. Radiation and advection fog models will require greater sophistication in order to study fog spatial and temporal variability. Physical aspects that require further study are discussed.

  8. How Hydrate Saturation Anomalies are Diffusively Constructed and Advectively Smoothed

    NASA Astrophysics Data System (ADS)

    Rempel, A. W.; Irizarry, J. T.; VanderBeek, B. P.; Handwerger, A. L.

    2015-12-01

    The physical processes that control the bulk characteristics of hydrate reservoirs are captured reasonably well by long-established model formulations that are rooted in laboratory-verified phase equilibrium parameterizations and field-based estimates of in situ conditions. More detailed assessments of hydrate distribution, especially involving the occurrence of high-saturation hydrate anomalies have been more difficult to obtain. Spatial variations in sediment properties are of central importance for modifying the phase behavior and promoting focussed fluid flow. However, quantitative predictions of hydrate anomaly development cannot be made rigorously without also addressing the changes in phase behavior and mechanical balances that accompany changes in hydrate saturation level. We demonstrate how pore-scale geometrical controls on hydrate phase stability can be parameterized for incorporation in simulations of hydrate anomaly development along dipping coarse-grained layers embedded in a more fine-grained background that is less amenable to fluid transport. Model simulations demonstrate how hydrate anomaly growth along coarse-layer boundaries is promoted by diffusive gas transport from the adjacent fine-grained matrix, while advective transport favors more distributed growth within the coarse-grained material and so effectively limits the difference between saturation peaks and background levels. Further analysis demonstrates how sediment contacts are unloaded once hydrate saturation reaches sufficient levels to form a load-bearing skeleton that can evolve to produce segregated nodules and lenses. Decomposition of such growth forms poses a significant geohazard that is expected to be particularly sensitive to perturbations induced by gas extraction. The figure illustrates the predicted evolution of hydrate saturation Sh in a coarse-grained dipping layer showing how prominent bounding hydrate anomalies (spikes) supplied by diffusive gas transport at early times

  9. Sorption Modeling and Verification for Off-Gas Treatment

    SciTech Connect

    Tavlarides, Lawrence; Yiacoumi, Sotira; Tsouris, Costas; Gabitto, Jorge; DePaoli, David

    2016-12-20

    This project was successfully executed to provide valuable adsorption data and improve a comprehensive model developed in previous work by the authors. Data obtained were used in an integrated computer program to predict the behavior of adsorption columns. The model is supported by experimental data and has been shown to predict capture of off gas similar to that evolving during the reprocessing of nuclear waste. The computer program structure contains (a) equilibrium models of off-gases with the adsorbate; (b) mass-transfer models to describe off-gas mass transfer to a particle, diffusion through the pores of the particle, and adsorption on the active sites of the particle; and (c) incorporation of these models into fixed bed adsorption modeling, which includes advection through the bed. These models are being connected with the MOOSE (Multiphysics Object-Oriented Simulation Environment) software developed at the Idaho National Laboratory through DGOSPREY (Discontinuous Galerkin Off-gas SeParation and REcoverY) computer codes developed in this project. Experiments for iodine and water adsorption have been conducted on reduced silver mordenite (Ag0Z) for single layered particles. Adsorption apparatuses have been constructed to execute these experiments over a useful range of conditions for temperatures ranging from ambient to 250°C and water dew points ranging from -69 to 19°C. Experimental results were analyzed to determine mass transfer and diffusion of these gases into the particles and to determine which models best describe the single and binary component mass transfer and diffusion processes. The experimental results were also used to demonstrate the capabilities of the comprehensive models developed to predict single-particle adsorption and transients of the adsorption-desorption processes in fixed beds. Models for adsorption and mass transfer have been developed to mathematically describe adsorption kinetics and transport via diffusion and advection

  10. Sorption of tylosin on clay minerals.

    PubMed

    Zhang, Qian; Yang, Chen; Huang, Weilin; Dang, Zhi; Shu, Xiaohua

    2013-11-01

    The equilibrium sorption of tylosin (TYL) on kaolinite and montmorillonite was measured at different solution pH using batch reactor systems. The results showed that all the sorption isotherms were nonlinear and that the nonlinearity decreased as the solution pH increased for a given clay. At a specific aqueous concentration, the single-point sorption distribution coefficient (KD) of TYL decreased rapidly as the solution pH increased. A speciation-dependent sorption model that accounted for the contributions of the cationic and neutral forms of TYL fit the data well, suggesting that the sorption may be dominated by both ion exchange and hydrophobic interactions. The isotherm data also fit well to a dual mode model that quantifies the contributions of a site-limiting Langmuir component (ion exchange) and a non-specific linear partitioning component (hydrophobic interactions). X-ray diffraction analyses revealed that the interlayers of montmorillonite were expanded due to the uptake of TYL. TYL molecules likely form a monolayer surface coverage.

  11. Sorption of small molecules in polymeric media

    NASA Astrophysics Data System (ADS)

    Camboni, Federico; Sokolov, Igor M.

    2016-12-01

    We discuss the sorption of penetrant molecules from the gas phase by a polymeric medium within a model which is very close in spirit to the dual sorption mode model: the penetrant molecules are partly dissolved within the polymeric matrix, partly fill the preexisting voids. The only difference with the initial dual sorption mode situation is the assumption that the two populations of molecules are in equilibrium with each other. Applying basic thermodynamics principles we obtain the dependence of the penetrant concentration on the pressure in the gas phase and find that this is expressed via the Lambert W-function, a different functional form than the one proposed by dual sorption mode model. The Lambert-like isotherms appear universally at low and moderate pressures and originate from the assumption that the internal energy in a polymer-penetrant-void ternary mixture is (in the lowest order) a bilinear form in the concentrations of the three components. Fitting the existing data shows that in the domain of parameters where the dual sorption mode model is typically applied, the Lambert function, which describes the same behavior as the one proposed by the gas-polymer matrix model, fits the data equally well.

  12. Sorption of parabens by flexible tubings.

    PubMed

    Bahal, S M; Romansky, J M

    2001-08-01

    Flexible tubings are extensively used in pharmaceuticals, food industry, and in hospitals. This study was undertaken to compare various flexible tubings to determine their sorption characteristics, using methyl and propyl parabens. After 24 h, some tubings showed 100% sorption of propylparaben and over 40% for methylparaben. Significant losses were observed within a few hours using several tubings. For methylparaben, the losses were in the following decreasing order of sorption: Tygon, Clearflo, silicone, Nylotube, and Newtex. For propylparaben, the losses were in the following order: Tygon, Clearflo, silicone, Newtex, and Nylotube. Teflon, Zelite, and Vitube showed little to no losses of methyl and propylparaben over 120 h of study. The silicone tubing, refilled after 120 h with fresh methylparaben or propylparaben solutions, again showed significant losses within a few hours. The tubings show slow desorption when filled with the buffer vehicle. For Silastic tubing, increase in temperature from 25 to 40 degrees C, increase in pH from 3.5 to 6.5, tubing lot to lot variation, or curing with peroxide or platinum had little or no effect on paraben sorption. As expected, the sorption of parabens increased with increasing surface area of Silastic tubing. Results provided can be used to select the best tubings and to minimize paraben losses during production and filling of liquid pharmaceuticals andfood products containing these antimicrobial preservatives.

  13. Comparative study of particle structure evolution during water sorption: skim and whole milk powders.

    PubMed

    Murrieta-Pazos, I; Gaiani, C; Galet, L; Cuq, B; Desobry, S; Scher, J

    2011-10-01

    Surface composition of dairy powders influences significantly a quantity of functional properties such as rehydration, caking, agglomeration. Nevertheless, the kinetic of water uptake by the powders was never directly related to the structure and the composition of the surface. In this work, the effect of relative humidity on the structural reorganization of two types of dairy powder was studied. The water-powder interaction for industrial whole milk powder, and skim milk powder was studied using dynamic vapor sorption. The water sorption isotherms were fitted with a Brunner-Emmet-Teller model and each stage of the sorption curve was analyzed with a Fickian diffusion. The water content in the monolayer predicted for each powder and the moisture diffusivity calculated were discussed and compared. Concurrently, powders microstructure and powders surface under variable relative humidity were assessed by X-ray photoelectron spectroscopy, scanning electron microscopy coupled with energy dispersive X-ray and atomic force microscopy. A correlation between the data obtained from the sorption isotherms and the modifications of structure allowed us to conclude that powder microstructure and chemical state of the components could play an important role in determining the water diffusivity.

  14. One-dimensional advection diffusion modeling of upwelled hyporheic stream temperature along Deer Creek, Vina, California

    NASA Astrophysics Data System (ADS)

    Butler, N. L.; Hunt, J. R.; Tompkins, M. R.

    2011-12-01

    Hyporheic exchange can locally mitigate thermal stress caused by high water temperatures by upwelling water cooler than ambient stream temperatures and thus providing thermal refuge for critical cold water organisms like salmonids. Ten hyporheic exchange locations were identified by dye tracer experiments along a 16 km stretch of Deer Creek near Vina, California. Four months of continuous temperature measurements were made in the late summer of 2005 at each downwelling and upwelling location and revealed upwelled temperatures that were lagged in time and damped in amplitude. Upwelling hyporheic temperatures that could provide thermal refuge were observed in seven of the ten temperature records. This data was modeled by an analytical one-dimensional advection-diffusion equation solution using subsurface water velocity and the hydrodynamic dispersivity fitting parameters. At each location variations in upwelling temperature are explained by changing subsurface water velocities and flow pathways. The lag time in hyporheic heat flow ranged from a few hours to 44 hours over distances of 15 to 76 meters. The daily stream temperature variation was on the order of 10°C, which was reduced to 1 to 8°C in the upwelling hyporheic flow. At four locations, there was evidence that changes in stream flow produced changes in the amplitude and phase of the upwelling hyporheic water temperature by altering both the subsurface water velocity and hydrodynamic dispersivity. At two locations, additional cold water refuge was created by decreases in surface water flow because it reduced the estimated subsurface water velocity increasing the lag time between the peak surface water and subsurface water temperatures. Increases in surface water flow increased the dispersivity at three locations providing more cold water refuge by reducing the amplitude of the upwelling hyporheic temperature. Such changes alter thermal refuge for salmonids placing a new emphasis on managing surface water

  15. Characterization of sorption mechanisms of VOCs with organobentonites using a LSER approach.

    PubMed

    Tian, Senlin; Zhu, Lizhong; Shi, Yao

    2004-01-15

    To fully utilize the sorption traits of organobentonites to control volatile organic compounds (VOCs) pollution, the sorption mechanisms of VOCs with organobentonites need to be understood adequately. The sorption of VOCs as vapors to a typical organobentonite, modified with cetyltrimethylammonium bromide (CTMAB-bentonite), was characterized using a linear solvation energy relationship (LSER) of the type log Kc = c + rR2 + s pi2H + a sigma(alpha2)H + b sigma(beta2)H + l log L16. The fitted LSER equation, log Kc = 0.434 + 0.968R2 - 0.0886pi2H + 2.170sigma(alpha2)H + 1.611sigma(beta2)H + 0.417 log L16, was obtained by a multiple regression of the partition coefficients of 22 probe solutes against the solvation parameters of the solutes. The coefficients of the LSER equation show that CTMAB-bentonite is a sorbent with nonsignificant dipolarity/polarizability, interacts with solutes partly through pi-/n-electron pairs, behaves both as hydrogen-bond donor and hydrogen-bond acceptor, and can interact with solutes by cavity/dispersion interactions. The related terms in LSER suggest that the potential factors governing the sorption of VOCs onto CTMAB-bentonite are dispersion interactions, hydrogen-bond acidity interactions, hydrogen-bond basicity interactions, and pi-/n-electron interactions. The dispersion interaction is recognized to be the predominant parameter for most solutes, whereas the contributions of the other parameters depend on specific solutes. The derived LSER equation successfully predicted the VOC partition coefficients and the selectivity of CTMAB-bentonite for the VOCs. The relationship between LSER and adsorption/partition model was compared. The classification of sorption mechanisms by LSER goes on the molecular interaction types between sorbate and sorbent, and classification by adsorption/partition model goes on the property difference among various components of sorbent. The LSER approach coupled with inverse gas chromatography (IGC) is a

  16. Effects of sorption competition on caesium diffusion through compacted argillaceous rock

    NASA Astrophysics Data System (ADS)

    Jakob, Andreas; Pfingsten, Wilfried; Van Loon, Luc

    2009-05-01

    We carried out a small-scale laboratory diffusion experiment on a disk-like sample of Opalinus clay from the Mont Terri underground laboratory (Switzerland) using 134Cs as tracer. A through-diffusion phase was followed by an out-diffusion phase where the tracer taken up by the sample was released again. Since the tracer concentration at both boundaries was monitored, careful mass-balance considerations were feasible. A first analysis of the experimental data was done in the frame of a single-species model accounting only for transport and non-linear sorption of caesium. The model could match the data of the through-diffusion phase, however only, when strongly reducing the sorption data based on batch sorption experiments. Yet, such a procedure was in strong contradiction with sorption measurements performed on dispersed and compacted systems. In addition, predictions concerning tracer out-diffusion and mass-balance considerations clearly revealed the shortcomings of this type of model. In a second attempt we applied a multi-species transport model where now the whole water chemistry and a sorption model for caesium were considered. First, the value for the diffusion coefficient was fixed to the best-fit value of the single-species model. But again, the sorption site densities had to be reduced strongly albeit the reduction factor was smaller. Only when fixing the sorption site densities to those values of the sorption model and letting the effective diffusion coefficient D e free for the adjustment, could through-diffusion data be reasonably well fitted and out-diffusion as well as mass-balances be predicted in a satisfying manner. The main results are: (1) The best-fit could be achieved with a value for D e of 1.8 × 10 -10 m 2 s -1 which is rather high but corroborated by results of a molecular modelling study. (2) If caesium arrives in the Opalinus clay sample potassium and sodium (calcium etc.) ions are released and caesium ions are sorbed. The released cations

  17. Impact of kerogen heterogeneity on sorption of organic pollutants. 2. Sorption equilibria

    SciTech Connect

    Yang, C.; Yu, Z.Q.; Xiao, B.H.; Huang, W.L.; Fu, J.M.; Dang, Z.

    2009-08-15

    Phenanthrene and naphthalene sorption isotherms were measured for three different series of kerogen materials using completely mixed batch reactors. Sorption isotherms were nonlinear for each sorbate-sorbent system, and the Freundlich isotherm equation fit the sorption data well. The Freundlich isotherm linearity parameter n ranged from 0.192 to 0.729 for phenanthrene and from 0.389 to 0.731 for naphthalene. The n values correlated linearly with rigidity and aromaticity of the kerogen matrix, but the single-point, organic carbon-normalized distribution coefficients varied dramatically among the tested sorbents. A dual-mode sorption equation consisting of a linear partitioning domain and a Langmuir adsorption domain adequately quantified the overall sorption equilibrium for each sorbent-sorbate system. Both models fit the data well, with r{sup 2} values of 0.965 to 0.996 for the Freundlich model and 0.963 to 0.997 for the dual-mode model for the phenanthrene sorption isotherms. The dual-mode model fitting results showed that as the rigidity and aromaticity of the kerogen matrix increased, the contribution of the linear partitioning domain to the overall sorption equilibrium decreased, whereas the contribution of the Langmuir adsorption domain increased. The present study suggested that kerogen materials found in soils and sediments should not be treated as a single, unified, carbonaceous sorbent phase.

  18. Sorption of sodium dodecylbenzene sulfonate by montmorillonite.

    PubMed

    Yang, Kun; Zhu, Lizhong; Xing, Baoshan

    2007-01-01

    Sorption of linear alkylbenzene sulfonates by soils and sediments is an important process that may affect their fate, transport, toxicity and their application in remediation of contaminated soil and groundwater. In this study, batch experiments were conducted to elucidate the sorption of a widely used anionic surfactant, sodium dodecylbenzene sulfonate (SDBS), by montmorillonite. It was observed that: (i) SDBS was sorbed significantly by montmorillonite saturated with Ca(2+), but little by Na-saturated montmorillonite; (ii) the amount of SDBS sorbed by Ca(2+)-montmorillonite was enhanced by NaCl; and (iii) no significant intercalation of SDBS into Ca(2+)-montmorillonite was observed by X-ray diffraction (XRD) analysis. These results indicate that the removal of SDBS by Ca(2+)-montmorillonite was primarily attributed to the precipitation between DBS(-) and Ca(2+) in solution which was released from montmorillonite via cation exchange. These results will help us to understand the sorption behavior and environmental effects of anionic surfactants.

  19. Effect of gaseous ammonia on nicotine sorption

    SciTech Connect

    Webb, A.M.; Singer, B.C.; Nazaroff, W.W.

    2002-06-01

    Nicotine is a major constituent of environmental tobacco smoke. Sorptive interactions of nicotine with indoor surfaces can substantially alter indoor concentrations. The phenomenon is poorly understood, including whether sorption is fully reversible or partially irreversible. They hypothesize that acid-base chemistry on indoor surfaces might contribute to the apparent irreversibility of nicotine sorption under some circumstances. Specifically, they suggest that nicotine may become protonated on surfaces, markedly reducing its vapor pressure. If so, subsequent exposure of the surface to gaseous ammonia, a common base, could raise the surface pH, causing deprotonation and desorption of nicotine from surfaces. A series of experiments was conducted to explore the effect of ammonia on nicotine sorption to and reemission from surfaces. The results indicate that, under some conditions, exposure to gaseous ammonia can substantially increase the rate of desorption of previously sorbed nicotine from common indoor surface materials.

  20. Radioiodide sorption to sediment minerals

    SciTech Connect

    Kaplan, D.I.; Serne, R.J.; Parker, K.E.; Kutnyakov, I.V.

    1999-07-01

    Laboratory studies were conducted to quantify and understand the processes by which iodide (I{sup {minus}}) sorbs to minerals found in subsurface arid sediments. Little or no I{sup {minus}} sorbed to montmorillonite (K{sub d} = {minus}0.42 {+-} 0.08 mL/g), quartz (K{sub d} = 0.04 {+-} 0.02 mL/g), vermiculite (K{sub d} = 0.56 {+-} 0.21 mL/g), calcite (K{sub d} = 0.04 {+-} 0.01 mL/g), goethite (K{sub d} = 0.10 {+-} 0.03 mL/g), or chlorite (K{sub d} = {minus}0.22 {+-} 0.06 mL/g). A significant amount of I{sup {minus}} sorbed to illite (K{sub d} = 15.14 {+-} 2.84 mL/g). Upon treating the iodide-laden illite with dissolved F{sup {minus}}, Cl{sup {minus}}, Br{sup {minus}}, or {sup 127}I{sup {minus}}, desorption (or isotopic exchange in the case of {sup 127}I) removed, respectively, 43 {+-} 3%, 45 {+-} 0%, 52 {+-} 3, and 83 {+-} 1% of the I{sup {minus}} originally adsorbed to the illite. The fact that such large amounts of I{sup {minus}} could be desorbed suggests that the I{sup {minus}} was weakly adsorbed, and not chemically bonded to a soft metal, such as mercury or silver, that may have existed in the illite structure as trace impurities. Finally, I{sup {minus}} sorption to illite was strongly pH-dependent; the K{sub d} values decreased from 46 to 22 mL/g as the pH values increased from 3.6 to 9.4. Importantly, I{sup {minus}} sorbed to illite even under alkaline conditions. Together, these experiments suggest that illite removed I{sup {minus}} from the aqueous phase predominantly by reversible physical adsorption to the pH-dependent edge sites. Illites may constitute a substantial proportion of the clay-size fraction of many arid sediments and therefore may play an important role in retarding I{sup {minus}} movement in these sediments.

  1. Sorption cryogenic refrigeration - Status and future

    NASA Technical Reports Server (NTRS)

    Jones, Jack A.

    1988-01-01

    The operation principles of sorption cryogenic refrigeration are discussed. Sorption refrigerators have virtually no wear-related moving parts, have negligible vibration, and offer extremely long life (at least ten years), making it possible to obtain efficient, long life and low vibration cooling to as low as 7 K for cryogenic sensors. The physisorption and chemisorption systems recommended for various cooling ranges down to 7 K are described in detail. For long-life cooling at 4-5 K temperatures, a hybrid chemisorption-mechanical refrigeration system is recommended.

  2. Sorption of asymmetric dimethylhydrazine vapor by peaty soil

    SciTech Connect

    Zaitseva, T.B.; Laskin, B.M.; Shistko, N.R.; Pimkin, V.G.

    1994-03-10

    Sorption of asymmetric dimethylhydrazine vapor by peaty soil was investigated. Sorption isotherms were measured by a dynamic method at 32-50{degrees}C. The type of sorption of the compound with the soil surface was determined from the calculated enthalpies of sorption. The ability of asymmetric dimethylhydrazine to migrate from the soil to other objects of the environment and to be removed from the soil by thermosorption was evaluated.

  3. Modeling velocity in gradient flows with coupled-map lattices with advection.

    PubMed

    Lind, Pedro G; Corte-Real, João; Gallas, Jason A C

    2002-07-01

    We introduce a simple model to investigate large scale behavior of gradient flows based on a lattice of coupled maps which, in addition to the usual diffusive term, incorporates advection, as an asymmetry in the coupling between nearest neighbors. This diffusive-advective model predicts traveling patterns to have velocities obeying the same scaling as wind velocities in the atmosphere, regarding the advective parameter as a sort of geostrophic wind. In addition, the velocity and wavelength of traveling wave solutions are studied. In general, due to the presence of advection, two regimes are identified: for strong diffusion the velocity varies linearly with advection, while for weak diffusion a power law is found with a characteristic exponent proportional to the diffusion.

  4. Hydration and sorption characteristics of a polyfunctional weak-base anion exchanger after the sorption of vanillin and ethylvanillin

    NASA Astrophysics Data System (ADS)

    Rodionova, D. O.; Voronyuk, I. V.; Eliseeva, T. V.

    2016-07-01

    Features of the sorption of substituted aromatic aldehydes by a weak-base anion exchanger under equilibrium conditions are investigated using vanillin and ethylvanillin as examples. Analysis of the sorption isotherms of carbonyl compounds at different temperatures allows us to calculate the equilibrium characteristics of their sorption and assess the entropy and enthalpy contributions to the energy of the process. Hydration characteristics of the macroporous weak-base anion exchanger before and after the sorption of aromatic aldehydes are compared.

  5. Advective hydrogel membrane chromatography for monoclonal antibody purification in bioprocessing.

    PubMed

    Hou, Ying; Brower, Mark; Pollard, David; Kanani, Dharmesh; Jacquemart, Renaud; Kachuik, Bradley; Stout, James

    2015-01-01

    Protein A chromatography is widely employed for the capture and purification of monoclonal antibodies (mAbs). Because of the high cost of protein A resins, there is a significant economic driving force to seek new downstream processing strategies. Membrane chromatography has emerged as a promising alternative to conventional resin based column chromatography. However, to date, the application has been limited to mostly ion exchange flow through (FT) mode. Recently, significant advances in Natrix hydrogel membrane has resulted in increased dynamic binding capacities for proteins, which makes membrane chromatography much more attractive for bind/elute operations. The dominantly advective mass transport property of the hydrogel membrane has also enabled Natrix membrane to be run at faster volumetric flow rates with high dynamic binding capacities. In this work, the potential of using Natrix weak cation exchange membrane as a mAb capture step is assessed. A series of cycle studies was also performed in the pilot scale device (> 30 cycles) with good reproducibility in terms of yield and product purities, suggesting potential for improved manufacturing flexibility and productivity. In addition, anion exchange (AEX) hydrogel membranes were also evaluated with multiple mAb programs in FT mode. Significantly higher binding capacity for impurities (support mAb loads up to 10Kg/L) and 40X faster processing speed were observed compared with traditional AEX column chromatography. A proposed protein A free mAb purification process platform could meet the demand of a downstream purification process with high purity, yield, and throughput.

  6. MAST solution of advection problems in irrotational flow fields

    NASA Astrophysics Data System (ADS)

    Aricò, Costanza; Tucciarelli, Tullio

    2007-03-01

    A new numerical-analytical Eulerian procedure is proposed for the solution of convection-dominated problems in the case of existing scalar potential of the flow field. The methodology is based on the conservation inside each computational elements of the 0th and 1st order effective spatial moments of the advected variable. This leads to a set of small ODE systems solved sequentially, one element after the other over all the computational domain, according to a MArching in Space and Time technique. The proposed procedure shows the following advantages: (1) it guarantees the local and global mass balance; (2) it is unconditionally stable with respect to the Courant number, (3) the solution in each cell needs information only from the upstream cells and does not require wider and wider stencils as in most of the recently proposed higher-order methods; (4) it provides a monotone solution. Several 1D and 2D numerical test have been performed and results have been compared with analytical solutions, as well as with results provided by other recent numerical methods.

  7. Jet-dominated advective systems of all mass scales

    NASA Astrophysics Data System (ADS)

    Körding, Elmar; Fender, R.

    We show that the radio emission of black hole (BH) and neutron star (NS) X-ray binaries (XRBs) follows the analytical prediction of a jet model where the jet carries a constant fraction of the accretion power. The radio emission can therefore be used as a tracer of the accretion rate. This measure is normalised with efficiently radiating objects. As it is independent of the X-ray fluxes, the measure allows us to compare the accretion rate dependency of the bolometric X-ray lumi- nosity of BHs and NSs. For NSs, it scales linearly with accretion rate while the scaling for BHs is quadratic - as expected for inefficient accretion flows. We find the same behaviour in AGN. This new approach uses the jet power to obtain the accretion rate. Thus, we know both the jet power and the radiated power of an accreting BH. This allows us to show that some accretion power is likely to be advected into the black hole, while the jet power dominates over the bolometric luminosity of a hard state BH.

  8. Sea breezes and advective effects in southwest James Bay

    NASA Technical Reports Server (NTRS)

    Mckendry, Ian; Roulet, Nigel

    1994-01-01

    Observations from a transect extending 100 km inland during the Northern Wetlands Study (NOWES) in 1990 show that the sea breeze develops on approximately 25% of days during summer and may penetrate up to 100 km inland on occasions. The sea breeze exhibits a marked diurnal clockwise rotation as a result of the Coriolis effect along the unobstructed coastline. The marine advective effect is shown to depend on gradient wind direction. With northwesterly upper level flow the sea breeze tends to be northeasterly in direction and is associated with decreased temperatures and vapor pressure deficits (VPD). With southwesterly upper level flow the sea breeze tends to have a southeasterly direction and less effect on temperatures and VPD. This is attributed to shorter residence times of air parcels over water. For two cases, Colorado State University mesoscale model simulations show good agreement with surface wind observations and suggest that under northwesterly gradient flow, Bowen ratios are increased in the onshore flow along western James Bay, while during southwesterly gradient flow these effects are negligible. These results have implications for the interpretation of local climate, ecology, and hydrology as well as land-based and airborne turbulent flux measurements made during NOWES.

  9. Time Acceleration Methods for Advection on the Cubed Sphere

    SciTech Connect

    Archibald, Richard K; Evans, Katherine J; White III, James B; Drake, John B

    2009-01-01

    Climate simulation will not grow to the ultrascale without new algorithms to overcome the scalability barriers blocking existing implementations. Until recently, climate simulations concentrated on the question of whether the climate is changing. The emphasis is now shifting to impact assessments, mitigation and adaptation strategies, and regional details. Such studies will require significant increases in spatial resolution and model complexity while maintaining adequate throughput. The barrier to progress is the resulting decrease in time step without increasing single-thread performance. In this paper we demonstrate how to overcome this time barrier for the first standard test defined for the shallow-water equations on a sphere. This paper explains how combining a multiwavelet discontinuous Galerkin method with exact linear part time-evolution schemes can overcome the time barrier for advection equations on a sphere. The discontinuous Galerkin method is a high-order method that is conservative, flexible, and scalable. The addition of multiwavelets to discontinuous Galerkin provides a hierarchical scale structure that can be exploited to improve computational efficiency in both the spatial and temporal dimensions. Exact linear part time-evolution schemes are explicit schemes that remain stable for implicit-size time steps.

  10. Authalic parameterization of general surfaces using Lie advection.

    PubMed

    Zou, Guangyu; Hu, Jiaxi; Gu, Xianfeng; Hua, Jing

    2011-12-01

    Parameterization of complex surfaces constitutes a major means of visualizing highly convoluted geometric structures as well as other properties associated with the surface. It also enables users with the ability to navigate, orient, and focus on regions of interest within a global view and overcome the occlusions to inner concavities. In this paper, we propose a novel area-preserving surface parameterization method which is rigorous in theory, moderate in computation, yet easily extendable to surfaces of non-disc and closed-boundary topologies. Starting from the distortion induced by an initial parameterization, an area restoring diffeomorphic flow is constructed as a Lie advection of differential 2-forms along the manifold, which yields equality of the area elements between the domain and the original surface at its final state. Existence and uniqueness of result are assured through an analytical derivation. Based upon a triangulated surface representation, we also present an efficient algorithm in line with discrete differential modeling. As an exemplar application, the utilization of this method for the effective visualization of brain cortical imaging modalities is presented. Compared with conformal methods, our method can reveal more subtle surface patterns in a quantitative manner. It, therefore, provides a competitive alternative to the existing parameterization techniques for better surface-based analysis in various scenarios.

  11. Non-equilibrium and equilibrium sorption with a linear-sorption isotherm during mass transport through an infinite, porous medium: some analytical solutions

    SciTech Connect

    Carnahan, C.L.; Remer, J.S.

    1981-04-01

    Analytical solutions have been developed for the problem of solute transport in a steady, three dimensional field of groundwater flow with non-equilibrium mass transfer of a radioactive species between fluid and solid phases and with anisotropic hydrodynamic dispersion. Interphase mass transport is described by a linear rate expression. Solutions are presented also for the case of equilibrium distribution of solute between fluid and solid phases. Three types of release from a point source were considered: instantaneous release of a finite mass of solute, continuous release at an exponentially decaying rate, and release for a finite period of time. Graphical displays of computational results for point-source solutions show the expected variation of sorptive retardation effects progressing from the case of no sorption, through several cases of non-equilibrium sorption, to the case of equilibrium sorption. The point-source solutions can be integrated over finite regions of a space to provide analytical solutions for regions of solute release having finite spatial extents and various geometrical shapes, thus considerably extending the utility of the point-source solutions.

  12. Enhanced PCBs sorption on biochars as affected by environmental factors: Humic acid and metal cations.

    PubMed

    Wang, Yu; Wang, Lei; Fang, Guodong; Herath, H M S K; Wang, Yujun; Cang, Long; Xie, Zubin; Zhou, Dongmei

    2013-01-01

    Biochar plays an important role in the behaviors of organic pollutants in the soil environment. The role of humic acid (HA) and metal cations on the adsorption affinity of polychlorinated biphenyls (PCBs) to the biochars in an aqueous medium and an extracted solution from a PCBs-contaminated soil was studied using batch experiments. Biochars were produced with pine needles and wheat straw at 350 °C and 550 °C under anaerobic condition. The results showed that the biochars had high adsorption affinity for PCBs. Pine needle chars adsorbed less nonplanar PCBs than planar ones due to dispersive interactions and separation. Coexistence of HA and metal cations increased PCBs sorption on the biochars accounted for HA adsorption and cation complexation. The results will aid in a better understanding of biochar sorption mechanism of contaminants in the environment.

  13. Sorption of Cu(II) Ions on Chitosan-Zeolite X Composites: Impact of Gelling and Drying Conditions.

    PubMed

    Djelad, Amal; Morsli, Amine; Robitzer, Mike; Bengueddach, Abdelkader; di Renzo, Francesco; Quignard, Françoise

    2016-01-19

    Chitosan-zeolite Na-X composite beads with open porosity and different zeolite contents were prepared by an encapsulation method. Preparation conditions had to be optimised in order to stabilize the zeolite network during the polysaccharide gelling process. Composites and pure reference components were characterized using X-ray diffraction (XRD); scanning electron microscopy (SEM); N₂ adsorption-desorption; and thermogravimetric analysis (TG). Cu(II) sorption was investigated at pH 6. The choice of drying method used for the storage of the adsorbent severely affects the textural properties of the composite and the copper sorption effectiveness. The copper sorption capacity of chitosan hydrogel is about 190 mg·g(-1). More than 70% of this capacity is retained when the polysaccharide is stored as an aerogel after supercrititcal CO₂ drying, but nearly 90% of the capacity is lost after evaporative drying to a xerogel. Textural data and Cu(II) sorption data indicate that the properties of the zeolite-polysaccharide composites are not just the sum of the properties of the individual components. Whereas a chitosan coating impairs the accessibility of the microporosity of the zeolite; the presence of the zeolite improves the stability of the dispersion of chitosan upon supercritical drying and increases the affinity of the composites for Cu(II) cations. Chitosan-zeolite aerogels present Cu(II) sorption properties.

  14. Porous nano-cerium oxide wood chip biochar composites for aqueous levofloxacin removal and sorption mechanism insights.

    PubMed

    Yi, Shengze; Sun, Yuanyuan; Hu, Xin; Xu, Hongxia; Gao, Bin; Wu, Jichun

    2017-01-14

    The adsorption removal of levofloxacin (LEV), a widely used fluoroquinolone antibiotic, by using the biochars derived from the pyrolysis of pine wood chip pretreated with cerium trichloride was investigated through batch sorption experiments and multiple characterization techniques. The differences in the basic physicochemical properties between Ce-impregnated biochars and the pristine biochars were confirmed by the analysis of elemental compositions, specific surface areas, energy dispersive spectrometry, X-ray diffraction, and thermo-gravimetry. FT-IR spectra of the pre- and post-sorption biochars confirmed the chemical adsorption for LEV sorption onto the biochars. Large shifts in the binding energy of Ce3d, O1s, C1s, and N1s regions on the pre- and post-sorption biochars indicated the surface complexation of LEV molecule onto the biochars. The binding species of Ce(4+) and Ce(3+) identified by X-ray photoelectron spectroscopy reflect the role of Ce oxides during sorption. Batch adsorption showed the significant enhancement of adsorption capacity for LEV after the Ce modification. Batch adsorption kinetic data fitted well with the pseudo-second-order model. Both the Langmuir and the Freundlich models reproduced the isotherm data well. Findings from this work indicated that Ce-impregnated biochars can be effective for the removal of aqueous LEV.

  15. Sorption of polyphenolics (tannins) to natural soils

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Tannins enter soil systems via rainfall through the leaf canopy, leaf litter decomposition, and root exudation and decomposition. For tannins released into soils, the relative importance of sorption to soil; chemical reactions with soil minerals; and biological decomposition is unknown. Determinin...

  16. Sorption and desorption studies on chitin gels.

    PubMed

    Vachoud, L; Zydowicz, N; Domard, A

    2001-01-10

    The aim of this work was to study various transport phenomena in chitin gels obtained by N-acetylation of chitosan in a water-alcohol mixture. Three kinds of transport were investigated: the sorption of solutes interacting with chitin, the desorption of solutes without significant interaction with the polymer, and osmosis phenomena. In the case of interactive sorption, dyes having different chemical structures such as C.I. Acid Blue 74, C.I. Reactive Violet 5 or C.I. Direct Red 28 were tested. Sorptions of C.I. Acid Blue 74 and C.I. Reactive Violet 5 depend on the charge density of the polymer network and, as a consequence, on DA, pH and the dielectric constant of the media. This result reveals the importance of electrostatic interactions. On the other hand, the sorption of C.I. Direct Red 28 is mainly due to hydrophobic interactions and H-bonding, it is limited to the extreme surface of the gel. Concerning the non-interactive desorption, solutes of different steric hindrance such as PP vitamin, B1 vitamin and caffeine exhibit similar diffusion coefficients located within 3.7-5.6x10(-6) cm(2) s(-1). Finally, the osmotic behaviour of the gel immersed in a concentrated solution of gelatin allows us to multiply by 25 the concentration of chitin in the gel without any penetration of gelatin.

  17. Microporous Carbon Disks For Sorption Refrigerators

    NASA Technical Reports Server (NTRS)

    Munukutla, Lakshmi V.; Moore, Mark R.

    1993-01-01

    Slow, carefully controlled pyrolysis found to turn polyvinylidene chloride disks into carbon disks having small pores and large surface areas. Disks exhibit high adsorptivities making them useful in krypton-sorption refrigerators. Carbons made from polyvinylidene chloride have greater adsorptive capacities. Thermal instability controlled and variability of product reduced by careful control of rates of heating, heating times, and rate of final cooling.

  18. Sorption of metals by Chlorobium spp.

    PubMed

    Garcia-Gil, J; Borrego, C

    1997-12-01

    The capacity of two species of green phototrophic sulfur bacteria, Chlorobium limicola and C. phaeobacteroides, to sorb several metal ions (Mn2+, Fe2+, Ni2+, Cu2+, Zn2+, Cd2+ and Pb2+) has been tested in laboratory batch cultures at increasing concentrations up to 2,000 mumol/l. Except for nickel--which was not sorbed to bacterial cells--the rest of metals tested were bound in a fast and passive process, which was mathematically described by means of Freundlich isotherms models. The sorption capacity of the two species studied were found to be dependent on the metal involved, whereas no differences were observed in the sorption intensity, suggesting that in all cases the sorption process proceeds in a similar way. Further, the comparison of the sorption intensity values as well as the metal recovery index (Ri), for both species, revealed that C. phaeobacteroides was more efficient that C. limicola to attach metal ions. The ecological significance of this ability in the water column of some stratified lakes, where coinciding maxima of ferrous iron and green photosynthetic sulfur bacteria are frequently found, is discussed.

  19. The Determination of Zeolite Sorption Properties

    NASA Astrophysics Data System (ADS)

    Tishin, A. A.; Laguntsov, N. I.; Kurchatov, I. M.

    The installation and the measurement data procedure were established for the sorbent characteristics determination. Sorption isotherms of the three gases (nitrogen, oxygen and carbon dioxide) are obtained on the industrial zeolites NaX, NaX-BKO and NaA in a pressure range (0;7) bar.

  20. Sorption studies of human keratinized tissues

    NASA Astrophysics Data System (ADS)

    Johnsen, G. K.; Martinsen, Ø. G.; Grimnes, Sverre

    2010-04-01

    Water content is known to be the most important single parameter for keratinized tissue to remain its vital functions. In that sense, a general knowledge of the water binding properties is of great interest, and a reliable measurement setup must be found. Also, revealing the sorption properties of human keratinized tissues is vital towards a calibration of susceptance based skin hydration measurements that already is an important diagnostic tool in clinical dermatology, and we will see that any hysteresis will complicate such a calibration further. In this study we investigated the sorption properties of keratinized tissues such as human epidermal stratum corneum (SC), hair and nail. The study was performed under controlled environmental conditions with a dynamic vapor sorption (DVS) instrument, and the water uptake of the keratinized test samples was measured as the relative humidity in the ambient air was altered step-wisely. In this study, vital and characteristic water sorption properties such as the isotherm, relative water uptake, and hysteresis were investigated and will be discussed.

  1. Modeling Fission Product Sorption in Graphite Structures

    SciTech Connect

    Szlufarska, Izabela; Morgan, Dane; Allen, Todd

    2013-04-08

    The goal of this project is to determine changes in adsorption and desorption of fission products to/from nuclear-grade graphite in response to a changing chemical environment. First, the project team will employ principle calculations and thermodynamic analysis to predict stability of fission products on graphite in the presence of structural defects commonly observed in very high- temperature reactor (VHTR) graphites. Desorption rates will be determined as a function of partial pressure of oxygen and iodine, relative humidity, and temperature. They will then carry out experimental characterization to determine the statistical distribution of structural features. This structural information will yield distributions of binding sites to be used as an input for a sorption model. Sorption isotherms calculated under this project will contribute to understanding of the physical bases of the source terms that are used in higher-level codes that model fission product transport and retention in graphite. The project will include the following tasks: Perform structural characterization of the VHTR graphite to determine crystallographic phases, defect structures and their distribution, volume fraction of coke, and amount of sp2 versus sp3 bonding. This information will be used as guidance for ab initio modeling and as input for sorptivity models; Perform ab initio calculations of binding energies to determine stability of fission products on the different sorption sites present in nuclear graphite microstructures. The project will use density functional theory (DFT) methods to calculate binding energies in vacuum and in oxidizing environments. The team will also calculate stability of iodine complexes with fission products on graphite sorption sites; Model graphite sorption isotherms to quantify concentration of fission products in graphite. The binding energies will be combined with a Langmuir isotherm statistical model to predict the sorbed concentration of fission

  2. Sorption of endrin to montmorillonite and kaolinite clays.

    PubMed

    Peng, Xianjia; Wang, Jun; Fan, Bin; Luan, Zhaokun

    2009-08-30

    It has been discovered previously that clay minerals may have a greater potential for sorption of pesticides. In this paper, the sorption of endrin, a nonionic persistent organochlorine pesticide, to montmorillonite and kaolinite was investigated. The effect of pH, ionic strength on the sorption was studied. The effect of intercalation of hydroxyl aluminium species on sorption of endrin to montmorillonite was also investigated. The results show that, the sorption isotherm of endrin to montmorillonite and kaolinite was linear. The sorption increases with the increase in ionic strength. pH has effect on the sorption and the sorption on both montmorillonite and kaolinite has obvious troughs at pH about 7.2 and 5.4, respectively. The intercalation of hydroxyl aluminium species decreases the sorption. Sorption mechanism of endrin to montmorillonite and kaolinite was suggested to be a combination of hydrophobic interaction and charge-dipole interaction and troughs in the effect of pH on sorption was attributed to the proton shift reaction of the broken bonds at the clay edges.

  3. Radionuclide sorption on drill core material from the Canadian Shield

    SciTech Connect

    Vandergraat, T.T.; Abry, D.R.

    1982-06-01

    The sorption of four radionuclides, /sup 90/Sr, /sup 137/Cs, /sup 144/Ce, and /sup 237/Pu, on drill core material from two rock formations in the Canadian Shield has been studied as part of the Canadian Nuclear Fuel Waste Management Program. For all four radionuclides, sorption increased with increased mafic mineral content of the rock. Autoradiographic investigations showed enhanced sorption on dark, or mafic, minerals and high sorption on chlorite infilling material in a closed fracture. Desorption was less complete than sorption after the same equilibration time, indicating a degree of irreversible sorption, or slower desorption kinetics. The effect of surface roughness (measured by mercury porosimetry) on sorption was not as great as that of the chemical and mineral composition of the rock.

  4. Dispersion Modeling.

    ERIC Educational Resources Information Center

    Budiansky, Stephen

    1980-01-01

    This article discusses the need for more accurate and complete input data and field verification of the various models of air pollutant dispension. Consideration should be given to changing the form of air quality standards based on enhanced dispersion modeling techniques. (Author/RE)

  5. Verification of Advective Bar Elements Implemented in the Aria Thermal Response Code.

    SciTech Connect

    Mills, Brantley

    2016-01-01

    A verification effort was undertaken to evaluate the implementation of the new advective bar capability in the Aria thermal response code. Several approaches to the verification process were taken : a mesh refinement study to demonstrate solution convergence in the fluid and the solid, visually examining the mapping of the advective bar element nodes to the surrounding surfaces, and a comparison of solutions produced using the advective bars for simple geometries with solutions from commercial CFD software . The mesh refinement study has shown solution convergence for simple pipe flow in both temperature and velocity . Guidelines were provided to achieve appropriate meshes between the advective bar elements and the surrounding volume. Simulations of pipe flow using advective bars elements in Aria have been compared to simulations using the commercial CFD software ANSYS Fluent (r) and provided comparable solutions in temperature and velocity supporting proper implementation of the new capability. Verification of Advective Bar Elements iv Acknowledgements A special thanks goes to Dean Dobranich for his guidance and expertise through all stages of this effort . His advice and feedback was instrumental to its completion. Thanks also goes to Sam Subia and Tolu Okusanya for helping to plan many of the verification activities performed in this document. Thank you to Sam, Justin Lamb and Victor Brunini for their assistance in resolving issues encountered with running the advective bar element model. Finally, thanks goes to Dean, Sam, and Adam Hetzler for reviewing the document and providing very valuable comments.

  6. An operator splitting algorithm for the three-dimensional advection-diffusion equation

    NASA Astrophysics Data System (ADS)

    Khan, Liaqat Ali; Liu, Philip L.-F.

    1998-09-01

    Operator splitting algorithms are frequently used for solving the advection-diffusion equation, especially to deal with advection dominated transport problems. In this paper an operator splitting algorithm for the three-dimensional advection-diffusion equation is presented. The algorithm represents a second-order-accurate adaptation of the Holly and Preissmann scheme for three-dimensional problems. The governing equation is split into an advection equation and a diffusion equation, and they are solved by a backward method of characteristics and a finite element method, respectively. The Hermite interpolation function is used for interpolation of concentration in the advection step. The spatial gradients of concentration in the Hermite interpolation are obtained by solving equations for concentration gradients in the advection step. To make the composite algorithm efficient, only three equations for first-order concentration derivatives are solved in the diffusion step of computation. The higher-order spatial concentration gradients, necessary to advance the solution in a computational cycle, are obtained by numerical differentiations based on the available information. The simulation characteristics and accuracy of the proposed algorithm are demonstrated by several advection dominated transport problems.

  7. STANDING SHOCK INSTABILITY IN ADVECTION-DOMINATED ACCRETION FLOWS

    SciTech Connect

    Le, Truong; Wood, Kent S.; Wolff, Michael T.; Becker, Peter A.; Putney, Joy

    2016-03-10

    Depending on the values of the energy and angular momentum per unit mass in the gas supplied at large radii, inviscid advection-dominated accretion flows can display velocity profiles with either preshock deceleration or preshock acceleration. Nakayama has shown that these two types of flow configurations are expected to have different stability properties. By employing the Chevalier and Imamura linearization method and the Nakayama instability boundary conditions, we discover that there are regions of parameter space where disks/shocks with outflows can be stable or unstable. In regions of instability, we find that preshock deceleration is always unstable to the zeroth mode with zero frequency of oscillation, but is always stable to the fundamental mode and overtones. Furthermore, we also find that preshock acceleration is always unstable to the zeroth mode and that the fundamental mode and overtones become increasingly less stable as the shock location moves away from the horizon when the disk half-height expands above ∼12 gravitational radii at the shock radius. In regions of stability, we demonstrate the zeroth mode to be stable for the velocity profiles that exhibit preshock acceleration and deceleration. Moreover, for models that are linearly unstable, our model suggests the possible existence of quasi-periodic oscillations (QPOs) with ratios 2:3 and 3:5. These ratios are believed to occur in stellar and supermassive black hole candidates, for example, in GRS 1915+105 and Sgr A*, respectively. We expect that similar QPO ratios also exist in regions of stable shocks.

  8. The distortion of the level set gradient under advection

    NASA Astrophysics Data System (ADS)

    Trujillo, Mario F.; Anumolu, Lakshman; Ryddner, Doug

    2017-04-01

    The practice of periodically reinitializing the level set function is well established in two-phase flow applications as a way of controlling the growth of anomalies and/or numerical errors. In the present work, the underlying roots of this anomalous growth are studied, where it is established that the augmentation of the magnitude of the level set gradient (| ∇ϕ |) is directly connected to the nature of the flow field; hence, it is not necessarily the result of some type of numerical error. More specifically, for a general flow field advecting the level set function, it is shown that the eigenpairs of the strain rate tensor are responsible for the rate of change of | ∇ϕ | along a fluid particle trajectory. This straining action not only affects the magnitude of | ∇ϕ |, but the general character of ϕ, and consequently contributes to the growth in numerical error. These numerical consequences are examined by adopting the Gradient Augmented Level Set method. Specifically, it is shown that the local error for ϕ is directly connected to the size of | ∇ϕ | and to the magnitude of the second and fourth order derivatives of ϕ. These analytical findings are subsequently supported by various examples. The role of reinitialization is discussed, where it is shown that in cases where the zero level set contour has a local radius of curvature that is below the local grid resolution, reinitialization exacerbates rather than diminishes the degree of error. For other cases, where the interface is well resolved, reinitialization helps stabilize the error as intended.

  9. Critical time scales for advection-diffusion-reaction processes

    NASA Astrophysics Data System (ADS)

    Ellery, Adam J.; Simpson, Matthew J.; McCue, Scott W.; Baker, Ruth E.

    2012-04-01

    The concept of local accumulation time (LAT) was introduced by Berezhkovskii and co-workers to give a finite measure of the time required for the transient solution of a reaction-diffusion equation to approach the steady-state solution [A. M. Berezhkovskii, C. Sample, and S. Y. Shvartsman, Biophys. J.BIOJAU0006-349510.1016/j.bpj.2010.07.045 99, L59 (2010); A. M. Berezhkovskii, C. Sample, and S. Y. Shvartsman, Phys. Rev. EPLEEE81539-375510.1103/PhysRevE.83.051906 83, 051906 (2011)]. Such a measure is referred to as a critical time. Here, we show that LAT is, in fact, identical to the concept of mean action time (MAT) that was first introduced by McNabb [A. McNabb and G. C. Wake, IMA J. Appl. Math.IJAMDM0272-496010.1093/imamat/47.2.193 47, 193 (1991)]. Although McNabb's initial argument was motivated by considering the mean particle lifetime (MPLT) for a linear death process, he applied the ideas to study diffusion. We extend the work of these authors by deriving expressions for the MAT for a general one-dimensional linear advection-diffusion-reaction problem. Using a combination of continuum and discrete approaches, we show that MAT and MPLT are equivalent for certain uniform-to-uniform transitions; these results provide a practical interpretation for MAT by directly linking the stochastic microscopic processes to a meaningful macroscopic time scale. We find that for more general transitions, the equivalence between MAT and MPLT does not hold. Unlike other critical time definitions, we show that it is possible to evaluate the MAT without solving the underlying partial differential equation (pde). This makes MAT a simple and attractive quantity for practical situations. Finally, our work explores the accuracy of certain approximations derived using MAT, showing that useful approximations for nonlinear kinetic processes can be obtained, again without treating the governing pde directly.

  10. The contiguous domains of Arctic Ocean advection: Trails of life and death

    NASA Astrophysics Data System (ADS)

    Wassmann, P.; Kosobokova, K. N.; Slagstad, D.; Drinkwater, K. F.; Hopcroft, R. R.; Moore, S. E.; Ellingsen, I.; Nelson, R. J.; Carmack, E.; Popova, E.; Berge, J.

    2015-12-01

    The central Arctic Ocean is not isolated, but tightly connected to the northern Pacific and Atlantic Oceans. Advection of nutrient-, detritus- and plankton-rich waters into the Arctic Ocean forms lengthy contiguous domains that connect subarctic with the arctic biota, supporting both primary production and higher trophic level consumers. In turn, the Arctic influences the physical, chemical and biological oceanography of adjacent subarctic waters through southward fluxes. However, exports of biomass out of the Arctic Ocean into both the Pacific and Atlantic Oceans are thought to be far smaller than the northward influx. Thus, Arctic Ocean ecosystems are net biomass beneficiaries through advection. The biotic impact of Atlantic- and Pacific-origin taxa in arctic waters depends on the total supply of allochthonously-produced biomass, their ability to survive as adults and their (unsuccessful) reproduction in the new environment. Thus, advective transport can be thought of as trails of life and death in the Arctic Ocean. Through direct and indirect (mammal stomachs, models) observations this overview presents information about the advection and fate of zooplankton in the Arctic Ocean, now and in the future. The main zooplankton organisms subjected to advection into and inside the Arctic Ocean are (a) oceanic expatriates of boreal Atlantic and Pacific origin, (b) oceanic Arctic residents and (c) neritic Arctic expatriates. As compared to the Pacific gateway the advective supply of zooplankton biomass through the Atlantic gateways is 2-3 times higher. Advection characterises how the main planktonic organisms interact along the contiguous domains and shows how the subarctic production regimes fuel life in the Arctic Ocean. The main differences in the advective regimes through the Pacific and Atlantic gateways are presented. The Arctic Ocean is, at least in some regions, a net heterotrophic ocean that - during the foreseeable global warming trend - will more and more rely

  11. Horizontal Advection and Mixing of Pollutants in the Urban Atmospheric Environment

    NASA Astrophysics Data System (ADS)

    Magnusson, S. P.; Entekhabi, D.; Britter, R.; Norford, L.; Fernando, H. J.

    2013-12-01

    Although urban air quality and its impacts on the public health have long been studied, the increasing urbanization is raising concerns on how to better control and mitigate these health impacts. A necessary element in predicting exposure levels is fundamental understanding of flow and dispersion in urban canyons. The complex topology of building structures and roads requires the resolution of turbulence phenomena within urban canyons. The use of dense and low porosity construction material can lead to rapid heating in response to direct solar exposure due to large thermal mass. Hence thermal and buoyancy effects may be as important as mechanically-forced or shear-induced flows. In this study, the transport of pollutants within the urban environment, as well as the thermal and advection effects, are investigated. The focus is on the horizontal transport or the advection effects within the urban environment. With increased urbanization and larger and more spread cities, concern about how the upstream air quality situation can affect downstream areas. The study also examines the release and the dispersion of hazardous material. Due to the variety and complexity of urban areas around the world, the urban environment is simplified into adjacent two-dimensional urban street canyons. Pollutants are released inside each canyon. Computational Fluid Dynamics (CFD) simulations are applied to evaluate and quantify the flow rate out of each canyon and also the exchange of pollutants between the canyons. Imagine a row of ten adjacent urban street canyons of aspect ratio 1 with horizontal flow perpendicular to it as shown in the attached figure. C is the concentration of pollutants. The first digit indicates in what canyon the pollutant is released and the second digit indicates the location of that pollutant. For example, C3,4 is the concentration of pollutant released inside canyon 3 measured in canyon 4. The same amount of pollution is released inside the ten street canyons

  12. A New Methodology For Estimating CO2 Advective Fluxes In Complex Terrain

    NASA Astrophysics Data System (ADS)

    Montagnani, L.; Manca, G.; Canepa, E.; Georgieva, E.; Kerschbaumer, G.; Minerbi, S.; Seufert, G.

    2007-12-01

    A key problem in using the eddy correlation (EC) technique for estimating the carbon dioxide Net Ecosystem Exchange (NEE) of terrestrial ecosystems is the potential bias caused by advective fluxes of CO2. Advective fluxes are often not considered since they are difficult to identify and to quantify, especially in complex mountainous terrain with highly variable wind patterns and drainage flows. We propose a methodology to estimate these fluxes based on a full 3-Dimensional (3D) approach applied to the topographically complex alpine forest site of Renon (1736 m a.s.l.). This is an aerodynamic method based on the computation of advective fluxes across the aerial faces of a control volume including the plant ecosystem. Data used for the computation of CO2 advective fluxes were collected during an extensive field campaign performed in 2005 in the framework of CarboEurope-IP research project. Vertical profiles of wind, air temperature and CO2 concentration have been measured at five towers and a spatial interpolation was performed in order to get 3D fields of such variables. The frame of reference used was orthogonal and the vertical direction was parallel to the gravity. Each anemometer was aligned in this frame of reference and no rotations were applied to the wind velocity components. The analysis of the 3D fields of wind velocity, CO2 mixing ratio and air density highlighted the spatial heterogeneity of CO2 source/sink strength and the strong de-coupling between air flow below and above the canopy during stable nights. The total CO2 advection calculated using the proposed methodology exhibited prevailing positive values during the night-time period. Advective fluxes estimated during windy nights were of the same magnitude and sign of vertical turbulent flux measured above canopy by the EC technique. This observation suggests that the friction velocity correction routinely applied to night-time periods may not be efficient at the Renon site. During light windy nights

  13. SEBAL-A: A remote sensing ET algorithm that accounts for advection with limited data. Part II: Test for transferability

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Because the Surface Energy Balance Algorithm for Land (SEBAL) tends to underestimate ET under conditions of advection, the model was modified by incorporating an advection component as part of the energy usable for crop evapotranspiration (ET). The modification involved the estimation of advected en...

  14. An approximate calculation of advective gas-phase transport of 14C at Yucca Mountain, Nevada

    NASA Astrophysics Data System (ADS)

    Knapp, R. B.

    1990-01-01

    A quasilinear partial differential equation, which describes gas-phase transport of a 14C kinematic wave through a porous medium, is derived, its sensitivity to system variables is analyzed and it is applied to one possible release scenarion at the porposed Yucca Mountain, Nevada high-level radioactive waste repository. Advection, isotope exchange between CO 2 in a flowing gas phase and HCO 3- in a static aqueous phase, and radioactive decay are incorporated. The governing equation is solved analytically by the method of characteristics. The mass fraction of 14C in the gas phase,X 14g, is controlled by radioactive decay. The relatively long half-line of 14C, about 5720 years, and the relatively shallow proposed burial depth of the radioactive waste, about 350m, requires significant retardation of the 14C wave velocity for significant reduction in X 14g. 14C wave velocity is most sensitive to temperature and pH which control the distribution of total carbon between gas and liquid phase; the greater the partitioning of carbon into the liquid phase, the greater the retardation of the 14C wave velocity and the greater the ultimate reduction in X 14g from initial conditions. Partitioning of total carbon into the liquid phase is greatest at low temperatures, < 100° C, and high pH values, > 8. Increasing water saturation also tends to retard 14C wave velocity but to a lesser extent. The governing equation has been applied using conditions that may possibly occur at the proposed Yucca Mountain repository. Calculations indicate that the 14C wave takes about 5900 years to reach the surface with a X 14g equal to 25 ppm. Diffusion and dispersion are not of major importance for these conditions. These calculations are approximate due to the number of assumptions involved. Discharge of 14C into the gas before the selected time would accelerate wave arrival and increase the amount of 14C reaching the surface.

  15. CHEMO-hydrodynamic coupling between forced advection in porous media and self-sustained chemical waves

    NASA Astrophysics Data System (ADS)

    Atis, S.; Saha, S.; Auradou, H.; Martin, J.; Rakotomalala, N.; Talon, L.; Salin, D.

    2012-09-01

    Autocatalytic reaction fronts between two reacting species in the absence of fluid flow, propagate as solitary waves. The coupling between autocatalytic reaction front and forced simple hydrodynamic flows leads to stationary fronts whose velocity and shape depend on the underlying flow field. We address the issue of the chemico-hydrodynamic coupling between forced advection in porous media and self-sustained chemical waves. Towards that purpose, we perform experiments over a wide range of flow velocities with the well characterized iodate arsenious acid and chlorite-tetrathionate autocatalytic reactions in transparent packed beads porous media. The characteristics of these porous media such as their porosity, tortuosity, and hydrodynamics dispersion are determined. In a pack of beads, the characteristic pore size and the velocity field correlation length are of the order of the bead size. In order to address these two length scales separately, we perform lattice Boltzmann numerical simulations in a stochastic porous medium, which takes into account the log-normal permeability distribution and the spatial correlation of the permeability field. In both experiments and numerical simulations, we observe stationary fronts propagating at a constant velocity with an almost constant front width. Experiments without flow in packed bead porous media with different bead sizes show that the front propagation depends on the tortuous nature of diffusion in the pore space. We observe microscopic effects when the pores are of the size of the chemical front width. We address both supportive co-current and adverse flows with respect to the direction of propagation of the chemical reaction. For supportive flows, experiments and simulations allow observation of two flow regimes. For adverse flow, we observe upstream and downstream front motion as well as static front behaviors over a wide range of flow rates. In order to understand better these observed static state fronts, flow

  16. CLUMPY ACCRETION ONTO BLACK HOLES. I. CLUMPY-ADVECTION-DOMINATED ACCRETION FLOW STRUCTURE AND RADIATION

    SciTech Connect

    Wang Jianmin; Cheng Cheng; Li Yanrong

    2012-04-01

    We investigate the dynamics of clumps embedded in and confined by the advection-dominated accretion flows (ADAFs), in which collisions among the clumps are neglected. We start from the collisionless Boltzmann equation and assume that interaction between the clumps and the ADAF is responsible for transporting the angular momentum of clumps outward. The inner edge of the clumpy-ADAF is set to be the tidal radius of the clumps. We consider strong- and weak-coupling cases, in which the averaged properties of clumps follow the ADAF dynamics and are mainly determined by the black hole potential, respectively. We propose the analytical solution of the dynamics of clumps for the two cases. The velocity dispersion of clumps is one magnitude higher than the ADAF for the strong-coupling case. For the weak-coupling case, we find that the mean radial velocity of clumps is linearly proportional to the coefficient of the drag force. We show that the tidally disrupted clumps would lead to an accumulation of the debris to form a debris disk in the Shakura-Sunyaev regime. The entire hot ADAF will be efficiently cooled down by photons from the debris disk, giving rise to a collapse of the ADAF, and quench the clumpy accretion. Subsequently, evaporation of the collapsed ADAF drives resuscitate of a new clumpy-ADAF, resulting in an oscillation of the global clumpy-ADAF. Applications of the present model are briefly discussed to X-ray binaries, low ionization nuclear emission regions, and BL Lac objects.

  17. Defluoridation by Bacteriogenic Iron Oxides: Sorption Studies

    NASA Astrophysics Data System (ADS)

    Evans, K.; Ferris, F.

    2009-05-01

    At concentrations above 1 mg/L, fluoride in drinking water can lead to dental and skeletal fluorosis, a disease that causes mottling of the teeth, calcification of ligaments, crippling bone deformities and many other physiological disorders that can, ultimately, lead to death. Conservative estimates are that fluorosis afflicts tens of millions of people worldwide. As there is no treatment for fluorosis, prevention is the only means of controlling the disease. While numerous defluoridation techniques have been explored, no single method has been found to be both effective and inexpensive enough to implement widely. Our research began in India, with a large-scale geochemical study of the groundwater in a fluoride-contaminated region of Orissa. Having developed a better understanding of the geochemical relationships that exist between fluoride and other parameters present in an affected area, as well as the complex relationships that arise among those parameters that can impact the presence of fluoride, we began investigating certain remediation scenarios involving iron oxides. A common approach to remediation involves the partitioning of fluoride from groundwater by sorption onto a variety of materials, one of the most effective of which is iron oxide whose surface area acts as a scavenger for fluoride. In the presence of iron oxidizing bacteria, the oxidation rate of iron has been shown to be ˜6 times greater than in their absence; fluoride should, therefore, be removed from an aqueous environment by bacteriogenic iron oxides (BIOS) much more quickly than by abiotic iron oxides. Most recently, sorption studies have been conducted using both BIOS and synthetic hydrous ferric oxides in order to compare the behavior between biotic and abiotic sorbents. These studies have provided sorption isotherms that allow comparison of fluoride removed by sorption to BIOS versus synthetic iron oxides. Sorption affinity constants have also been determined, which allow for the

  18. Fog dispersion

    NASA Technical Reports Server (NTRS)

    Frost, W.; Christensen, L. S.; Collins, F. G.; Camp, D. W.

    1980-01-01

    A study of economically viable techniques for dispersing warm fog at commercial airports is presented. Five fog dispersion techniques are examined: evaporation suppression, downwash, mixing, seeding with hygroscopic material, thermal techniques, and charged particle techniques. Thermal techniques, although effective, were found to be too expensive for routine airport operations, and detrimental to the environment. Seeding or helicopter downwash are practical for small-scale or temporary fog clearing, but are probably not useful for airport operations on a routine basis. Considerable disagreement exists on the capability of charged particle techniques, which stems from the fact that different assumptions and parameter values are used in the analytical models. Recommendations resulting from the review of this technique are listed, and include: experimental measurements of the parameters in question; a study to ascertain possible safety hazards, such as increased electrical activity or fuel ignition during refueling operations which could render charged particle techniques impractical; and a study of a single charged particle generator.

  19. Study of sorption of two sulfonylurea type of herbicides and their additives on soils and soil components.

    PubMed

    Földényi, Rita; Tóth, Zoltán; Samu, Gyöngyi; Érsek, Csaba

    2013-01-01

    The sorption of two sulfonylurea type herbicides (chlorsulfuron: (1-(2-chlorophenylsulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea; tribenuron methyl: (methyl-2-[N-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-(methyl-ureido)-sulfonyl]-benzoate) was studied on sand and chernozem soil adsorbents. Experimental results for solutions prepared from the pure ingredients were compared to those prepared from the appropriate formulated commercial products. At small concentrations, the extent of adsorption of the active ingredient was higher than from the formulation containing solutions. Environmental fate and effects of the forming agents are less investigated because they rarely have concentration limits recommended by authorities. In addition to the adsorption of active ingredients, therefore, the sorption behavior of a widely used additive Supragil WP (sodium diisopropyl naphthalene sulphonate) was also studied. This dispersant is an anionic forming agent applied in a lot of pesticide formulations. Using three different soils (sand, brown forest, chernozem) as adsorbents two-step isotherms were obtained. The role of the soil organic matter (OM) was significant in the adsorption mechanism because the adsorbed amounts of the dispersant correlated with the specific surface area as well as with the total organic carbon (TOC) content of the soils. The sorption behavior indicates the operation of hydrophobic interaction mechanism between the soil OM and the dispersant. These results are supported by our further sorption experiments on clays, too. Zeta potential measurements seem to be promising for the interpretation of multi-step isotherms. The application of this technique proved that higher concentrations of the anionic forming agent assisted the peptization of soil organic matter (SOM) resulting in stable colloidal solution dominated by negative charges. Since the pesticides investigated are also anionic at the studied pH (7 and 8.3) the dissolved organics lead to the

  20. Sorption modelling on illite. Part II: Actinide sorption and linear free energy relationships

    NASA Astrophysics Data System (ADS)

    Bradbury, M. H.; Baeyens, B.

    2009-02-01

    Sorption edge data for Ni(II), Co(II), Eu(III) and Sn(IV) [Bradbury M. H. and Baeyens B. (2009) Sorption modelling on illite. Part I: titration measurements and sorption of Ni(II), Co(II), Eu(III) and Sn(IV), Part I] on purified Na-Illite du Puy are available from some previous work, and some new measurements for Am(III), Th(IV), Pa(V) and U(VI) are presented here. All of these sorption edge measurements have been modelled with a 2 site protolysis non-electrostatic surface complexation and cation exchange (2SPNE SC/CE) sorption model for which the site types, site capacities and protolysis constants were fixed [Bradbury M. H. and Baeyens B. (2009), Part I]. In addition, two further data sets for the sorption of Am(III) and Np(V) on Illite du Puy, obtained from the literature, were also modelled in this work. Thus, surface complexation constants for the strong sites in the 2SPNE SC/CE sorption model for nine metals with valence states from II to VI have been obtained. A linear relationship between the logarithm of strong site metal binding constants, SK x-1, and the logarithm of the corresponding aqueous hydrolysis stability constant, OHK x, extending over nearly 35 orders of magnitude is established here for illite for these nine metals. Such correlations are often termed linear free energy relationships (LFER), and although they are quite common in aqueous phase chemistry, they are much less so in surface chemistry, especially over this large range. The LFER for illite could be described by the equation: logSK=7.9±0.4+(0.83±0.02)logOHKx where, " x" is an integer. A similar relationship has been previously obtained for montmorillonite, thus LFERs relating to the sorption on two of the most important clay minerals present in natural systems have been established. Such an LFER approach is an extremely useful tool for estimating surface complexation constants for metals in a chemically consistent manner. It provides a means of obtaining sorption values for

  1. Sorption of perfluorooctane sulfonate on organo-montmorillonites.

    PubMed

    Zhou, Qin; Deng, Shubo; Yu, Qiang; Zhang, Qiaoying; Yu, Gang; Huang, Jun; He, Hongping

    2010-02-01

    Perfluorinated compound as one of the emerging pollutants has caused great attention in recent years. In this study, the organo-montmorillonites (organo-Mts) with different amounts and arrangements of hexadecyltrimethylammonium bromide (HDTMAB) were prepared as effective sorbents for PFOS removal from water. Batch sorption experiments including sorption kinetics, sorption isotherm as well as effect of solution pH were studied. The Elovich and pseudo-second-order models were selected to fit the kinetic data and the latter described the sorption kinetic better. Sorption isotherms showed that the sorption amount of PFOS increased with increasing amount of HDTMAB loaded in the montmorillonites, indicating that hydrophobic interaction played an important role in the sorption process. Comparative sorption of other perfluorinated compounds (PFCs) with different length of C-F chains and different functional groups further verified that hydrophobic interaction was the main force for the sorption of PFCs on the organo-Mts. X-ray diffraction (XRD) analysis demonstrated the significant decrease of interlayer distance after PFOS sorption, suggesting that the HDTMAB molecules were rearranged in the interlayer of organo-Mts. The PFOS molecules first diffused into the organo-Mts via hydrophobic interaction, and then the rearrangement occurred through electrostatic interaction between the two surfactants, resulting in the microstructure change within the organo-Mts.

  2. Black Hole Event Horizons and Advection-Dominated Accretion

    NASA Technical Reports Server (NTRS)

    McClintock, Jeffrey; Mushotzky, Richard F. (Technical Monitor)

    2001-01-01

    The XMM data on black-hole X-ray novae are only now becoming available and they have so far not been included in any publications. This work is part of a larger project that makes use of both XMM and Chandra data. Our first publication on the Chandra results is the following: "New Evidence for Black Hole Event Horizons from Chandra" by M.R. Garcia, J.E. McClintock, R. Narayan, P. Callanan, D. Barret and S. Murray (2001, ApJ, 553, L47). Therein we present the luminosities of the two black-hole X-ray novae, GRO J0422+22 and 4U1 543-47, which were observed by Chandra. These results are combined with the luminosities of four additional black-hole X-ray novae, which were observed as part of a Chandra GTO program (PI: S. Murray). The very low, but nonzero, quiescent X-ray luminosities of these black hole binaries is very difficult to understand in the context of standard viscous accretion disk theory. The principal result of this work is that X-ray novae that contain black hole primaries are about 100 times fainter that X-ray novae that contain neutron star primaries. This result had been suggested in earlier work, but the present work very firmly establishes this large luminosity difference. The result is remarkable because the black-hole and the neutron-star systems are believed to be similar in many respects. Most importantly, the mass transfer rate from the secondary star is believed to be very comparable for the two kinds of systems for similar orbital periods. The advection-dominated accretion flow (ADAF) model provides a natural framework for understanding the extraordinarily low luminosities of the black hole systems and the hundred-fold greater luminosities of the neutron star systems. The chief feature of an ADAF is that the heat energy in the accreting gas is trapped in the gas and travels with it, rather than being radiated promptly. Thus the accreting gas reaches the central object with a huge amount of thermal energy. If the accretor is a black hole, the

  3. Fractures as Advective Conduits at the Earth Atmosphere Interface

    NASA Astrophysics Data System (ADS)

    Dragila, M. I.; Weisbrod, N.; Nachshon, U.; Kamai, T.

    2012-12-01

    Understanding gas exchange between the Earth's upper crust and the atmosphere is vital and necessary because this phenomenon controls to a large extent many important processes including, the water cycle, agricultural activities, greenhouse gas emissions and more. From a hydrological aspect, water vapor transport is an extremely important process related to Earth-atmosphere gas exchange because it affects above ground water vapor concentration, soil water content and soil salinity. Traditionally, diffusion was considered the main mechanism of gas exchange between the atmosphere and vadose zone, driven by gas concentration gradients. While this assumption may be correct for many porous media, our laboratory and field-scale studies have shown that advective gas transport mechanisms are governing these fluxes in fractured rocks and cracked soils. Convection driven by thermal gradients (free convection) and wind induced (forced convection) were explored and both were found to play a major role in Earth-atmosphere gas exchange. Long-term laboratory experiments using fracture simulators in a customized climate controlled laboratory have shown that thermal convection occurs when nighttime thermal conditions prevail. This convective venting significantly enhances evaporation and subsequently salt precipitation on the fracture walls. Experiment results were used to develop an empirical relationship between temperature gradients, fracture aperture and convective gas flux through the fracture. Theoretical calculations show that thermal convection is indeed likely to play a major role in evaporation from fractures and can explain enhanced salt accumulation observed in surface-exposed fractures. Long-term field measurements, carried out continuously for 5+ years in a single fracture in the Israeli Negev Desert, verified the development of air convection cycles of 10-18 hours duration on a daily basis, with a peak in both convective flux and duration during the winter. During

  4. Residual insecticides and the problem of sorption

    PubMed Central

    Bertagna, P.

    1959-01-01

    Whereas laboratory investigations have elucidated the mechanism of sorption of residual insecticides and demonstrated that their persistency is determined by a number of physico-chemical factors and is therefore theoretically calculable, the variables encountered in the field may produce results in apparent conflict with those theoretically expected. Attempts to enhance persistency through the prevention of sorption, although promising, have so far not been fully successful. It is consequently also necessary to assess the residual effectiveness of insecticides, “effectiveness” here being viewed as a biological effect expressed in terms of the mosquito mortality produced. For this purpose bio-assay tests have been used, but with very variable results, and it is suggested that a study of the bio-assay technique itself is needed. This should be conducted in parallel with chemical determinations of the total amount of insecticide present both on and below the sprayed surface. PMID:13799942

  5. Surface complexation modeling or organic acid sorption to goethite

    SciTech Connect

    Evanko, C.R.; Dzombak, D.A.

    1999-06-15

    Surface complexation modeling was performed using the Generalized Two-Layer Model for a series of low molecular weight organic acids. Sorption of these organic acids to goethite was investigated in a previous study to assess the influence of particular structural features on sorption. Here, the ability to describe the observed sorption behavior for compounds with similar structural features using surface complexation modeling was investigated. A set of surface reactions and equilibrium constants yielding optimal data fits was obtained for each organic acid over a range of total sorbate concentrations. Surface complexation modeling successfully described sorption of a number of the simple organic acids, but an additional hydrophobic component was needed to describe sorption behavior of some compounds with significant hydrophobic character. These compounds exhibited sorption behavior of some compounds with significant hydrophobic character. These compounds exhibited sorption behavior that was inconsistent with ligand exchange mechanisms since sorption behavior of some compounds with significant hydrophobic character. These compounds exhibited sorption behavior that was inconsistent with ligand exchange mechanisms since sorption did not decrease with increasing total sorbate concentration and/or exceeded surface site saturation. Hydrophobic interactions appeared to be most significant for the compound containing a 5-carbon aliphatic chain. Comparison of optimized equilibrium constants for similar surface species showed that model results were consistent with observed sorption behavior: equilibrium constants were highest for compounds having adjacent carboxylic groups, lower for compounds with adjacent phenolic groups, and lowest for compounds with phenolic groups in the ortho position relative to a carboxylic group. Surface complexation modeling was also performed to fit sorption data for Suwannee River fulvic acid. The data could be described well using reactions and

  6. Effect of natural organic materials on cadmium and neptunium sorption

    SciTech Connect

    Kung, K.S.; Triay, I.R.

    1994-10-01

    In a batch sorption study of the effect of naturally occurring organic materials on the sorption of cadmium and neptunium on oxides and tuff surfaces, the model sorbents were synthetic goethite, boehmite, amorphous silicon oxides, and a crushed tuff material from Yucca Mountain, Nevada. An amino acid, 3-(3,4-dihydroxypheny)-DL-alanine (DOPA), and an aquatic-originated fulvic material, Nordic aquatic fulvic acid (NAFA), were used as model organic chemicals. Sorption isotherm results showed that DOPA sorption followed the order aluminum oxide > iron oxide > silicon oxide and that the amount of DOAP sorption for a given sorbent increased as the solution pH was raised. The sorption of cadmium and neptunium on the iron oxide was about ten times higher than that on the aluminum oxide. The sorption of cadmium and neptunium on natural tuff material was much lower than that on aluminum and iron oxides. The sorption of cadmium on iron and aluminum oxides was found to be influenced by the presence of DOPA, and increasing the amount of DOPA coating resulted in higher cadmium sorption on aluminum oxide. However, for iron oxide, cadmium sorption decreased with increasing DOPA concentration. The presence of the model organic materials DOPA and NAFA did not affect the sorption of neptunium on tuff material or on the iron and aluminum oxides. Spectroscopic results indicate that cadmium complexes strongly with DOPA. Therefore, the effect of the organic material, DOPA, on the cadmium sorption is readily observed. However, neptunium is possibly complexed weakly with organic material. Thus, DOPA and NAFA have little effect on neptunium sorption on all sorbents selected for study.

  7. Rigorous upper bounds for fluid and plasma transport due to passive advection

    SciTech Connect

    Krommes, J.A.; Smith, R.A.; Kim, C.B.

    1987-07-01

    The formulation of variational principles for transport due to passive advection is described. A detailed account of the work has been published elsewhere. In the present paper, the motivations, philosophy, and implications of the method are briefly discussed. 15 refs.

  8. AN EULERIAN-LAGRANGIAN LOCALIZED ADJOINT METHOD FOR THE ADVECTION-DIFFUSION EQUATION

    EPA Science Inventory

    Many numerical methods use characteristic analysis to accommodate the advective component of transport. Such characteristic methods include Eulerian-Lagrangian methods (ELM), modified method of characteristics (MMOC), and operator splitting methods. A generalization of characteri...

  9. Simulation of Helical Flow Hydrodynamics in Meanders and Advection-Turbulent Diffusion Using Smoothed Particle Hydrodynamics

    NASA Astrophysics Data System (ADS)

    Gusti, T. P.; Hertanti, D. R.; Bahsan, E.; Soeryantono, H.

    2013-12-01

    Particle-based numerical methods, such as Smoothed Particle Hydrodynamics (SPH), may be able to simulate some hydrodynamic and morphodynamic behaviors better than grid-based numerical methods. This study simulates hydrodynamics in meanders and advection and turbulent diffusion in straight river channels using Microsoft Excel and Visual Basic. The simulators generate three-dimensional data for hydrodynamics and one-dimensional data for advection-turbulent diffusion. Fluid at rest, sloshing, and helical flow are simulated in the river meanders. Spill loading and step loading are done to simulate concentration patterns associated with advection-turbulent diffusion. Results indicate that helical flow is formed due to disturbance in morphology and particle velocity in the stream and the number of particles does not have a significant effect on the pattern of advection-turbulent diffusion concentration.

  10. A Quasi-Conservative Adaptive Semi-Lagrangian Advection-Diffusion Scheme

    NASA Astrophysics Data System (ADS)

    Behrens, Joern

    2014-05-01

    Many processes in atmospheric or oceanic tracer transport are conveniently represented by advection-diffusion type equations. Depending on the magnitudes of both components, the mathematical representation and consequently the discretization is a non-trivial problem. We will focus on advection-dominated situations and will introduce a semi-Lagrangian scheme with adaptive mesh refinement for high local resolution. This scheme is well suited for pollutant transport from point sources, or transport processes featuring fine filamentation with corresponding local concentration maxima. In order to achieve stability, accuracy and conservation, we combine an adaptive mesh refinement quasi-conservative semi-Lagrangian scheme, based on an integral formulation of the underlying advective conservation law (Behrens, 2006), with an advection diffusion scheme as described by Spiegelman and Katz (2006). The resulting scheme proves to be conservative and stable, while maintaining high computational efficiency and accuracy.

  11. The impact of advection on stratification and chlorophyll variability in the equatorial Pacific

    NASA Astrophysics Data System (ADS)

    Dave, Apurva C.; Lozier, M. Susan

    2015-06-01

    Previously reported global-scale correlations between interannual variability in upper ocean stratification and chlorophyll a (a proxy for phytoplankton biomass) have been shown to be driven by strong associations between the two properties in the central and western equatorial Pacific. Herein, we present evidence that these correlations are not causal but instead result from the advection of heat, salt, and nutrients in the region. Specifically, we demonstrate that stratification and chlorophyll are simultaneously influenced by shifts in the horizontal advective inputs of cold/saline/nutrient-rich waters from upwelling regions to the east and warm/fresh/nutrient-poor waters to the west. We find that horizontal advection contributes substantially to the annual surface layer nutrient budget and, together with vertical advection, significantly impacts interannual variability in chlorophyll. These results highlight the importance of a three-dimensional framework for examining nutrient supply in the upper ocean—a crucial requirement for assessing future marine ecosystem responses to a changing climate.

  12. Fast, Low-Duty-Cycle Sorption Refrigerators

    NASA Technical Reports Server (NTRS)

    Johnson, AL; Jones, Jack A.

    1994-01-01

    Metal hydride/hydrogen-sorption refrigerators developed to provide rapid, intermittent cooling at temperatures between 30 and 10 K. In original application, refrigerators cool infrared detectors aboard spacecraft, exhausting heat to outer space via radiators at 250 K. Modified to cool scientific instrumentation on Earth with some loss of efficiency. Require no power during quick cooldown and low heating power during relatively long recharge periods.

  13. As(III) and As(V) sorption on iron-modified non-pyrolyzed and pyrolyzed biomass from Petroselinum crispum (parsley).

    PubMed

    Jiménez-Cedillo, M J; Olguín, M T; Fall, C; Colin-Cruz, A

    2013-03-15

    The sorption of As(III) and As(V) from aqueous solutions onto iron-modified Petroselinum crispum (PCFe) and iron-modified carbonaceous material from the pyrolysis of P. crispum (PCTTFe) was investigated. The modified sorbents were characterized with scanning electron microscopy. The sorbent elemental composition was determined with energy-dispersive X-ray spectroscopy (EDS). The principal functional groups from the sorbents were determined with FT-IR. The specific surfaces and points of zero charge (pzc) of the materials were also determined. As(III) and As(V) sorption onto the modified sorbents were performed in a batch system. After the sorption process, the As content in the liquid and solid phases was determined with atomic absorption and neutron activation analyses, respectively. After the arsenic sorption processes, the desorption of Fe from PCFe and PCTTFe was verified with atomic absorption spectrometry. The morphology of PC changed after iron modification. The specific area and pzc differed significantly between the iron-modified non-pyrolyzed and pyrolyzed P. crispum. The kinetics of the arsenite and arsenate sorption processes were described with a pseudo-second-order model. The Langmuir-Freundlich model provided the isotherms with the best fit. Less than 0.02% of the Fe was desorbed from the PCFe and PCTTFe after the As(III) and As(V) sorption processes.

  14. Chemo-mechanical modification of cottonwood for Pb(2+) removal from aqueous solutions: Sorption mechanisms and potential application as biofilter in drip-irrigation.

    PubMed

    Mosa, Ahmed; El-Ghamry, Ayman; Trüby, Peter; Omar, Mahmoud; Gao, Bin; Elnaggar, Abdelhamid; Li, Yuncong

    2016-10-01

    Using biomass (e.g. crop residues) and its derivatives as biosorbents have been recognized as an eco-friendly technique for wastewater decontamination. In this study, mechanically modified cottonwood was further activated with KOH to improve its sorption of Pb(2+). In addition, its potential as a biofilter to safeguard radish (Raphanus sativus, L.) against Pb-stress was evaluated in a gravity-fed drip irrigation system. Physiochemical properties of the chemo-mechanically activated cottonwood (CMACW) and the mechanically activated cottonwood (MACW) before and after sorption process were characterized using scanning electron microscopy (SEM), energy dispersive X-ray spectroscopy (EDS), transmission electron microscopy (TEM), digital selected-area electron diffraction (SAED) and Fourier transform infrared spectroscopy (FTIR). After activation, several sorption mechanisms (i.e. precipitation, electrostatic outer- and inner-sphere complexation) were responsible for the higher sorption capacity of CMACW as compared with MACW (8.55 vs. 7.28 mg g(-1)). Sorption kinetics and isotherms fitted better with the pseudo-second-order and Langmuir models as compared with the pseudo-first-order and Freundlich models, respectively. In the gravity-fed drip irrigation system, the CMACW biofilter reduced the accumulation of Pb in radish roots and shoots and avoided reaching the toxic limits in some cases. Soil types had a significant effect on Pb(2+) bioavailability because of the difference in sorption ability. Findings from this study showed that CMACW biofilter can be used as a safeguard for wastewater irrigation.

  15. Advection-Induced Spectrotemporal Defects in a Free-Electron Laser

    SciTech Connect

    Bielawski, S.; Szwaj, C.; Bruni, C.; Garzella, D.; Orlandi, G.L.; Couprie, M.E.

    2005-07-15

    We evidence numerically and experimentally that advection can induce spectrotemporal defects in a system presenting a localized structure. Those defects in the spectrum are associated with the breakings induced by the drift of the localized solution. The results are based on simulations and experiments performed on the super-ACO free-electron laser. However, we show that this instability can be generalized using a real Ginzburg-Landau equation with (i) advection and (ii) a finite-size supercritical region.

  16. Exploration of POD-Galerkin Techniques for Developing Reduced Order Models of Reaction-Advection Equations

    DTIC Science & Technology

    2014-04-01

    downstream boundary (when needed) is obtained by extrapolation, taking into account the hyperbolic character of the equation . By separating the...for Developing Reduced Order Models of Reaction-Advection Equations 5b. GRANT NUMBER 5c. PROGRAM ELEMENT NUMBER 6. AUTHOR(S) 5d. PROJECT...advection scalar equation is used as a representative equation to investigate the overall approach. Both linear and nonlinear model equations are

  17. Sorption Modeling and Verification for Off-Gas Treatment

    SciTech Connect

    Tavlarides, Lawrence L.; Lin, Ronghong; Nan, Yue; Yiacoumi, Sotira; Tsouris, Costas; Ladshaw, Austin; Sharma, Ketki; Gabitto, Jorge; DePaoli, David

    2015-04-29

    The project has made progress toward developing a comprehensive modeling capability for the capture of target species in off gas evolved during the reprocessing of nuclear fuel. The effort has integrated experimentation, model development, and computer code development for adsorption and absorption processes. For adsorption, a modeling library has been initiated to include (a) equilibrium models for uptake of off-gas components by adsorbents, (b) mass transfer models to describe mass transfer to a particle, diffusion through the pores of the particle and adsorption on the active sites of the particle, and (c) interconnection of these models to fixed bed adsorption modeling which includes advection through the bed. For single-component equilibria, a Generalized Statistical Thermodynamic Adsorption (GSTA) code was developed to represent experimental data from a broad range of isotherm types; this is equivalent to a Langmuir isotherm in the two-parameter case, and was demonstrated for Kr on INL-engineered sorbent HZ PAN, water sorption on molecular sieve A sorbent material (MS3A), and Kr and Xe capture on metal-organic framework (MOF) materials. The GSTA isotherm was extended to multicomponent systems through application of a modified spreading pressure surface activity model and generalized predictive adsorbed solution theory; the result is the capability to estimate multicomponent adsorption equilibria from single-component isotherms. This advance, which enhances the capability to simulate systems related to off-gas treatment, has been demonstrated for a range of real-gas systems in the literature and is ready for testing with data currently being collected for multicomponent systems of interest, including iodine and water on MS3A. A diffusion kinetic model for sorbent pellets involving pore and surface diffusion as well as external mass transfer has been established, and a methodology was developed for determining unknown diffusivity parameters from transient

  18. Sorption cooling of astrophysics science instruments

    NASA Technical Reports Server (NTRS)

    Wade, Lawrence A.; Levy, Alan R.

    1996-01-01

    The current status of continuous and periodic operation sorption cryocooler development for astrophysics missions requiring refrigeration to 4 K and below, is reviewed. These coolers are suited for the cooling of detectors in planned astrophysics missions such as the exploration of neighboring planetary systems planet finder array (ExNPS PFA). The cooler requirements imposed by these missions include a ten-year life, zero vibration, zero electromagnetic interference and electromagnetic charging operation, and the ability to scale designs to provide low refrigeration capability with low power consumption. Spaceflight test results are summarized for the brilliant eyes 10 K sorption cryocooler experiment. This experiment successfully validated flight cooler performance and provided characterization of all sorption cooler design parameters which may have shown sensitivity to microgravity effects. Ground test results from a continuous 25 K cooler planned for use in a long duration airborne balloon experiment are presented. A NASA program to develop 30 K, 10 K and 4 K vibration-free coolers for astrophysics missions is outlined.

  19. Multicomponent gas sorption Joule-Thomson refrigeration

    NASA Technical Reports Server (NTRS)

    Jones, Jack A. (Inventor); Petrick, S. Walter (Inventor); Bard, Steven (Inventor)

    1991-01-01

    The present invention relates to a cryogenic Joule-Thomson refrigeration capable of pumping multicomponent gases with a single stage sorption compressor system. Alternative methods of pumping a multicomponent gas with a single stage compressor are disclosed. In a first embodiment, the sorbent geometry is such that a void is defined near the output of the sorption compressor. When the sorbent is cooled, the sorbent primarily adsorbs the higher boiling point gas such that the lower boiling point gas passes through the sorbent to occupy the void. When the sorbent is heated, the higher boiling point gas is desorbed at high temperature and pressure and thereafter propels the lower boiling point gas out of the sorption compressor. A mixing chamber is provided to remix the constituent gases prior to expansion of the gas through a Joule-Thomson valve. Other methods of pumping a multicomponent gas are disclosed. For example, where the sorbent is porous and the low boiling point gas does not adsorb very well, the pores of the sorbent will act as a void space for the lower boiling point gas. Alternatively, a mixed sorbent may be used where a first sorbent component physically adsorbs the high boiling point gas and where the second sorbent component chemically absorbs the low boiling point gas.

  20. Sensitivity of solute advective travel time to porosities of hydrogeologic units.

    PubMed

    Zhu, Jianting; Pohlmann, Karl F; Chapman, Jenny B; Russell, Charles E; Carroll, Rosemary W H; Shafer, David S

    2010-01-01

    An integral approach is proposed to quantify uncertainty and sensitivity of advective travel time to the effective porosities of hydrogeologic units (HGUs) along groundwater flow paths. The approach is applicable in situations where a groundwater flow model exists, but a full solute transport model is not available. The approach can be used to: (1) determine HGUs whose porosities are influential to the solute advective travel time; and (2) apportion uncertainties of solute advective travel times to the uncertainty contributions from individual HGU porosities. A simple one-dimensional steady-state flow example is used to illustrate the approach. Advective travel times of solutes are obtained based on the one-dimensional steady-state flow results in conjunction with the HGU porosities. The approach can be easily applicable to more complex multi-dimensional cases where advective solute travel time can be calculated based on simulated flow results from groundwater flow models. This approach is particularly valuable for optimizing limited resources when designing field characterization programs for uncertainty reduction by identifying HGUs that contribute most to the estimation uncertainty of advective travel times of solutes.

  1. Sorption and degradation of four nitroaromatic herbicides in mono and multi-solute saturated/unsaturated soil batch systems

    NASA Astrophysics Data System (ADS)

    Martins, Jean M.; Mermoud, André

    1998-09-01

    This paper presents a study on sorption and degradation processes involved in the fate of nitroaromatic herbicides in an alluvial sandy loam. Particular attention was given to a competitive sorption process and its impact on herbicide biodegradation through bioavailability modification. The main question addressed was the occurrence of antagonistic or synergistic effects in herbicide mixtures. Approaching the problem by using a herbicide combination, it was demonstrated that the more soluble herbicides strongly decreased the sorption of the more hydrophobic ones on the soil organic fraction. Conversely, ionic strength was shown to increase sorption levels dramatically. These results prove that soil solution chemistry is a relevant factor to be taken into account in pesticide behaviour studies. Herbicide biodegradation was studied with the same approach, and the results revealed that degradation of a particular dinitrophenol is affected by the presence of similar molecules. In well-dispersed soil suspensions where herbicide/micro-organism contact is optimal, toxicity was shown to increase herbicide persistence and to be the controlling factor of biodegradation. Conversely, persistence in repacked unsaturated soil batches was strongly decreased in both mono and multi-solute systems. In such solid batches, the soil structure imposed mass transfer kinetics which modify micro-organism/herbicide contact and decreased toxicity effects. Furthermore, the competitive sorption observed in multi-solute systems was supposed to be responsible for the observed increase of herbicide biodegradation presumably by keeping molecules bioavailable for microbial attack. These results support the assumption that soils are divided into two compartments presenting different capacities in regard to chemical sorption and biodegradation, which could be a basis for explaining chemical aging in soil. This study providing new information on physico-chemical control of pollutant biodegradation in

  2. The influence of clay surface modification with berberine on the sorption of anthocyanins

    NASA Astrophysics Data System (ADS)

    Chulkov, A. N.; Deineka, V. I.; Tikhova, A. A.; Vesentzev, A. I.; Deineka, L. A.

    2012-03-01

    The influence of preliminary sorption of berberine on the sorption of anthocyanins by bentonite clay was studied. The cation exchange sorption mechanism was found to be replaced by hydrophobic sorption of these compounds after clay modification with berberine. The enthalpy of sorption along the initial isotherm part changed from endothermic to exothermic.

  3. Selective sorption of latex membranes with ethanol-water mixtures

    SciTech Connect

    Wei, Y.; Huang, R.Y.M. )

    1994-02-01

    Latex membranes have recently found use in pervaporation separation. The sorption of water-ethanol mixtures to latex membranes was carried out on three types of latex membranes, poly(acrylonitrile-co-butyl acrylate) [P(AN-BuA)], poly(methyl methacrylate-co-butyl acrylate) [P(MMA-BuA)], and poly(styrene-co-butyl acrylate) [P(ST-BuA)], which were prepared in our laboratory by direct casting of polymer latexes synthesized by emulsion polymerization. These latex membranes all exhibit preferential sorption and permeation toward water. Both water and ethanol sorption to the latex membranes exhibited nonideal sorption, with water sorption being enhanced greatly by the presence of ethanol. It was shown that the solubility parameter theory did not give correct predictions for the preferential sorption of latex membranes. Better results were obtained by using the Flory-Huggins interaction parameter. 12 refs., 4 figs., 2 tabs.

  4. Pharmaceuticals' sorptions relative to properties of thirteen different soils.

    PubMed

    Kodešová, Radka; Grabic, Roman; Kočárek, Martin; Klement, Aleš; Golovko, Oksana; Fér, Miroslav; Nikodem, Antonín; Jakšík, Ondřej

    2015-04-01

    Transport of human and veterinary pharmaceuticals in soils and consequent ground-water contamination are influenced by many factors, including compound sorption on soil particles. Here we evaluate the sorption isotherms for 7 pharmaceuticals on 13 soils, described by Freundlich equations, and assess the impact of soil properties on various pharmaceuticals' sorption on soils. Sorption of ionizable pharmaceuticals was, in many cases, highly affected by soil pH. The sorption coefficient of sulfamethoxazole was negatively correlated to soil pH, and thus positively related to hydrolytic acidity and exchangeable acidity. Sorption coefficients for clindamycin and clarithromycin were positively related to soil pH and thus negatively related to hydrolytic acidity and exchangeable acidity, and positively related to base cation saturation. The sorption coefficients for the remaining pharmaceuticals (trimethoprim, metoprolol, atenolol, and carbamazepine) were also positively correlated with the base cation saturation and cation exchange capacity. Positive correlations between sorption coefficients and clay content were found for clindamycin, clarithromycin, atenolol, and metoprolol. Positive correlations between sorption coefficients and organic carbon content were obtained for trimethoprim and carbamazepine. Pedotransfer rules for predicting sorption coefficients of various pharmaceuticals included hydrolytic acidity (sulfamethoxazole), organic carbon content (trimethoprimand carbamazepine), base cation saturation (atenolol and metoprolol), exchangeable acidity and clay content (clindamycin), and soil active pH and clay content (clarithromycin). Pedotransfer rules, predicting the Freundlich sorption coefficients, could be applied for prediction of pharmaceutical mobility in soils with similar soil properties. Predicted sorption coefficients together with pharmaceutical half-lives and other imputes (e.g., soil-hydraulic, geological, hydro-geological, climatic) may be used for

  5. Sorption of copper by chemically modified aspen wood fibers.

    PubMed

    Huang, Liyuan; Ou, Zhaoyang; Boving, Thomas B; Tyson, Julian; Xing, Baoshan

    2009-08-01

    Sorption of copper (Cu(2+)) by untreated and treated (bleaching and hydrolysis) aspen wood fibers, cellulose and lignin was examined to understand the Cu(2+) sorption behavior by these natural sorbents. All sorbents were characterized by solid-state (13)C NMR and FTIR. Bleaching broke up aromatic structures and increased hydrophilicity of the fibers, whereas hydrolysis decreased carbohydrate content, producing a more hydrophobic structure. Copper sorption was a function of pH; the percentage of Cu(2+) sorption steadily increased from pH 1.5 to 4.5 with a maximum sorption amount at around pH 5.5 for all the materials. All isotherms fitted well to the Langmuir equation. Bleached sample (BL) had a highest sorption capacity, followed by untreated (UTR), cellulose (CEL), and hydrolyzed (HHY), while lignin (LIG) had little Cu(2+) sorption under the studied conditions. The results suggested that carboxyl (-COOH) and hydroxyl (-CHOH) in carbohydrates are mainly responsible for Cu(2+) sorption, and that ion exchange may be a main sorption mechanism for the studied sorbents. Additionally, the sorption capacity for Cu(2+) on all sorbents decreased with the increase of the initial concentrations of Ca(2+), Na(+) or Al(3+). Copper sorption decreased rapidly at low initial concentrations of Ca(2+), Na(+) or Al(3+). However, the decline of Cu(2+) sorption slowed down when initial Na(+) and Ca(2+) concentration was higher than 0.05M or initial Al(3+) concentration was greater than 0.005M, indicating that specific adsorption may be taking place. Therefore, the majority of sorbed Cu(2+) to aspen wood fibers could be through ion exchange (especially, for UTR, BL and CEL), while a faction of sorbed Cu(2+) via inner-sphere complex (or specific adsorption).

  6. Effect of illite particle shape on cesium sorption

    USGS Publications Warehouse

    Rajec, P.; Sucha, V.; Eberl, D.D.; Srodon, J.; Elsass, F.

    1999-01-01

    Samples containing illite and illite-smectite, having different crystal shapes (plates, "barrels", and filaments), were selected for sorption experiments with cesium. There is a positive correlation between total surface area and Cs-sorption capacity, but no correlation between total surface area and the distribution coefficient, Kd. Generally Kd increases with the edge surface area, although "hairy" (filamentous) illite does not fit this pattern, possibly because elongation of crystals along one axis reduces the number of specific sorption sites.

  7. Advection and evolution of river basins in mountain ranges.

    NASA Astrophysics Data System (ADS)

    Castelltort, S.; Simpson, G.; Willett, S.

    2009-04-01

    Simpson (2006) have proposed a mechanism which involves (1) the idea that river networks in the lowland plains are incorporated in the orogen as it widens, and (2) that they do not change after their incorporation, thus "importing" a geometry acquired outside of the range independently of the tectonic and climatic influences acting inside the uplifting zone. This mechanisms implies rather a "static" view of river networks which serves as an alternative to models in which river networks continuously reorganize inside uplifting topography in such a way as to maintain a statistical geometry dictated solely by geomorphic processes. In the present work our approach to this problem is to measure and compare the form of river basins in the lowlands and in the uplands of the Himalayas, New-Zealand, Taiwan, the European Alps, the Pyrenees and the Apennines. We first present the method we employ to measure the shape of river basins and the data used. Second, we analyse and discuss our results which show a correlation between the shape of networks developed in the pro-lowlands of active orogens and their upland counterparts whereas such a correlation does not exist on the retro-side of the considered orogens. Our results thus support (1) the horizontal advection of river basins from the pro-lowlands to the pro-uplands, (2) a certain amount of reorganization by widening of basin boundaries, and (3) the existence of a different mechanism of drainage network evolution in the retro-side of the orogens. Castelltort, S., and Simpson, G., 2006, Basin Research, 18: 267-276. Hallet, B. and Molnar, P., 2001. J. Geophys. Res, 106: 13697-13709. Hovius, N., 1996, Basin Research, 8: 29-44.

  8. Advective transport observations with MODPATH-OBS--documentation of the MODPATH observation process

    USGS Publications Warehouse

    Hanson, R.T.; Kauffman, L.K.; Hill, M.C.; Dickinson, J.E.; Mehl, S.W.

    2013-01-01

    The MODPATH-OBS computer program described in this report is designed to calculate simulated equivalents for observations related to advective groundwater transport that can be represented in a quantitative way by using simulated particle-tracking data. The simulated equivalents supported by MODPATH-OBS are (1) distance from a source location at a defined time, or proximity to an observed location; (2) time of travel from an initial location to defined locations, areas, or volumes of the simulated system; (3) concentrations used to simulate groundwater age; and (4) percentages of water derived from contributing source areas. Although particle tracking only simulates the advective component of conservative transport, effects of non-conservative processes such as retardation can be approximated through manipulation of the effective-porosity value used to calculate velocity based on the properties of selected conservative tracers. This program can also account for simple decay or production, but it cannot account for diffusion. Dispersion can be represented through direct simulation of subsurface heterogeneity and the use of many particles. MODPATH-OBS acts as a postprocessor to MODPATH, so that the sequence of model runs generally required is MODFLOW, MODPATH, and MODPATH-OBS. The version of MODFLOW and MODPATH that support the version of MODPATH-OBS presented in this report are MODFLOW-2005 or MODFLOW-LGR, and MODPATH-LGR. MODFLOW-LGR is derived from MODFLOW-2005, MODPATH 5, and MODPATH 6 and supports local grid refinement. MODPATH-LGR is derived from MODPATH 5. It supports the forward and backward tracking of particles through locally refined grids and provides the output needed for MODPATH_OBS. For a single grid and no observations, MODPATH-LGR results are equivalent to MODPATH 5. MODPATH-LGR and MODPATH-OBS simulations can use nearly all of the capabilities of MODFLOW-2005 and MODFLOW-LGR; for example, simulations may be steady-state, transient, or a combination

  9. Sorption of radionuclides by cement-based barrier materials

    SciTech Connect

    Li, Kefei Pang, Xiaoyun

    2014-11-15

    This paper investigates the sorption of radionuclide ions, {sup 137}Cs{sup +} and {sup 90}Sr{sup 2+}, by cement-based barrier materials for radioactive waste disposal. A mortar with ternary binder is prepared and powder samples are ground from the hardened material following a predetermined granulometry. After pre-equilibrium with an artificial pore solution, the sorption behaviors of powder samples are investigated through single sorption and blended sorption. The results show that: (1) no systematic difference is observed for single and blended sorptions thus the interaction between {sup 137}Cs{sup +} and {sup 90}Sr{sup 2+} sorptions must be weak; (2) the sorption kinetics is rapid and all characteristic times are less than 1d; (3) the sorption capacity is enhanced by C–A–S–H hydrates and the measured K{sub d} values can be predicted from C–S–H sorption data with Ca/Si ratio equal to Ca/(Si + Al) ratio.

  10. The sorption of polonium, actinium and protactinium onto geological materials

    SciTech Connect

    Baston, G.M.N.; Berry, J.A.; Brownsword, M.; Heath, T.G.; Ilett, D.J.; McCrohon, R.; Tweed, C.J.; Yui, M.

    1999-07-01

    This paper describes a combined experimental and modeling program of generic sorption studies to increase confidence in the performance assessment for a potential high-level radioactive waste repository in Japan. The sorption of polonium, actinium and protactinium onto geological materials has been investigated. Sorption of these radioelements onto bentonite, tuff and granodiorite from equilibrated de-ionized water was studied under reducing conditions at room temperature. In addition, the sorption of actinium and protactinium was investigated at 60 C. Thermodynamic chemical modeling was carried out to aid interpretation of the results.

  11. Sorption of fibronectin to human root surfaces in vitro

    SciTech Connect

    Mendieta, C.; Caravana, C.; Fine, D.H. )

    1990-05-01

    The purpose of this study was to determine the conditions that favor the sorption and retention of human plasma fibronectin to cementum. Rectangular root segments prepared from teeth extracted for orthodontic reasons were mounted on a capillary pipette and immersed in solutions of {sup 125}I fibronectin for assay of cementum sorption under various conditions. Kinetic studies showed sorption to be rapid, with 77% of the maximum fibronectin sorption occurring within 1 minute. Fibronectin sorption was reduced when added in conjunction with serum and was inhibited by monovalent ions (such as sodium), but enhanced in the presence of divalent cations (such as calcium). Exposure of cementum to serum partially blocked subsequent sorption of fibronectin, while cementum bound fibronectin was eluted by subsequent exposure to serum. Treatment of cementum with citric acid pH 1.1 (4 minutes) followed by 5% sodium hypochlorite (5 minutes) caused a significant increase in fibronectin sorption with maximum retention upon subsequent exposure to serum (P less than 0.05). Fibronectin sorption to cementum was: rapid, electrostatic in nature, competitive, reversible, Ca+(+)-facilitated, and maximized by prior treatment of the root with citric acid and sodium hypochlorite. It is concluded that sorption of fibronectin to cementum can be achieved for clinical gain; however, conditions of application can significantly influence both accumulation and subsequent release of root sorbed material.

  12. Sorption of tebuconazole onto selected soil minerals and humic acids.

    PubMed

    Cadková, Eva; Komárek, Michael; Kaliszová, Regina; Koudelková, Věra; Dvořák, Jiří; Vaněk, Aleš

    2012-01-01

    The aim of the present study was to investigate tebuconazole sorption on common soil minerals (birnessite, ferrihydrite, goethite, calcite and illite) and humic acids (representing soil organic matter). Tebuconazole was used (i) in the commercial form Horizon 250 EW and (ii) as an analytical grade pure chemical. In the experiment with the commercially available tebuconazole, a significant pH-dependent sorption onto the oxides was observed (decreasing sorption with increasing pH). The highest sorption was found for ferrihydrite due to its high specific surface area, followed by humic acids, birnessite, goethite and illite. No detectable sorption was found for calcite. The sorption of analytical grade tebuconazole on all selected minerals was significantly lower compared to the commercial product. The sorption was the highest for humic acids, followed by ferrihydrite and illite and almost negligible for goethite and birnessite without any pH dependence. Again, no sorption was observed for calcite. The differences in sorption of the commercially available and analytical grade tebuconazole can be attributed to the additives (e.g., solvents) present in the commercial product. This work proved the importance of soil mineralogy and composition of the commercially available pesticides on the behavior of tebuconazole in soils.

  13. Single Component Sorption-Desorption Test Experimental Design Approach Discussions

    SciTech Connect

    Phil WInston

    2011-09-01

    A task was identified within the fission-product-transport work package to develop a path forward for doing testing to determine behavior of volatile fission products behavior and to engage members of the NGNP community to advise and dissent on the approach. The following document is a summary of the discussions and the specific approaches suggested for components of the testing. Included in the summary isare the minutes of the conference call that was held with INL and external interested parties to elicit comments on the approaches brought forward by the INL participants. The conclusion was that an initial non-radioactive, single component test will be useful to establish the limits of currently available chemical detection methods, and to evaluated source-dispersion uniformity. In parallel, development of a real-time low-concentration monitoring method is believed to be useful in detecting rapid dispersion as well as desorption phenomena. Ultimately, the test cycle is expected to progress to the use of radio-traced species, simply because this method will allow the lowest possible detection limits. The consensus of the conference call was that there is no need for an in-core test because the duct and heat exchanger surfaces that will be the sorption target will be outside the main neutron flux and will not be affected by irradiation. Participants in the discussion and contributors to the INL approach were Jeffrey Berg, Pattrick Calderoni, Gary Groenewold, Paul Humrickhouse, Brad Merrill, and Phil Winston. Participants from outside the INL included David Hanson of General Atomics, Todd Allen, Tyler Gerczak, and Izabela Szlufarska of the University of Wisconsin, Gary Was, of the University of Michigan, Sudarshan Loyalka and Tushar Ghosh of the University of Missouri, and Robert Morris of Oak Ridge National Laboratory.

  14. SORPTION OF VOLATILE ORGANIC SOLVENTS FROM AQUEOUS SOLUTION ONTO SUBSURFACE SOLIDS

    EPA Science Inventory

    Sorption isotherms for tetrachloroethene on low-carbon subsurface core samples were linear to equilibrium solution concentrations of 2 mg L−1. Concentrations above this value produced pronounced curvature in the sorption isotherms. Sorption of tetrachloroethene, benzene, trichlor...

  15. SEDIMENT-ASSOCIATED REACTIONS OF AROMATIC AMINES: 1. ELUCIDATION OF SORPTION MECHANISMS

    EPA Science Inventory

    Sorption of aromatic amines to sediments and soils can occur by both reversible physical processes and irreversible chemical processes. To elucidate the significance of these sorption pathways, the sorption kinetics of aniline and pyridine were studied in resaturated pond sedimen...

  16. Application of green seaweed biomass for MoVI sorption from contaminated waters. Kinetic, thermodynamic and continuous sorption studies.

    PubMed

    Bertoni, Fernando A; Medeot, Anabela C; González, Juan C; Sala, Luis F; Bellú, Sebastián E

    2015-05-15

    Spongomorpha pacifica biomass was evaluated as a new sorbent for Mo(VI) removal from aqueous solution. The maximum sorption capacity was found to be 1.28×10(6)±1×10(4) mg kg(-1) at 20°C and pH 2.0. Sorption kinetics and equilibrium studies followed pseudo-first order and Langmuir adsorption isotherm models, respectively. FTIR analysis revealed that carboxyl and hydroxyl groups were mainly responsible for the sorption of Mo(VI). SEM images show that morphological changes occur at the biomass surface after Mo(VI) sorption. Activation parameters and mean free energies obtained with Dubinin-Radushkevich isotherm model demonstrate that the mechanism of sorption process was chemical sorption. Thermodynamic parameters demonstrate that the sorption process was spontaneous, endothermic and the driven force was entropic. The isosteric heat of sorption decreases with surface loading, indicating that S. pacifica has an energetically non-homogeneous surface. Experimental breakthrough curves were simulated by Thomas and modified dose-response models. The bed depth service time (BDST) model was employed to scale-up the continuous sorption experiments. The critical bed depth, Z0 was determined to be 1.7 cm. S.pacifica biomass showed to be a good sorbent for Mo(VI) and it can be used in continuous treatment of effluent polluted with molybdate ions.

  17. Shear dispersion in a capillary tube with a porous wall.

    PubMed

    Dejam, Morteza; Hassanzadeh, Hassan; Chen, Zhangxin

    2016-01-01

    An analytical expression is presented for the shear dispersion during solute transport in a coupled system comprised of a capillary tube and a porous medium. The dispersion coefficient is derived in a capillary tube with a porous wall by considering an accurate boundary condition, which is the continuity of concentration and mass flux, at the interface between the capillary tube and porous medium. A comparison of the obtained results with that in a non-coupled system identifies three regimes including: diffusion-dominated, transition, and advection-dominated. The results reveal that it is essential to include the exchange of solute between the capillary tube and porous medium in development of the shear dispersion coefficient for the last two regimes. The resulting equivalent transport equation revealed that due to mass transfer between the capillary tube and the porous medium, the dispersion coefficient is decreased while the effective velocity in the capillary tube increases. However, a larger effective advection term leads to faster breakthrough of a solute and enhances mass delivery to the porous medium as compared with the classical double-porosity model with a non-coupled dispersion coefficient. The obtained results also indicate that the finite porous medium gives faster breakthrough of a solute as compared with the infinite one. These results find applications in solute transport in porous capillaries and membranes.

  18. Arsenic sorption onto laterite iron concretions: temperature effect.

    PubMed

    Partey, Frederick; Norman, David; Ndur, Samuel; Nartey, Robert

    2008-05-15

    We investigated arsenate and arsenite sorption onto laterite iron concretions (LIC) to test its suitability for use in the low-tech treatment of arsenic-bearing drinking water. Batch experiments on crushed LIC from Prestea, Ghana were conducted at a series of temperatures, ionic strengths, and pHs. The point of zero net charge on laterite iron concretion was determined by potentiometric titrations yielding an average pHp(ZNC) around 8.64. Experiments show that sorption capacity for both arsenite and arsenate increase with temperature. The equilibrium sorption capacity for arsenite was larger than that for arsenate over the 25 to 60 degrees C temperature range. A Langmuir model satisfactorily fits the arsenite and arsenate sorption isotherm data. Both arsenite and arsenate sorbed over the pH range of natural waters. Arsenite sorption increases with increasing solution pH to a maximum at pH 7, then decreases with further increase in solution pH. Arsenate sorption, on the other hand, shows little change with increasing solution pH. Increasing solution ionic strength 10-fold results in a slight increase in sorption. Ionic strength experiments show that an inner-sphere sorption mechanism is responsible for As (V) sorption on LIC, while As (III) sorption is by an outer-sphere mechanism. Gibbs free energy (DeltaG degrees) for arsenite and arsenate sorption onto LIC was calculated from Langmuir isotherms; the negative values agree with reaction spontaneity. The positive values of the standard enthalpy (DeltaH degrees) show the endothermic nature of arsenite and arsenate sorption onto LIC. Positive entropy (DeltaS degrees) values suggest the affinity of LIC for the arsenic species in solution. Analysis of the arsenic sorption data suggests that LIC can be used for low-tech natural-materials arsenic water treatment. Laterite iron concretions have a number of advantages for this use over commercial materials, including the ability to remove arsenic from waters with a wide

  19. Studies of anions sorption on natural zeolites.

    PubMed

    Barczyk, K; Mozgawa, W; Król, M

    2014-12-10

    This work presents results of FT-IR spectroscopic studies of anions-chromate, phosphate and arsenate - sorbed from aqueous solutions (different concentrations of anions) on zeolites. The sorption has been conducted on natural zeolites from different structural groups, i.e. chabazite, mordenite, ferrierite and clinoptilolite. The Na-forms of sorbents were exchanged with hexadecyltrimethylammonium cations (HDTMA(+)) and organo-zeolites were obtained. External cation exchange capacities (ECEC) of organo-zeolites were measured. Their values are 17mmol/100g for chabazite, 4mmol/100g for mordenite and ferrierite and 10mmol/100g for clinoptilolite. The used initial inputs of HDTMA correspond to 100% and 200% ECEC of the minerals. Organo-modificated sorbents were subsequently used for immobilization of mentioned anions. It was proven that aforementioned anions' sorption causes changes in IR spectra of the HDTMA-zeolites. These alterations are dependent on the kind of anions that were sorbed. In all cases, variations are due to bands corresponding to the characteristic Si-O(Si,Al) vibrations (occurring in alumino- and silicooxygen tetrahedra building spatial framework of zeolites). Alkylammonium surfactant vibrations have also been observed. Systematic changes in the spectra connected with the anion concentration in the initial solution have been revealed. The amounts of sorbed CrO4(2-), AsO4(3-) and PO4(3-) ions were calculated from the difference between their concentrations in solutions before (initial concentration) and after (equilibrium concentration) sorption experiments. Concentrations of anions were determined by spectrophotometric method.

  20. Thermodynamics of imidacloprid sorption in Croatian soils

    NASA Astrophysics Data System (ADS)

    Milin, Čedomila; Broznic, Dalibor

    2015-04-01

    Neonicotinoids are increasingly replacing the organophosphate and methylcarbamate acetylcholinesterase inhibitors which are losing their effectiveness because of selection for resistant pest populations. Imidacloprid is the most important neonicotinoid with low soil persistence, high insecticidal potency and relatively low mammalian toxicity. In Croatia, imidacloprid is most commonly used in olive growing areas, including Istria and Kvarner islands, as an effective means of olive fruit fly infestation control. Sorption-desorption behavior of imidacloprid in six soils collected from five coastal regions in Croatia at 20, 30 and 40°C was investigated using batch equilibrium technique. Isothermal data were applied to Freundlich, Langmuir and Temkin equation, and the thermodynamic parameters ΔH°, ΔG°, ΔS° were calculated. The sorption isotherm curves were of non-linear and may be classified as L-type suggesting a relatively high sorption capacity for imidacloprid. Our results showed that the KFsor values decreased for all the tested soils as the temperature increases, indicating that the temperature strongly influence the sorption. Values of ΔG° were negative (-4.65 to -2.00 kJ/mol) indicating that at all experimental temperatures the interactions of imidacloprid with soils were spontaneous process. The negative and small ΔH° values (-19.79 to -8.89 kJ/mol) were in the range of weak forces, such as H-bonds, consistent with interactions and par¬titioning of the imidacloprid molecules into soil organic matter. The ΔS° values followed the range of -57.12 to -14.51 J/molK, suggesting that imidacloprid molecules lose entropy during transition from the solution phase to soil surface. It was found that imidacloprid desorption from soil was concentration and temperature dependent, i.e. at lower imidacloprid concentrations and temperature, lower desorption percentage occurred. Desorption studies revealed that hysteretic behavior under different temperature

  1. Integrated Heat Switch/Oxide Sorption Compressor

    NASA Technical Reports Server (NTRS)

    Bard, Steven

    1989-01-01

    Thermally-driven, nonmechanical compressor uses container filled with compressed praseodymium cerium oxide powder (PrCeOx) to provide high-pressure flow of oxygen gas for driving closed-cycle Joule-Thomson-expansion refrigeration unit. Integrated heat switch/oxide sorption compressor has no moving parts except check valves, which control flow of oxygen gas between compressor and closed-cycle Joule-Thomson refrigeration system. Oxygen expelled from sorbent at high pressure by evacuating heat-switch gap and turning on heater.

  2. MEMS ion-sorption high vacuum pump

    NASA Astrophysics Data System (ADS)

    Grzebyk, T.; Knapkiewicz, P.; Szyszka, P.; Gorecka-Drzazga, A.; Dziuban, J. A.

    2016-11-01

    In the article a miniature MEMS-type ion-sorption vacuum pump has been presented. The influence of electric and magnetic field, as well as horizontal and vertical dimensions of the micropump and type of material used for electrodes on the pump properties has been investigated. It has been found that the micropump works efficiently as long as the magnetic field is higher than 0.3 T, and pumping cell is larger than 1x1x1 mm3. The pump allows generating vacuum at the level of 10-7-10-9 hPa in 100 mm3 volume.

  3. Modeling of Convective-Stratiform Precipitation Processes: Sensitivity to Partitioning Methods and Numerical Advection Schemes

    NASA Technical Reports Server (NTRS)

    Lang, Steve; Tao, W.-K.; Simpson, J.; Ferrier, B.; Einaudi, Franco (Technical Monitor)

    2001-01-01

    Six different convective-stratiform separation techniques, including a new technique that utilizes the ratio of vertical and terminal velocities, are compared and evaluated using two-dimensional numerical simulations of a tropical [Tropical Ocean Global Atmosphere Coupled Ocean-Atmosphere Response Experiment (TOGA COARE)] and midlatitude continental [Preliminary Regional Experiment for STORM-Central (PRESTORM)] squall line. The simulations are made using two different numerical advection schemes: 4th order and positive definite advection. Comparisons are made in terms of rainfall, cloud coverage, mass fluxes, apparent heating and moistening, mean hydrometeor profiles, CFADs (Contoured Frequency with Altitude Diagrams), microphysics, and latent heating retrieval. Overall, it was found that the different separation techniques produced results that qualitatively agreed. However, the quantitative differences were significant. Observational comparisons were unable to conclusively evaluate the performance of the techniques. Latent heating retrieval was shown to be sensitive to the use of separation technique mainly due to the stratiform region for methods that found very little stratiform rain. The midlatitude PRESTORM simulation was found to be nearly invariant with respect to advection type for most quantities while for TOGA COARE fourth order advection produced numerous shallow convective cores and positive definite advection fewer cells that were both broader and deeper penetrating above the freezing level.

  4. Estimation of the advection effects induced by surface heterogeneities in the surface energy budget

    NASA Astrophysics Data System (ADS)

    Cuxart, Joan; Wrenger, Burkhard; Martínez-Villagrasa, Daniel; Reuder, Joachim; Jonassen, Marius O.; Jiménez, Maria A.; Lothon, Marie; Lohou, Fabienne; Hartogensis, Oscar; Dünnermann, Jens; Conangla, Laura; Garai, Anirban

    2016-07-01

    The effect of terrain heterogeneities in one-point measurements is a continuous subject of discussion. Here we focus on the order of magnitude of the advection term in the equation of the evolution of temperature as generated by documented terrain heterogeneities and we estimate its importance as a term in the surface energy budget (SEB), for which the turbulent fluxes are computed using the eddy-correlation method. The heterogeneities are estimated from satellite and model fields for scales near 1 km or broader, while the smaller scales are estimated through direct measurements with remotely piloted aircraft and thermal cameras and also by high-resolution modelling. The variability of the surface temperature fields is not found to decrease clearly with increasing resolution, and consequently the advection term becomes more important as the scales become finer. The advection term provides non-significant values to the SEB at scales larger than a few kilometres. In contrast, surface heterogeneities at the metre scale yield large values of the advection, which are probably only significant in the first centimetres above the ground. The motions that seem to contribute significantly to the advection term in the SEB equation in our case are roughly those around the hectometre scales.

  5. Local and nonlocal advected invariants and helicities in magnetohydrodynamics and gas dynamics I: Lie dragging approach

    NASA Astrophysics Data System (ADS)

    Webb, G. M.; Dasgupta, B.; McKenzie, J. F.; Hu, Q.; Zank, G. P.

    2014-03-01

    In this paper advected invariants and conservation laws in ideal magnetohydrodynamics (MHD) and gas dynamics are obtained using Lie dragging techniques. There are different classes of invariants that are advected or Lie dragged with the flow. Simple examples are the advection of the entropy S (a 0-form), and the conservation of magnetic flux (an invariant 2-form advected with the flow). The magnetic flux conservation law is equivalent to Faraday's equation. The gauge condition for the magnetic helicity to be advected with the flow is determined. Different variants of the helicity in ideal fluid dynamics and MHD including: fluid helicity, cross helicity and magnetic helicity are investigated. The fluid helicity conservation law and the cross-helicity conservation law in MHD are derived for the case of a barotropic gas. If the magnetic field lies in the constant entropy surface, then the gas pressure can depend on both the entropy and the density. In these cases the conservation laws are local conservation laws. For non-barotropic gases, we obtain nonlocal conservation laws for fluid helicity and cross helicity by using Clebsch variables. These nonlocal conservation laws are the main new results of the paper. Ertel's theorem and potential vorticity, the Hollman invariant, and the Godbillon-Vey invariant for special flows for which the magnetic helicity is zero are also discussed.

  6. Advection of Microphysical Scalars in Terminal Area Simulation System (TASS)

    NASA Technical Reports Server (NTRS)

    Ahmad, Nashat N.; Proctor, Fred H.

    2011-01-01

    The Terminal Area Simulation System (TASS) is a large eddy scale atmospheric flow model with extensive turbulence and microphysics packages. It has been applied successfully in the past to a diverse set of problems ranging from prediction of severe convective events (Proctor et al. 2002), tracking storms and for simulating weapons effects such as the dispersion and fallout of fission debris (Bacon and Sarma 1991), etc. More recently, TASS has been used for predicting the transport and decay of wake vortices behind aircraft (Proctor 2009). An essential part of the TASS model is its comprehensive microphysics package, which relies on the accurate computation of microphysical scalar transport. This paper describes an evaluation of the Leonard scheme implemented in the TASS model for transporting microphysical scalars. The scheme is validated against benchmark cases with exact solutions and compared with two other schemes - a Monotone Upstream-centered Scheme for Conservation Laws (MUSCL)-type scheme after van Leer and LeVeque's high-resolution wave propagation method. Finally, a comparison between the schemes is made against an incident of severe tornadic super-cell convection near Del City, Oklahoma.

  7. Kinetics and reversibility of micropollutant sorption in sludge.

    PubMed

    Barret, Maialen; Carrère, Hélène; Patau, Mathieu; Patureau, Dominique

    2011-10-01

    The fate of micropollutants throughout wastewater treatment systems is highly dependent on their sorption interactions with sludge matter. In this study, both the sorption and desorption kinetics of polycyclic aromatic hydrocarbons (PAHs) in activated sludge were shown to be very rapid in comparison to biodegradation kinetics. It was concluded that PAH transfer does not limit their biodegradation and that their fate is governed by the sorption/desorption equilibrium state. The effect of contact time between sludge and PAHs was also investigated. It was shown that aging did not influence the sorption/desorption equilibrium although PAH losses during aging suggest that sequestration phenomena had occurred. This implies that for PAH sorption assessment within treatment processes there is no need to include a contact time dimension. As a consequence, thanks to an innovative approach taking into account sorption equilibria and sequestration, this work has demonstrated that studies in the literature which, in main, deal with micropollutant sorption in sewage sludge with only a short contact time can be extrapolated to real systems in which sorption, desorption and aging occur.

  8. Dynamic vapor sorption isotherms of medium grain rice varieties

    Technology Transfer Automated Retrieval System (TEKTRAN)

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

  9. Column Chromatography To Obtain Organic Cation Sorption Isotherms.

    PubMed

    Jolin, William C; Sullivan, James; Vasudevan, Dharni; MacKay, Allison A

    2016-08-02

    Column chromatography was evaluated as a method to obtain organic cation sorption isotherms for environmental solids while using the peak skewness to identify the linear range of the sorption isotherm. Custom packed HPLC columns and standard batch sorption techniques were used to intercompare sorption isotherms and solid-water sorption coefficients (Kd) for four organic cations (benzylamine, 2,4-dichlorobenzylamine, phenyltrimethylammonium, oxytetracycline) with two aluminosilicate clay minerals and one soil. A comparison of Freundlich isotherm parameters revealed isotherm linearity or nonlinearity was not significantly different between column chromatography and traditional batch experiments. Importantly, skewness (a metric of eluting peak symmetry) analysis of eluting peaks can establish isotherm linearity, thereby enabling a less labor intensive means to generate the extensive data sets of linear Kd values required for the development of predictive sorption models. Our findings clearly show that column chromatography can reproduce sorption measures from conventional batch experiments with the benefit of lower labor-intensity, faster analysis times, and allow for consistent sorption measures across laboratories with distinct chromatography instrumentation.

  10. Sorption of humic acids and alpha-endosulfan by clayminerals

    SciTech Connect

    Hengpraprom, S.; Lee, C.M.; Coates, R.T.

    2005-02-18

    Sorption of alpha-endosulfan by kaolinite andmontmorillonite alone and in the presence of sorbed and dissolved humicacid (HA) was investigated (pH 8 and 25oC). Three types of HA, Elliotsoil HA (EHA), Peat HA (PHA), and Summit Hill HA (SHHA), were used torepresent typical humic substances found in soils. For sorption of HA byeither mineral, Freundlich sorption coefficient (Kf) values appeared todecrease in the order of EHA>PHA>SHHA, which followedincreasing polarity (expressed as the O/C atomic ratio) and decreasingpercent-carbon content. For both clays, sorption of alpha-endosulfan bythe HA mineral complex was greater than for sorption by the clay alone.Sorption of alpha-endosulfan by the HA mineral complexes followed thesame order as the Kf of the HAs (EHA>PHA>SHHA). Based on theamount of HA adsorbed by each mineral, organic carbon partitioncoefficients (KOC) were determined for sorption of alpha-endosulfan bytwo of the HA mineral complexes. The value of KOC for alpha-endosulfansorption was greater for kaolinite EHA than kaolinite SHHA. However, theopposite trend was found with the montmorillonite HA complexes.Montmorillonite appeared to sorb alpha-endosulfan and/or HA with higheraffinity than kaolinite, which likely is due to its 2:1 layer structureand higher surface area. Sorption of endosulfan diol, a hydrolysisproduct, by the minerals was much less than the parentpesticide.

  11. Nickel sorption to goethite and montmorillonite in presence of citrate.

    PubMed

    Marcussen, Helle; Holm, Peter E; Strobel, Bjarne W; Hansen, Hans Chr B

    2009-02-15

    Mobility and bioavailability of nickel (Ni) in soil strongly depends on the interaction between Ni(II), ligands, and sorbents like organic matter and minerals. Sorption of Ni(II) and Ni(II)-citrate complexes to goethite and montmorillonite was examined in batch experiments with and without citrate as ligand in the pH range pH 4-7.5. Without citrate, montmorillonite shows higher Ni sorption than goethite. Citrate strongly decreases Ni sorption to montmorillonite; in presence of 100 microM citrate goethite becomes a stronger Ni sorbent than montmorillonite. Ni and citrate sorption was modeled successfully using the diffuse double layer model with the following reactions: Goethite: 3 [triple bond]FeOH + Citrate(3-) + 3H+ <=> [triple bond] Fe3Citrate + 3H2O, [triple bond]FeOH + Ni2+ <=> [triple bond] FeONi + H+ and 2 [triple bond] FeOH + Citrate(3)- + Ni2+ <=> [triple bond] FeONiCitrate(2-) + H+. Montmorillonite: 2X- + Ni2+ <=> X2Ni and [triple bond] AIOH + Ni2+ <=> AIONi+ + H+. Sorption of Ni to a mixture of goethite and montmorillonite could be calculated by use of reactions and constants for the monomineral systems. Without citrate, the sorbed amount of Ni per mass unit in the mixture can be found as a simple average of sorption to the two single sorbents, while in presence of citrate Ni sorption to montmorillonite is strongly influenced by citrate sorption to goethite.

  12. Status report on SIRS: sorption information retrieval system

    SciTech Connect

    Hostetler, D.D.; Serne, R.J.; Baldwin, A.J.; Petrie, G.M.

    1980-11-01

    Two major uses were identified for the Sorption Information Retrieval System: (1) to aid geochemists in the elucidation of sorption mechanisms; and (2) to aid safety assessment modelers in selection of Kds for any given scenerio. Other benefits such as providing an auditable vehicle for the Kd selection were also discussed.

  13. LEAD SORPTION ON RUTHENIUM OXIDE: A MACROSCOPIC AND SPECTROSCOPIC STUDY

    EPA Science Inventory

    Metal oxide phases play an important role in governing the sorption and desorption mechanisms of metals in water, soils, and sediments. Many researchers have examined the efficiency of Pb sorption on Mn, Fe, Al, Ti, and Si oxide surfaces. Most studies concluded that adsorption ...

  14. LEAD SORPTION ON RUTHENIUM OXIDE: A MACROSCOPIC AND SPECTROSCOPIC STUDY

    EPA Science Inventory

    The sorption and desorption of Pb on RuO2 xH2O were examined kinetically and thermodynamically via spectroscopic and macroscopic investigations. X-ray absorption spectroscopy (XAS) was employed to determine the sorption mechanism with regard to identity of nearest atomic neighbo...

  15. Nitrate sorption and desorption in biochars from fast pyrolysis

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Increasing the nitrate (NO3-) sorption capacity of Midwestern US soils has the potential to reduce nitrate leaching to ground water and reduce the extent of the hypoxia zone in the Gulf of Mexico. The objective of this study was to determine the sorption and desorption capacity of non-activated and ...

  16. Liquid Chromatography Applications to Determination of Sorption on Aquifer Materials

    DTIC Science & Technology

    1989-11-01

    1985) observed a similar factor between column and batch sorption coefficients for nematicides on soils. They noted that this may be a consequence of...Development Branch, Norris, TN 37828 (1985). J. N. Bilkert and P. S. C. Rao. Sorption and leaching of three non-fumigant nematicides in soils. J

  17. [Sorption of nitrobenzene to anionic surfactant modified layered double hydroxides].

    PubMed

    Xia, Yan; Zhu, Run-Liang; Tao, Qi; Liu, Han-Yang

    2013-01-01

    Sodium dodecyl sulfate (SDS) modified MgAl layered double hydroxides (LDHs) were synthesized at different surfactant concentrations (0.5-2.0 TAEC) by the co-precipitation method. The LDH-DS samples obtained were characterized by powder X-ray diffraction and FT-IR spectroscopy. The results showed that SDS was successfully intercalated into the interlayer of the LDH, and the basal spacing was expanded from 0.80 nm to 3.98 nm. The intercalated SDS was considered consistent with a paraffin bilayers arrangement. The sorption of nitrobenzene on LDH-DS was examined, and the results showed that linear model could fit the sorption isotherms well (R2 > 0.99), which implied a partitioning sorption process. The sorption coefficient of nitrobenzene (K(d)) on LDH-DS was positively related to the DS - loading amount, but the organic carbon content normalized sorption coefficient of nitrobenzene (K(oc)) was shown to remain relatively constant. The sorption thermodynamics results showed that the sorption of nitrobenzene on LDH-DS was an endothermic process, and the increase of entropy was the driving force for the sorption process.

  18. Sorption and desorption of indaziflam degradates in several agricultural soils

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Processes regulating pesticide fate in the environment are influenced by the physicochemical properties of pesticides and soils. Sorption-desorption are important processes as they regulate movement of pesticides in soil. Although sorption-desorption is widely studied for herbicides, studies involvi...

  19. [Study on the sorption of 4-octylphenol by freshwater algae].

    PubMed

    Peng, Zhang-e; Yang, Hai-zhen; Wang, Bei-bei; Deng, Nan-sheng

    2009-12-01

    The sorption of 4-octylphenol (4-OP) by two freshwater algae was investigated. Results showed that the sorption of 4-octylphenol by algae was obvious and quick, where 20% of initial 4-OP (2 mg/L) was accumulated by Chlorella vulgaris (CV) and 46% initial 4-OP (2 mg/L) was accumulated by Anabaena cylindrical (AC) after 5 min incubation. The sorption got equilibrium at 1 h after incubation. Langmuir sorption model was good appropriate type for this sorption. The effect of pH value on CV sorption was obvious than that on AC sorption. The sorption capacity of the biomass of two algae increased with the decrease of pH value. The analyzing of interaction between algae and 4-octylphenol was performed by fluorescence spectrum. Results showed that the algae could weaker the fluorescence spectrum intensity of 4-octylphenol and result in red shift of the maximum absorbance wavelength of mixture solution. Based on the results, it was speculated that algae bound with the contamination could use the near UV region of solar radiation and induced the contamination degradation.

  20. Competitive sorption of heavy metals by water hyacinth roots.

    PubMed

    Zheng, Jia-Chuan; Liu, Hou-Qi; Feng, Hui-Min; Li, Wen-Wei; Lam, Michael Hon-Wah; Lam, Paul Kwan-Sing; Yu, Han-Qing

    2016-12-01

    Heavy metal pollution is a global issue severely constraining aquaculture practices, not only deteriorating the aquatic environment but also threatening the aquaculture production. One promising solution is adopting aquaponics systems where a synergy can be established between aquaculture and aquatic plants for metal sorption, but the interactions of multiple metals in such aquatic plants are poorly understood. In this study, we investigated the absorption behaviors of Cu(II) and Cd(II) in water by water hyacinth roots in both single- and binary-metal systems. Cu(II) and Cd(II) were individually removed by water hyacinth roots at high efficiency, accompanied with release of protons and cations such as Ca(2+) and Mg(2+). However, in a binary-metal arrangement, the Cd(II) sorption was significantly inhibited by Cu(II), and the higher sorption affinity of Cu(II) accounted for its competitive sorption advantage. Ionic exchange was identified as a predominant mechanism of the metal sorption by water hyacinth roots, and the amine and oxygen-containing groups are the main binding sites accounting for metal sorption via chelation or coordination. This study highlights the interactive impacts of different metals during their sorption by water hyacinth roots and elucidates the underlying mechanism of metal competitive sorption, which may provide useful implications for optimization of phytoremediation system and development of more sustainable aquaculture industry.

  1. Mixed-Gas Sorption Joule-Thomson Refrigerator

    NASA Technical Reports Server (NTRS)

    Jones, Jack A.; Petrick, S. Walter; Bard, Steven

    1991-01-01

    Proposed mixed-gas sorption Joule-Thomson refrigerator provides cooling down to temperature of 70 K. Includes only one stage and no mechanical compressor. Simpler, operates without vibrating, and consumes less power in producing same amount of cooling. Same sorption principle of operation applicable in compressor that chemisorbs oxygen or hydrogen from mixture with helium, neon, and/or other nonreactive gases.

  2. Using Weighted Least Squares Regression for Obtaining Langmuir Sorption Constants

    Technology Transfer Automated Retrieval System (TEKTRAN)

    One of the most commonly used models for describing phosphorus (P) sorption to soils is the Langmuir model. To obtain model parameters, the Langmuir model is fit to measured sorption data using least squares regression. Least squares regression is based on several assumptions including normally dist...

  3. Sorption mechanisms of metals to graphene oxide

    NASA Astrophysics Data System (ADS)

    Showalter, Allison R.; Duster, Thomas A.; Szymanowski, Jennifer E. S.; Na, Chongzheng; Fein, Jeremy B.; Bunker, Bruce A.

    2016-05-01

    Environmental toxic metal contamination remediation and prevention is an ongoing issue. Graphene oxide is highly sorptive for many heavy metals over a wide pH range under different ionic strength conditions. We present x-ray absorption fine structure (XAFS) spectroscopy results investigating the binding environment of Pb(II), Cd(II) and U(VI) ions onto multi-layered graphene oxide (MLGO). Analysis indicates that the dominant sorption mechanism of Pb to MLGO changes as a function of pH, with increasing inner sphere contribution as pH increases. In contrast, the sorption mechanism of Cd to MLGO remains constant under the studied pH range. This adsorption mechanism is an electrostatic attraction between the hydrated Cd+2 ion and the MLGO surface. The U(VI), present as the uranyl ion, changes only subtly as a function of pH and is bound to the surface via an inner sphere bond. Knowledge of the binding mechanism for each metal is necessary to help in optimizing environmental remediation or prevention in filtration systems.

  4. Zn Isotope Fractionation during Sorption onto Kaolinite.

    PubMed

    Guinoiseau, Damien; Gélabert, Alexandre; Moureau, Julien; Louvat, Pascale; Benedetti, Marc F

    2016-02-16

    In this study, we quantify zinc isotope fractionation during its sorption onto kaolinite, by performing experiments under various pH, ionic strength, and total Zn concentrations. A systematic enrichment in heavy Zn isotopes on the surface of kaolinite was measured, with Δ(66)Znadsorbed-solution ranging from 0.11‰ at low pH and low ionic strength to 0.49‰ at high pH and high ionic strength. Both the measured Zn concentration and its isotopic ratio are correctly described using a thermodynamic sorption model that considers two binding sites: external basal surfaces and edge sites. Based on this modeling approach, two distinct Zn isotopic fractionation factors were calculated: Δ(66)Znadsorbed-solution = 0.18 ± 0.06‰ for ion exchange onto basal sites, and Δ(66)Znadsorbed-solution = 0.49 ± 0.06‰ for specific complexation onto edge sites. These two distinct factors indicate that Zn isotope fractionation is dominantly controlled by the chemical composition of the solution (pH, ionic strength).

  5. Effect of humic acid on sorption of technetium by alumina.

    PubMed

    Kumar, S; Rawat, N; Kar, A S; Tomar, B S; Manchanda, V K

    2011-09-15

    Sorption of technetium by alumina has been studied in absence as well as in presence of humic acid using (95)Tc(m) as a tracer. Measurements were carried out at fixed ionic strength (0.1M NaClO(4)) under varying pH (3-10) as well as redox (aerobic and reducing anaerobic) conditions. Under aerobic conditions, negligible sorption of technetium was observed onto alumina both in absence and in presence of humic acid. However, under reducing conditions (simulated with [Sn(II)] = 10(-6)M), presence of humic acid enhanced the sorption of technetium in the low pH region significantly and decreased at higher pH with respect to that in absence of humic acid. Linear additive as well as surface complexation modeling of Tc(IV) sorption in presence of humic acid indicated the predominant role of sorbed humic acid in deciding technetium sorption onto alumina.

  6. Sorption of perfluoroalkyl substances to two types of minerals.

    PubMed

    Hellsing, Maja S; Josefsson, Sarah; Hughes, Arwel V; Ahrens, Lutz

    2016-09-01

    The sorption of perfluoroalkyl substances (PFASs) was investigated for two model soil mineral surfaces, alumina (Al2O3) and silica (SiO2), on molecular level using neutron scattering. The PFASs were selected (i.e. perfluorohexanoic acid (PFHxA), perfluorooctanoic acid (PFOA), perfluorononanoic acid (PFNA), and perfluorooctane sulfonic acid (PFOS)) to examine the role of hydrophobic chain length and hydrophilic functional group on their sorption behaviour. All four PFASs were found to sorb to alumina surface (positively charged) forming a hydrated layer consisting of 50% PFASs. The PFAS solubility limit, which decrease with chain length, was found to strongly influence the sorption behaviour. The sorbed PFAS layer could easily be removed by gentle rinsing with water, indicating release upon rainfall in the environment. No sorption was observed for PFOA and PFOS at silica surface (negatively charged), showing electrostatic interaction being the driving force in the sorption process.

  7. First-Order Hyperbolic System Method for Time-Dependent Advection-Diffusion Problems

    NASA Technical Reports Server (NTRS)

    Mazaheri, Alireza; Nishikawa, Hiroaki

    2014-01-01

    A time-dependent extension of the first-order hyperbolic system method for advection-diffusion problems is introduced. Diffusive/viscous terms are written and discretized as a hyperbolic system, which recovers the original equation in the steady state. The resulting scheme offers advantages over traditional schemes: a dramatic simplification in the discretization, high-order accuracy in the solution gradients, and orders-of-magnitude convergence acceleration. The hyperbolic advection-diffusion system is discretized by the second-order upwind residual-distribution scheme in a unified manner, and the system of implicit-residual-equations is solved by Newton's method over every physical time step. The numerical results are presented for linear and nonlinear advection-diffusion problems, demonstrating solutions and gradients produced to the same order of accuracy, with rapid convergence over each physical time step, typically less than five Newton iterations.

  8. Tomography-based monitoring of isothermal snow metamorphism under advective conditions

    NASA Astrophysics Data System (ADS)

    Ebner, P. P.; Schneebeli, M.; Steinfeld, A.

    2015-07-01

    Time-lapse X-ray microtomography was used to investigate the structural dynamics of isothermal snow metamorphism exposed to an advective airflow. The effect of diffusion and advection across the snow pores on the snow microstructure were analysed in controlled laboratory experiments and possible effects on natural snowpacks discussed. The 3-D digital geometry obtained by tomographic scans was used in direct pore-level numerical simulations to determine the effective permeability. The results showed that isothermal advection with saturated air have no influence on the coarsening rate that is typical for isothermal snow metamorphism. Isothermal snow metamorphism is driven by sublimation deposition caused by the Kelvin effect and is the limiting factor independently of the transport regime in the pores.

  9. Variational optimization analysis of temperature and moisture advection in a severe storm environment

    NASA Technical Reports Server (NTRS)

    Mcfarland, M. J.

    1975-01-01

    Horizontal wind components, potential temperature, and mixing ratio fields associated with a severe storm environment in the south central U.S. were analyzed from synoptic upper air observations with a nonhomogeneous, anisotropic weighting function. Each data field was filtered with variational optimization analysis techniques. Variational optimization analysis was also performed on the vertical motion field and was used to produce advective forecasts of the potential temperature and mixing ratio fields. Results show that the dry intrusion is characterized by warm air, the advection of which produces a well-defined upward motion pattern. A corresponding downward motion pattern comprising a deep vertical circulation in the warm air sector of the low pressure system was detected. The axes alignment of maximum dry and warm advection with the axis of the tornado-producing squall line also resulted.

  10. Small-scale particle advection, manipulation and mixing: beyond the hydrodynamic scale.

    PubMed

    Straube, Arthur V

    2011-05-11

    In this paper we discuss the problems of particle advection, manipulation and mixing at small scales. We start by considering reaction-advection-diffusion systems with the focus on mixing. We show how mixing advection affects the processes of reaction-diffusion and discuss mixing-induced instabilities. Further, we consider the problem of particle manipulation and discuss collective effects in systems comprising solid and compressible particles. We particularly discuss mechanisms of particle entrapment, the role of compressibility in the dynamics of bubbly liquids and nonequilibrium colloidal explosion. Finally, we address two issues related to the problem of wetting. First, we study the role of contact line motion for a sessile droplet (or a bubble) on an oscillating substrate. Second, we discuss an instability of a thin film leading to the formation of a fractal structure of droplets.

  11. Degradation and sorption of atrazine, hexazinone and procymidone in coastal sand aquifer media.

    PubMed

    Pang, Liping; Close, Murray; Flintoft, Mark

    2005-02-01

    possible explanation for these observations is that ionic atrazine is bound to oppositely charged ionic oxides, and ionic oxides have less effect on the sorption of the non-ionic procymidone. The significant tailing in the pesticide breakthrough curves (BTCs) in comparison with the bromide BTC, together with model-simulated results, suggests that the transport of the pesticides was under chemical non-equilibrium conditions with R values that were less than their equivalent values predicted using the batch equilibrium isothermal data. As a result of non-linear kinetic sorption, retardation factors of the pesticides in groundwater systems would not be constant and will decrease with decreasing pesticide concentrations and increasing flow velocities. Hence, the use of equilibrium isotherm data will probably over-predict the sorption of pesticides in groundwater systems. Rhodamine WT, a commonly used groundwater tracer, was significantly retarded (R = 5.48) and its BTC was much more spread out than the bromide BTC. Therefore, it would not be a good tracer for the indication of groundwater flow velocity and dispersion for the coastal sand aquifer system. In contrast to some aquifer media, the dye tracer was unsuitable as a marker of the appearance of atrazine in a coastal sand aquifer system.

  12. Analytical power series solution for contaminant transport with hyperbolic asymptotic distance-dependent dispersivity

    NASA Astrophysics Data System (ADS)

    Chen, Jui-Sheng; Ni, Chuen-Fa; Liang, Ching-Ping; Chiang, Chen-Chung

    2008-11-01

    SummaryA hyperbolic asymptotic function, which characterizes that the dispersivity initially increases with travel distance and eventually reaches an asymptotic value at long travel distance, is adopted and incorporated into the general advection-dispersion equation for describing scale-dependent solute transport in porous media in this study. An analytical technique for solving advection-dispersion equation with hyperbolic asymptotic distance-dependent dispersivity is presented. The analytical solution is derived by applying the extended power series method coupling with the Laplace transform. The developed analytical solution is compared with the corresponding numerical solution to evaluate its accuracy. Results demonstrate that the breakthrough curves at different locations obtained from the derived power series solution agree closely with those from the numerical solution. Moreover, breakthrough curves obtained from the hyperbolic asymptotic dispersivity model are compared with those obtained from the constant dispersivity model to scrutinize the relationship of the transport parameters derived by Mishra and Parker [Mishra, S., Parker, J.C., 1990. Analysis of solute transport with a hyperbolic scale dependent dispersion model. Hydrol. Proc. 4(1), 45-47]. The result reveals that the relationship postulated by Mishra and Parker [Mishra, S., Parker, J.C., 1990. Analysis of solute transport with a hyperbolic scale dependent dispersion model. Hydrol. Proc. 4(1), 45-47] is only valid under conditions with small dimensionless asymptotic dispersivity ( aa) and large dimensionless characteristic half length ( b).

  13. Sorption of polycyclic aromatic hydrocarbons (PAHs) on glass surfaces.

    PubMed

    Qian, Yuan; Posch, Tjorben; Schmidt, Torsten C

    2011-02-01

    Sorption of polycyclic aromatic hydrocarbons (PAHs) to glass commonly used in laboratories was studied. Sorption coefficients (Kd) of five selected PAHs to borosilicate glass surfaces were measured using column chromatography. A linear relationship between log Kd and the corresponding water solubility of the subcooled liquid (log Sw) of the investigated PAHs was observed. Based on the determined sorption coefficients our data revealed that mass loss caused by sorption on glass walls strongly depends on the ratio of solution volume to contacted surface area (V/S). The influence of solution chemistry such as ionic strength, solution pH, presence of cosolvent, and the influence of temperature on the sorption process were investigated. In the presence of ionic strength, sorption coefficients concurrently increased but less than a factor of 2 up to 0.005 M calcium chloride concentration. However, further increasing ionic strength had no influence on Kd. The cosolvent reduced sorption at a concentration of methanol in water above 0.5% (v/v); however, for benzo[a]pyrene even with 10% (v/v) methanol the mass loss would be still higher than 10% (with a V/S ratio less than 0.25). Significant effects of the solution pH and temperature were not observed. These results suggest that van der Waal's forces dominate the sorption process. In the analysis of highly hydrophobic PAHs in aqueous samples, mass loss due to sorption on glass walls should be accounted for in the final result if untreated glass is used. The presented relationship between log Kd and log Sw may help to decide if such a correction is necessary. Furthermore, the frequently used silanization of glass surfaces may not be sufficient to suppress sorption for large PAHs.

  14. Surface Complexation Modeling of Organic Acid Sorption to Goethite.

    PubMed

    Evanko; Dzombak

    1999-06-15

    Surface complexation modeling was performed using the Generalized Two-Layer Model for a series of low molecular weight organic acids. Sorption of these organic acids to goethite was investigated in a previous study to assess the influence of particular structural features on sorption. Here, the ability to describe the observed sorption behavior for compounds with similar structural features using surface complexation modeling was investigated. A set of surface reactions and equilibrium constants yielding optimal data fits was obtained for each organic acid over a range of total sorbate concentrations. Surface complexation modeling successfully described sorption of a number of the simple organic acids, but an additional hydrophobic component was needed to describe sorption behavior of some compounds with significant hydrophobic character. These compounds exhibited sorption behavior that was inconsistent with ligand exchange mechanisms since sorption did not decrease with increasing total sorbate concentration and/or exceeded surface site saturation. Hydrophobic interactions appeared to be most significant for the compound containing a 5-carbon aliphatic chain. Comparison of optimized equilibrium constants for similar surface species showed that model results were consistent with observed sorption behavior: equilibrium constants were highest for compounds having adjacent carboxylic groups, lower for compounds with adjacent phenolic groups, and lowest for compounds with phenolic groups in the ortho position relative to a carboxylic group. Surface complexation modeling was also performed to fit sorption data for Suwannee River fulvic acid. The data could be described well using reactions and constants similar to those for pyromellitic acid. This four-carboxyl group compound may be useful as a model for fulvic acid with respect to sorption. Other simple organic acids having multiple carboxylic and phenolic functional groups were identified as potential models for humic

  15. Sorption of roxarsone onto soils with different physicochemical properties.

    PubMed

    Fu, Qing-Long; He, Jian-Zhou; Blaney, Lee; Zhou, Dong-Mei

    2016-09-01

    Elevated roxarsone (ROX) concentrations in soils, caused by land application of ROX-bearing poultry litter, mandate investigation of ROX sorption onto soils. Equilibrium and kinetic studies of ROX sorption onto five soils were carried out to explore the relationship between sorption parameters and soil properties, and to reveal the effects of coexisting humic acid (HA), P(V), As(V), and As(III) on ROX transport. Experimental results indicated that ROX sorption reached equilibrium within 24 h, with pseudo-second order rate constants of 5.74-5.26 × 10(2) g/(mg h); film and intra-particle diffusion were the rate-limiting processes. ROX sorption to soils involved partitioning and adsorption phenomena; however, their relative contributions varied for different soils. The maximum ROX sorption varied with soil type, ranging from 0.59 to 4.12 mg/g. Results from correlation analysis and multiple linear regressions revealed that the maximum sorption capacities, partition coefficients, and desorption percentages were correlated with soil properties, especially iron content, total organic carbon, and dissolved organic carbon. ROX sorption to soils was affected more by soil pH than the initial pH of ROX-containing solutions. Carboxylic and amide functional groups were determined to be responsible for ROX sorption to soils. ROX sorption capacities decreased in the presence of HA, P(V), As(V), and As(III), indicating that ROX mobility in soils was facilitated by dissolved organic matter (DOM) and competing anions.

  16. Large-eddy Advection in Evapotranspiration Estimates from an Array of Eddy Covariance Towers

    NASA Astrophysics Data System (ADS)

    Lin, X.; Evett, S. R.; Gowda, P. H.; Colaizzi, P. D.; Aiken, R.

    2014-12-01

    Evapotranspiration was continuously measured by an array of eddy covariance systems and large weighting lysimeter in a sorghum in Bushland, Texas in 2014. The advective divergence from both horizontal and vertical directions were measured through profile measurements above canopy. All storage terms were integrated from the depth of soil heat flux plate to the height of eddy covariance measurement. Therefore, a comparison between the eddy covariance system and large weighing lysimeter was conducted on hourly and daily basis. The results for the discrepancy between eddy covariance towers and the lysimeter will be discussed in terms of advection and storage contributions in time domain and frequency domain.

  17. An extension of Prandtl-Batchelor theory and consequences for chaotic advection

    NASA Astrophysics Data System (ADS)

    Mezic, Igor

    2002-09-01

    We extend the Prandtl-Batchelor theory of steady laminar motion at large Reynolds number to derive conditions that steady three-dimensional Navier-Stokes flows have to satisfy. We combine these results with ergodic theory to show that flows with strong Beltrami property (e.g., ABC flows) cannot be a paradigm for chaotic advection in inertia-dominated boundary-driven three-dimensional flows. Our results indicate that viscous forces are responsible for chaotic advection in steady, three-dimensional boundary-driven Navier-Stokes flows at large Reynolds numbers.

  18. The impact of air mass advection on aerosol optical properties over Gotland (Baltic Sea)

    NASA Astrophysics Data System (ADS)

    Zdun, Agnieszka; Rozwadowska, Anna; Kratzer, Susanne

    2016-12-01

    In the present paper, measurements of aerosol optical properties from the Gotland station of the AERONET network, combined with a two-stage cluster analysis of back trajectories of air masses moving over Gotland, were used to identify the main paths of air mass advection to the Baltic Sea and to relate them to aerosol optical properties, i.e. the aerosol optical thickness at the wavelength λ = 500 nm, AOT (500) and the Ångström exponent for the spectral range from 440 to 870 nm, α(440,870). One- to six-day long back trajectories ending at 300, 500 and 3000 m above the station were computed using the HYSPLIT model. The study shows that in the Gotland region, variability in aerosol optical thickness AOT(500) is more strongly related to advections in the boundary layer than to those in the free troposphere. The observed variability in AOT(500) was best explained by the advection speeds and directions given by clustering of 4-day backward trajectories of air arriving in the boundary layer at 500 m above the station. 17 clusters of 4-day trajectories arriving at altitude 500 m above the Gotland station (sea level) derived using two-stage cluster analysis differ from each other with respect to trajectory length, the speed of air mass movement and the direction of advection. They also show different cluster means of AOT(500) and α(440,870). The cluster mean AOT(500) ranges from 0.342 ± 0.012 for the continental clusters M2 (east-southeast advection with moderate speed) and 0.294 ± 0.025 for S5 (slow south-southeast advection) to 0.064 ± 0.002 and 0.069 ± 0.002 for the respective marine clusters L3 (fast west-northwest advection) and M3 (north-northwest advection with moderate speed). The cluster mean α(440,870) varies from 1.65-1.70 for the short-trajectory clusters to 0.98 ± 0.03 and 1.06 ± 0.03 for the Arctic marine cluster L4 (fast inflow from the north) and marine cluster L5 (fast inflow from the west) respectively.

  19. Kull ALE: I. Unstructured Mesh Advection, Interface Capturing, and Multiphase 2T RHD with Material Interfaces

    SciTech Connect

    Anninos, P

    2002-02-11

    Several advection algorithms are presented within the remap framework for unstructured mesh ALE codes. The methods discussed include a generic advection scheme based on a finite volume approach, and three groups of algorithms for the treatment of material boundary interfaces. The interface capturing algorithms belong to the Volume of Fluid (VoF) class of methods to approximate material interfaces from the local fractional volume of fluid distribution in arbitrary unstructured polyhedral meshes appropriate for the Kull code. Also presented are several schemes for extending single material radiation diffusion solvers to account for multi-material interfaces.

  20. Tracer Migration in a Radially Divergent Flow Field: Longitudinal Dispersivity and Anionic Tracer Retardation

    SciTech Connect

    Seaman, J.C., P.M. Bertsch, M. Wilson, J. Singer, F. Majs and S.A. Aburime

    2007-01-01

    Hydrodynamic dispersion, the combined effects of chemical diffusion and differences in solute path length and flow velocity, is an important factor controlling contaminant migration in the subsurface environment. However, few comprehensive three-dimensional datasets exist for critically evaluating the impact of travel distance and site heterogeneity on solute dispersion, and the conservative nature of several commonly used groundwater tracers is still in question. Therefore, we conducted a series of field-scale experiments using tritiated water ({sup 3}H{sup 1}HO), bromide (Br{sup -}), and two fluorobenzoates (2,4 Di-FBA, 2,6 Di-FBA) as tracers in the water-table aquifer on the USDOE's Savannah River Site (SRS), located on the upper Atlantic Coastal Plain. For each experiment, tracer-free groundwater was injected for approximately 24 h (56.7 L min{sup -1}) to establish a steady-state forced radial gradient before the introduction of a tracer pulse. After the tracer pulse, which lasted from 256 to 560 min, the forced gradient was maintained throughout the experiment using nonlabeled groundwater. Tracer migration was monitored using six multilevel monitoring wells, radially spaced at approximate distances of 2.0, 3.0, and 4.5 m from the central injection well. Each sampling well was further divided into three discrete sampling depths that were pumped continuously ({approx}0.1 L min{sup -1}) throughout the course of the experiments. Longitudinal dispersivity ({alpha}{sub L}) and travel times for {sup 3}H{sup 1}HO breakthrough were estimated by fitting the field data to analytical approximations of the advection-dispersion equation (ADE) for uniform and radial flow conditions. Dispersivity varied greatly between wells located at similar transport distances and even between zones within a given well, which we attributed to variability in the hydraulic conductivity at the study site. The radial flow equation generally described tritium breakthrough better than the

  1. Titanium dioxide-coated carbon nanotube network filter for rapid and effective arsenic sorption.

    PubMed

    Liu, Han; Zuo, Kuichang; Vecitis, Chad D

    2014-12-02

    In this study, a TiO2-coated carbon nanotube (CNT) network filter was prepared via a simple filtration–steam hydrolysis method and evaluated with respect to aqueous arsenic removal. The TiO2 coating was 5.5 ± 2.7 nm thick, completely covered the CNT network surface, and had a specific surface area of 196 m(2) g(–1), which was ∼2-fold greater than that of the CNT network. The TiO2–CNT As sorption kinetics increased with both increasing flow rate and cell potential, with increasing flow rate having a significantly stronger effect. At 6 mL min(–1) in the absence of potential and in recirculation mode, the first-order As sorption rate constants were 4.3 and 4.4 s(–1) for As(III) and As(V), respectively. The TiO2–CNT electro-assisted equilibrium sorption capacities at a cell potential of 2 V for effluent [As] = 10 ppb in single-pass mode were 1.8 and 1.3 mg g(–1) for As(III) and As(V), respectively. The enhanced TiO2–CNT filter As sorption kinetics and capacity result from increased mass transport due to internal convection and pore radius range, improved sorption site accessibility due to porosity and TiO2 dispersion, and reduced TiO2 negative surface charge due to anodic capacitance. Groundwater samples containing 44 ppb As were treated by single-pass filtration, and 12,500 bed volumes (residence time of 4.5 s; 127 L m(–2) h(–1); 5.8 mg m(–2) h(–1)) were filtered prior to the effluent As level reaching >10 ppb. A spent TiO2 filter was successfully regenerated by 5 mM NaOH for both As(III) and As(V).

  2. A facile synthesis of Fe3O4-charcoal composite for the sorption of a hazardous dye from aquatic environment.

    PubMed

    Ahmed, Md Juned K; Ahmaruzzaman, M

    2015-11-01

    Herein, we synthesized Fe3O4-charcoal composite using chemical precipitation technique and utilized it for the sorption of methylene blue from aqueous solution. The synthesized composite was characterized by Infra-red spectroscopy, N2 adsorption-desorption isotherm, X-ray diffraction, selected area electron diffraction, transmission electron microscopy, and vibrating sample magnetometer. The composite depicts absorption bands conforming to Fe-O, -OH, CO, and C-O vibrations. The composite was mesoporous in nature with a surface area of 387.30 m(2) g(-1). The observed diffraction planes correspond to face-centered cubic Fe3O4 and disordered graphitic carbon. The spherical Fe3O4 particles (average diameter ∼13.8 nm) were uniformly distributed in the carbon matrix of the charcoal. The saturation and remanent magnetizations demonstrate its potential for magnetic separation and reuse. The composite showed dye sorption capacities of 97.49 mg g(-1) and 90.85 mg g(-1) in batch and fixed-bed system. Pseudo-second order kinetics and Temkin isotherm best represented the sorption data. The sorption process was endothermic, spontaneous, and administered by electrostatic, π-π dispersive interactions, film, and intraparticle diffusion. Microwave irradiations followed by methanol elution regenerated the dye-loaded composite with nearly no loss in sorption capacity. The recovery of energy and potential utilization of bottom ash enhances the prospective of Fe3O4-charcoal composite for industrial applications.

  3. Sorption of diclofenac and naproxen onto MWCNT in model wastewater treated by H2O2 and/or UV.

    PubMed

    Czech, Bożena; Oleszczuk, Patryk

    2016-04-01

    The application of oxidation processes such as UV and/or H2O2 will change the physicochemical properties of carbon nanotubes (CNT). It may affect the sorption affinity of CNT to different contaminants and then affect their fate in the environment. In the present study the adsorption of two very common used pharmaceuticals (diclofenac and naproxen) onto CNT treated by UV, H2O2 or UV/H2O2 was investigated. Four different adsorption models (Freundlich, Langmuir, Temkin, Dubinin-Radushkevich) were tested. The best fitting of experimental data was observed for Freundlich or Langmuir model. The significant relationships between Q calculated from Langmuir model with O% and dispersity were observed. Kinetics of diclofenac and naproxen followed mainly pseudo-second order indicating for chemisorption limiting step of adsorption. The data showed that the mechanism of sorption was physical or chemical depending on the type of CNT modification.

  4. BIOPLUME III: NATURAL ATTENTUATION DECISION SUPPORT SYSTEM USER'S MANUAL - VERSION 1.0

    EPA Science Inventory

    The BIOPLUME III program is a two-dimensional, finite difference model for simulating the natural attenuation of organic contaminants in ground water due to the processes of advection, dispersion, sorption, and biodegradation. The model simulates the biodegradation of organic...

  5. BIOPLUME III

    EPA Pesticide Factsheets

    BIOPLUME III is a two-dimensional finite difference model for simulating the natural attenuation of organic contaminants in groundwater due to the processes of advection, dispersion, sorption, and biodegradation.

  6. Sorption of endosulphan sulphate in soil organic matter.

    PubMed

    Chowdhury, Raja; Atwater, James W; Hall, Ken J; Parkinson, Paula

    2011-12-01

    Sorption of endosulphan sulphate in soil organic matter was investigated using Standard Elliot soil humic acid (HA) and soil fulvic acid (FA) at two ionic strengths (0.001 and 0.01). It was observed that divalent calcium ion and ionic strength affect the sorption of endosulphan sulphate in HA. All the experiments were carried out at pH 6.7 +/- 0.1. In the presence and absence of calcium (ionic strength 0.001), the solubility enhancement method was used to estimate the sorption coefficients of endosulphan sulphate in HA. For FA, the solubility enhancement method was used to estimate the sorption coefficients at an ionic strength of 0.001 (in the presence of calcium) and 0.01. The presence of calcium was found to significantly enhance (alpha = 0.01) the solubility of endosulphan sulphate in HA. Sorption coefficients at pH 6.7, obtained using the solubility enhancement method, were found to be 10-21 L/g in HA and 6 L/g in FA (in the presence of calcium). Increase in ionic strength from 0.001 to 0.01 decreased the sorption of endosulphan sulphate in HA. The effect of ionic strength and calcium on the sorption of endosulphan sulphate was most satisfactorily explained on the basis of the Donnan volume.

  7. Molecular scale assessment of methylarsenic sorption on aluminum oxide.

    PubMed

    Shimizu, Masayuki; Ginder-Vogel, Matthew; Parikh, Sanjai J; Sparks, Donald L

    2010-01-15

    Methylated forms of arsenic (As), monomethylarsenate (MMA) and dimethylarsenate (DMA), have historically been used as herbicides and pesticides. Because of their large application to agriculture fields and the toxicity of MMA and DMA, the sorption of methylated As to soil constituents requires investigation. MMA and DMA sorption on amorphous aluminum oxide (AAO) was investigated using both macroscopic batch sorption kinetics and molecular scale extended X-ray absorption fine structure (EXAFS) and Fourier transform infrared (FTIR) spectroscopic techniques. Sorption isotherm studies revealed sorption maxima of 0.183, 0.145, and 0.056 mmol As/mmol Al for arsenate (As(V)), MMA, and DMA, respectively. In the sorption kinetics studies, 100% of added As(V) was sorbed within 5 min, while 78% and 15% of added MMA and DMA were sorbed, respectively. Desorption experiments, using phosphate as a desorbing agent, resulted in 30% release of absorbed As(V), while 48% and 62% of absorbed MMA and DMA, respectively, were released. FTIR and EXAFS studies revealed that MMA and DMA formed mainly bidentate binuclear complexes with AAO. On the basis of these results, it is proposed that increasing methyl group substitution results in decreased As sorption and increased As desorption on AAO.

  8. [Sorption characteristics of surfactant onto bentonite using microwave irradiation].

    PubMed

    Li, Ji-Wu; Zhu, Li-Zhong; Cai, Wei-Jian

    2007-11-01

    The sorption curve of cetylpyridinium chloride (CPC) onto bentonite by microwave irradiation was studied. The effects of microwave reaction time and CPC concentration on interlayer spacing and organic carbon content of organobentonite were tested, respectively. Thermodynamics and kinetics of sorption of CPC onto bentonite by microwave irradiation were studied. The saturated adsorption amount of CPC to bentonite with microwave irradiation time from 90 s to 120 s was equal to that of conventional sorption, up to 0.001 63 mol x g(-1). On the condition of microwave irradiation time with 2 min and concentration of CPC with 1.20 mmol x L(-1), the interlayer spacing was attained to 2.44 nm at the best, and organic carbon content was 23.45%. The atomic force microscopy (AFM) showed that the typical layer morphological structure of bentonite was not devastated by microwave. Contrast to conventional sorption, sorption of CPC onto bentonite was greatly influenced by microwave, velocity constant of sorption reaction was increased 107.6 times, and free energy of sorption reaction system was decreased.

  9. Molecular Scale Assessment of Methylarsenic Sorption on Aluminum Oxide

    SciTech Connect

    Shimizu, M.; Ginder-Vogel, M; Parikh, S; Sparks, D

    2010-01-01

    Methylated forms of arsenic (As), monomethylarsenate (MMA) and dimethylarsenate (DMA), have historically been used as herbicides and pesticides. Because of their large application to agriculture fields and the toxicity of MMA and DMA, the sorption of methylated As to soil constituents requires investigation. MMA and DMA sorption on amorphous aluminum oxide (AAO) was investigated using both macroscopic batch sorption kinetics and molecular scale extended X-ray absorption fine structure (EXAFS) and Fourier transform infrared (FTIR) spectroscopic techniques. Sorption isotherm studies revealed sorption maxima of 0.183, 0.145, and 0.056 mmol As/mmol Al for arsenate (As{sup V}), MMA, and DMA, respectively. In the sorption kinetics studies, 100% of added As{sup V} was sorbed within 5 min, while 78% and 15% of added MMA and DMA were sorbed, respectively. Desorption experiments, using phosphate as a desorbing agent, resulted in 30% release of absorbed As{sup V}, while 48% and 62% of absorbed MMA and DMA, respectively, were released. FTIR and EXAFS studies revealed that MMA and DMA formed mainly bidentate binuclear complexes with AAO. On the basis of these results, it is proposed that increasing methyl group substitution results in decreased As sorption and increased As desorption on AAO.

  10. Sorption of triazine and organophosphorus pesticides on soil and biochar.

    PubMed

    Uchimiya, Minori; Wartelle, Lynda H; Boddu, Veera M

    2012-03-28

    Sorption and degradation are the primary processes controlling the efficacy and runoff contamination risk of agrochemicals. Considering the longevity of biochar in agroecosystems, biochar soil amendment must be carefully evaluated on the basis of the target agrochemical and soil types to achieve agricultural (minimum impact on efficacy) and environmental (minimum runoff contamination) benefits. In this study, sorption-desorption isotherms and kinetics of triazine (deisopropylatrazine) and organophosphorus (malathion, parathion, and diazinon) pesticides were first investigated on various soil types ranging from clayey, acidic Puerto Rican forest soil (PR) to heavy metal contaminated small arms range (SAR) soils of sandy and peaty nature. On PR, malathion sorption did not reach equilibrium during the 3 week study. Comparison of solution-phase molar phosphorus and agrochemical concentrations suggested that degradation products of organophosphorus pesticides were bound on soil surfaces. The degree of sorption on different soils showed the following increasing trend: deisopropylatrazine < malathion < diazinon < parathion. While sorption of deisopropylatrazine on SAR soils was not affected by diazinon or malathion, deisopropylatrazine suppressed the sorption of diazinon and malathion. Deisopropylatrazine irreversibly sorbed on biochars, and greater sorption was observed with higher Brunauer-Emmett-Teller surface area of biochar (4.7-2061 mg g(-1)). The results suggested the utility of biochar for remediation of sites where concentrations of highly stable and mobile agrochemicals exceed the water-quality benchmarks.

  11. Water vapor sorption thermodynamics of the Nafion ionomer membrane.

    PubMed

    Wadsö, Lars; Jannasch, Patric

    2013-07-18

    The water interactions of polymer electrolyte membranes are of significant interest when these materials are used in, for example, fuel cells. We have therefore studied the sorption thermodynamics of Nafion with a sorption calorimeter that simultaneously measures the sorption isotherm and the mixing (sorption) enthalpy. This unique method is suitable for investigating the sorption thermodynamics of ionic polymers. The measurements were made at 25 °C on a series of samples dried at different temperatures from 25 to 120 °C. The sorption isotherms indicate that the samples dried at 120 °C lost about 0.8 more water molecules per sulfonic group during the drying than did the samples dried at 25 °C, and this result was verified gravimetrically. The mixing enthalpies showed several peaks or plateaus for the samples dried at 60-120 °C. This behavior was seen up to about 2 water molecules per sulfonic group. As these peaks were not directly related to any feature in the sorption isotherm, they probably have their origin in a secondary process, such as a reorganization of the polymer.

  12. Insights into the sorption properties of cutin and cutan biopolymers.

    PubMed

    Shechter, Michal; Chefetz, Benny

    2008-02-15

    Plant cuticles have been reported as highly efficient sorbents for organic compounds. The objective of this study was to elucidate the sorption and desorption behavior of polar and nonpolar organic compounds with the major structural components of the plant cuticle: the biopolymers cutin and cutan. The sorption affinity values of the studied compounds followed the order: phenanthrene > atrazine > chlorotoluron > carbamazepine. A higher sorption affinity of phenanthrene and atrazine to cutin was probably due to the higher level of amorphous paraffinic carbon in this biopolymer. Phenanthrene exhibited reversible sorption behavior and a high ratio of organic-carbon-normalized distribution coefficient (Koc) to carbon-normalized octanol-water partitioning coefficients (Kowc) with both biopolymers. This suggests that both biopolymers provide phenanthrene with a partition medium for hydrophobic interactions with the flexible long alkyl-chain moieties of the biopolymers. The low Koc/Kowc ratios obtained for the polar sorbates suggest that the polar sites in the biopolymers are not accessible for sorption interactions. Atrazine and carbamazepine exhibited sorption-desorption hysteresis with both sorbents, indicating that both sorbates interact with cutin and cutan via both hydrophobic and specific interactions. In general, the sorptive properties of the studied biopolymers were similar, signifying that the active sorption sites are similar even though the biopolymers exhibit different properties.

  13. Sorption of carbon dioxide onto sodium carbonate

    SciTech Connect

    Sang-Wook Park; Deok-Ho Sung; Byoung-Sik Choi; Kwang-Joong Oh; Kil-Ho Moon

    2006-07-01

    Sodium carbonate was used as a sorbent to capture CO{sub 2} from a gaseous stream of carbon dioxide, nitrogen, and moisture. The breakthrough data of CO{sub 2} were measured in a fixed bed to observe the reaction kinetics of CO{sub 2}-carbonate reaction. Several models such as the shrinking-core model, the homogeneous model, and the deactivation model in the non-catalytic heterogeneous reaction systems were used to explain the kinetics of reaction among CO{sub 2}, Na{sub 2}CO{sub 3}, and moisture using analysis of the experimental breakthrough data. Good agreement of the deactivation model was obtained with the experimental breakthrough data. The sorption rate constant and the deactivation rate constant were evaluated by analysis of the experimental breakthrough data using a nonlinear least squares technique and described as Arrhenius form.

  14. Sorption compressor/mechanical expander hybrid refrigeration

    NASA Technical Reports Server (NTRS)

    Jones, J. A.; Britcliffe, M.

    1987-01-01

    Experience with Deep Space Network (DSN) ground-based cryogenic refrigerators has proved the reliability of the basic two-stage Gifford-McMahon helium refrigerator. A very long life cryogenic refrigeration system appears possible by combining this expansion system or a turbo expansion system with a hydride sorption compressor in place of the usual motor driven piston compressor. To test the feasibility of this system, a commercial Gifford-McMahon refrigerator was tested using hydrogen gas as the working fluid. Although no attempt was made to optimize the system for hydrogen operation, the refrigerator developed 1.3 W at 30 K and 6.6 W at 60 K. The results of the test and of theoretical performances of the hybrid compressor coupled to these expansion systems are presented.

  15. Attenuation of polychlorinated biphenyl sorption to charcoal by humic acids.

    PubMed

    Koelmans, Albert A; Meulman, Brendo; Meijer, Thijs; Jonker, Michiel T O

    2009-02-01

    Strong sorption to black carbon may limit the environmental risks of organic pollutants, but interactions with cosorbing humic acid (HA) may interfere. We studied the attenuative effect of HA additions on the sorption of polychlorinated biphenyls (PCBs) to a charcoal. "Intrinsic" sorption to HA-amended charcoal was calculated by subtracting the sorption contribution of HA from the total sorption to charcoal and HA. Association of PCBs with HA was proportional to hydrophobicity. However, the planar PCBs 77 and 126 had an additional 2-4 times stronger association than expected from hydrophobicity alone. Sorption isotherms for the raw charcoal fitted slightly better to a three-parameter Polanyi-Dubinin-Manes model than to a two-parameter Langmuir model. Preloading the charcoal with 1-75 mg of HA/g of charcoal increasingly attenuated sorption to charcoal with up to a factor of 10. The resultant isotherms could be described adequately with the Freundlich model. Isotherm nonlinearity increased with HA loading, suggesting increased sorption competition between HA and PCBs. Attenuation was negligible in the PCB picogram per liter to nanogram per liter range and increased at higher PCB concentrations, which points to saturation of binding sites on the charcoal. Attenuation was highest for planar congeners, which suggests an additional site blockage mechanism. These variations due to HA loading and PCB concentration can explain the variability in attenuation reported in earlier work and imply that the use of constant "attenuation factors" to adjust sorption coefficients determined for pure carbonaceous materials in order to apply them to field situations may not be warranted.

  16. Bacterial sorption of heavy metals. [Bacillus cereus

    SciTech Connect

    Mullen, M.D.; Wolf, D.C. ); Ferris, F.G.; Beveridge, T.J.; Flemming, C.A. ); Bailey, G.W. )

    1989-12-01

    Four bacteria, Bacillus cereus, Bacillus subtilis, Escherichia coli, and Pseudomonas aeruginosa, were examined for the ability to remove Ag{sup +}, Cd{sup 2+}, Cu{sup 2+}, and La{sup 3+} from solution by batch equilibration methods. Cd and Cu sorption over the concentration range 0.001 to 1 mM was described by Freundlich isotherms. At 1 mM concentrations of both Cd{sup 2+} and Cu{sup 2+}, P. aeruginosa and B. cereus were the most and least efficient at metal removal, respectively. Freundlich K constants indicated that E. coli was most efficient at Cd{sup 2+} removal and B. subtilis removed the most Cu{sup 2+}. Removal of Ag{sup +} from solution by bacteria was very efficient; an average of 89% of the total Ag{sup +} was removed from the 1 mM solution, while only 12, 29, and 27% of the total Cd{sup 2+}, Cu{sup 2+}, and La{sup 3+}, respectively, were sorbed from 1 mM solutions. Electron microscopy indicated that La{sup 3+} accumulated at the cell surface as needlelike, crystalline precipitates. Silver precipitated as discrete colloidal aggregates at the cell surface and occasionally in the cytoplasm. Neither Cd{sup 2+} nor Cu{sup 2+} provided enough electron scattering to identify the location of sorption. The affinity series for bacterial removal of these metals decreased in the order Ag > La > Cu > Cd. The results indicate that bacterial cells are capable of binding large quantities of different metals.

  17. Alteration of chaotic advection in blood flow around partial blockage zone: Role of hematocrit concentration

    NASA Astrophysics Data System (ADS)

    Maiti, Soumyabrata; Chaudhury, Kaustav; DasGupta, Debabrata; Chakraborty, Suman

    2013-01-01

    Spatial distributions of particles carried by blood exhibit complex filamentary pattern under the combined effects of geometrical irregularities of the blood vessels and pulsating pumping by the heart. This signifies the existence of so called chaotic advection. In the present article, we argue that the understanding of such pathologically triggered chaotic advection is incomplete without giving due consideration to a major constituent of blood: abundant presence of red blood cells quantified by the hematocrit (HCT) concentration. We show that the hematocrit concentration in blood cells can alter the filamentary structures of the spatial distribution of advected particles in an intriguing manner. Our results reveal that there primarily are two major impacts of HCT concentrations towards dictating the chaotic dynamics of blood flow: changing the zone of influence of chaotic mixing and determining the enhancement of residence time of the advected particles away from the wall. This, in turn, may alter the extent of activation of platelets or other reactive biological entities, bearing immense consequence towards dictating the biophysical mechanisms behind possible life-threatening diseases originating in the circulatory system.

  18. MECHANISM OF OUTFLOWS IN ACCRETION SYSTEM: ADVECTIVE COOLING CANNOT BALANCE VISCOUS HEATING?

    SciTech Connect

    Gu, Wei-Min

    2015-01-20

    Based on the no-outflow assumption, we investigate steady-state, axisymmetric, optically thin accretion flows in spherical coordinates. By comparing the vertically integrated advective cooling rate with the viscous heating rate, we find that the former is generally less than 30% of the latter, which indicates that the advective cooling itself cannot balance the viscous heating. As a consequence, for radiatively inefficient flows with low accretion rates such as M-dot ≲10{sup −3} M-dot {sub Edd}, where M-dot {sub Edd} is the Eddington accretion rate, the viscous heating rate will be larger than the sum of the advective cooling rate and the radiative cooling one. Thus, no thermal equilibrium can be established under the no-outflow assumption. We therefore argue that in such cases outflows ought to occur and take away more than 70% of the thermal energy generated by viscous dissipation. Similarly, for optically thick flows with extremely large accretion rates such as M-dot ≳10 M-dot {sub Edd}, outflows should also occur owing to the limited advection and the low efficiency of radiative cooling. Our results may help to understand the mechanism of outflows found in observations and numerical simulations.

  19. Satellite-advection based solar forecasting: lessons learned and progress towards probabalistic solar forecasting

    NASA Astrophysics Data System (ADS)

    Rogers, M. A.

    2015-12-01

    Using satellite observations from GOES-E and GOES-W platforms in concert with GFS-derived cloud-level winds and a standalone radiative transfer model, an advection-derived forecast for surface GHI over the continental United States, with intercomparison between forecasts for four zones over the CONUS and Central Pacific with SURFRAD results. Primary sources for error in advection-based forecasts, primarily driven by false- or mistimed ramp events are discussed, with identification of error sources quantified along with techniques used to improve advection-based forecasts to approximately 10% MAE for designated surface locations. Development of a blended steering wind product utilizing NWP output combined with satellite-derived winds from AMV techniques to improve 0-1 hour advection forecasts will be discussed. Additionally, the use of two years' of solar forecast observations in the development of a prototype probablistic forecast for ramp events will be shown, with the intent of increasing the use of satellite-derived forecasts for grid operators and optimizing integration of renewable resources into the power grid. Elements of the work were developed under the 'Public-Private-Academic Partnership to Advance Solar Power Forecasting' project spearheaded by the National Center for Atmospheric Research.

  20. An enriched finite element method to fractional advection-diffusion equation

    NASA Astrophysics Data System (ADS)

    Luan, Shengzhi; Lian, Yanping; Ying, Yuping; Tang, Shaoqiang; Wagner, Gregory J.; Liu, Wing Kam

    2017-03-01

    In this paper, an enriched finite element method with fractional basis [ 1,x^{α }] for spatial fractional partial differential equations is proposed to obtain more stable and accurate numerical solutions. For pure fractional diffusion equation without advection, the enriched Galerkin finite element method formulation is demonstrated to simulate the exact solution successfully without any numerical oscillation, which is advantageous compared to the traditional Galerkin finite element method with integer basis [ 1,x] . For fractional advection-diffusion equation, the oscillatory behavior becomes complex due to the introduction of the advection term which can be characterized by a fractional element Peclet number. For the purpose of addressing the more complex numerical oscillation, an enriched Petrov-Galerkin finite element method is developed by using a dimensionless fractional stabilization parameter, which is formulated through a minimization of the residual of the nodal solution. The effectiveness and accuracy of the enriched finite element method are demonstrated by a series of numerical examples of fractional diffusion equation and fractional advection-diffusion equation, including both one-dimensional and two-dimensional, steady-state and time-dependent cases.

  1. DEVELOPMENT AND DEMONSTRATION OF A BIDIRECTIONAL ADVECTIVE FLUX METER FOR SEDIMENT-WATER INTERFACE

    EPA Science Inventory

    A bidirectional advective flux meter for measuring water transport across the sediment-water interface has been successfully developed and field tested. The flow sensor employs a heat-pulse technique combined with a flow collection funnel for the flow measurement. Because the dir...

  2. A global spectral element model for poisson equations and advective flow over a sphere

    NASA Astrophysics Data System (ADS)

    Mei, Huan; Wang, Faming; Zeng, Zhong; Qiu, Zhouhua; Yin, Linmao; Li, Liang

    2016-03-01

    A global spherical Fourier-Legendre spectral element method is proposed to solve Poisson equations and advective flow over a sphere. In the meridional direction, Legendre polynomials are used and the region is divided into several elements. In order to avoid coordinate singularities at the north and south poles in the meridional direction, Legendre-Gauss-Radau points are chosen at the elements involving the two poles. Fourier polynomials are applied in the zonal direction for its periodicity, with only one element. Then, the partial differential equations are solved on the longitude-latitude meshes without coordinate transformation between spherical and Cartesian coordinates. For verification of the proposed method, a few Poisson equations and advective flows are tested. Firstly, the method is found to be valid for test cases with smooth solution. The results of the Poisson equations demonstrate that the present method exhibits high accuracy and exponential convergence. Highprecision solutions are also obtained with near negligible numerical diffusion during the time evolution for advective flow with smooth shape. Secondly, the results of advective flow with non-smooth shape and deformational flow are also shown to be reasonable and effective. As a result, the present method is proved to be capable of solving flow through different types of elements, and thereby a desirable method with reliability and high accuracy for solving partial differential equations over a sphere.

  3. A Study of the Physical Processes of an Advection Fog Boundary Layer

    NASA Astrophysics Data System (ADS)

    Liu, Duan Yang; Yan, Wen Lian; Yang, Jun; Pu, Mei Juan; Niu, Sheng Jie; Li, Zi Hua

    2016-01-01

    A large quantity of advection fog appeared in the Yangtze River delta region between 1 and 2 December 2009. Here, we detail the fog formation and dissipation processes and the background weather conditions. The fog boundary layer and its formation and dissipation mechanisms have also been analyzed using field data recorded in a northern suburb of Nanjing. The results showed the following: (1) This advection fog was generated by interaction between advection of a north-east cold ground layer and a south-east warm upper layer. The double-inversion structure generated by this interaction between the cold and warm advections and steady south-east vapour transport was the main cause of this long-lasting fog. The double-inversion structure provided good thermal conditions for the thick fog, and the south-east vapour transport was not only conducive to maintaining the thickness of the fog but also sustained its long duration. (2) The fog-top altitude was over 600 m for most of the time, and the fog reduced visibility to less than 100 m for approximately 12 h. (3) The low-level jet near the lower inversion layer also played a role in maintaining the thick fog system by promoting heat, momentum and south-east vapour transport.

  4. The connection of standard thin disk with advection-dominated accretion flow

    NASA Astrophysics Data System (ADS)

    Lin, Yi-qing; Lu, Ju-fu; G. U., Wei-min

    2005-04-01

    Using the standard Runge-Kutta method, a global solution of the basic equations describing black hole accretion flows is derived. It is proved that transition from a standard thin disk to an advection-dominated accretion flow is realizable in case of high viscosity, without introducing any additional mechanism of energy transfer or specifying any ad hoc outer boundary condition.

  5. Sorption Heat Pipe -A New Thermal Control Device for Space Applications

    NASA Astrophysics Data System (ADS)

    Vasiliev, Leonard L.; Vasiliev, Leonid L.

    2003-01-01

    Sorption heat pipe is a novelty and combines the enhanced heat and mass transfer typical for conventional heat pipe with sorption phenomena in a sorbent structure. Sorption heat pipe can be used as a heat source / sink and be applied as a heat pipe. Sorption heat pipe is insensitive to some ``g'' acceleration and it is suggested for space and ground application.

  6. Sorption of lanthanum ions by natural clinoptilolite tuff

    NASA Astrophysics Data System (ADS)

    Dampilova, B. V.; Zonkhoeva, E. L.

    2013-08-01

    The equilibrium and kinetics of sorption of lanthanum ions on natural clinoptilolite tuff are studied. It is demonstrated that sorption of lanthanum ions from diluted solutions occurs in micropores of clinoptilolite, and from concentrated solutions in the mesoporous structure of tuff. The main capacity of zeolite tuff is found in the secondary porous structure. The sorption of lanthanum ions is limited by diffusion in tuff grains. Lanthanum ions are regularly distributed in the tuff phase and interact with the Brønsted centers of large clinoptilolite cavities.

  7. Zeolite-filled PDMS membranes. 1. Sorption of halogenated hydrocarbons

    SciTech Connect

    Vankelecom, I.F.J.; Dotermont, C.; Morobe, M.; Uytterhoeven, J.B.; Vandecasteele, C.

    1997-03-20

    Aiming at a more thorough understanding of the influence of zeolite fillers in PDMS membranes on the pervaporation of chlorinated hydrocarbons from aqueous solutions, the sorption aspect of this separation process was studied. Firstly, the sorption of water and five different chlorinated hydrocarbons was investigated in the zeolite and the polymer separately. Secondly, the composite system was considered and conclusions were drawn concerning interactions at the zeolite-polymer interphase. Finally, the sorption results obtained on the self-synthesized membranes were compared with measurements on commercially available PDMS membranes (GFT). 23 refs., 11 figs., 3 tabs.

  8. Selective Sorption of Dissolved Organic Carbon Compounds by Temperate Soils

    SciTech Connect

    Jagadamma, Sindhu; Mayes, Melanie; Phillips, Jana Randolph

    2012-01-01

    Physico-chemical sorption of dissolved organic carbon (DOC) on soil minerals is one of the major processes of organic carbon (OC) stabilization in soils, especially in deeper layers. The attachment of C on soil solids is related to the reactivity of the soil minerals and the chemistry of the sorbate functional groups, but the sorption studies conducted without controlling microbial activity may overestimate the sorption potential of soil. This study was conducted to examine the sorptive characteristics of a diverse functional groups of simple OC compounds (D-glucose, L-alanine, oxalic acid, salicylic acid, and sinapyl alcohol) on temperate climate soil orders (Mollisols, Ultisols and Alfisols) with and without biological degradative processes. Equilibrium batch experiments were conducted using 0-100 mg C L-1 at a solid-solution ratio of 1:60 for 48 hrs and the sorption parameters were calculated by Langmuir model fitting. The amount of added compounds that remained in the solution phase was detected by high performance liquid chromatography (HPLC) and total organic C (TOC) analysis. Soil sterilization was performed by -irradiation technique and experiments were repeated to determine the contribution of microbial degradation to apparent sorption. Overall, Ultisols did not show a marked preference for apparent sorption of any of the model compounds, as indicated by a narrower range of maximum sorption capacity (Smax) of 173-527 mg kg soil-1 across compounds. Mollisols exhibited a strong preference for apparent sorption of oxalic acid (Smax of 5290 mg kg soil-1) and sinapyl alcohol (Smax of 2031 mg kg soil-1) over the other compounds. The propensity for sorption of oxalic acid is mainly attributed to the precipitation of insoluble Ca-oxalate due to the calcareous nature of most Mollisol subsoils and its preference for sinapyl alcohol could be linked to the polymerization of this lignin monomer on 2:2 mineral dominated soils. The reactivity of Alfisols to DOC was in

  9. Modeling the advection of discontinuous quantities in Geophysical flows using Particle Level Sets

    NASA Astrophysics Data System (ADS)

    Aleksandrov, V.; Samuel, H.; Evonuk, M.

    2010-12-01

    Advection is one of the major processes that commonly acts on various scales in nature (core formation, mantle convective stirring, multi-phase flows in magma chambers, salt diapirism ...). While this process can be modeled numerically by solving conservation equations, various geodynamic scenarios involve advection of quantities with sharp discontinuities. Unfortunately, in these cases modeling numerically pure advection becomes very challenging, in particular because sharp discontinuities lead to numerical instabilities, which prevent the local use of high order numerical schemes. Several approaches have been used in computational geodynamics in order to overcome this difficulty, with variable amounts of success. Despite the use of correcting filters or non-oscillatory, shock-preserving schemes, Eulerian (fixed grid) techniques generally suffer from artificial numerical diffusion. Lagrangian approaches (dynamic grids or particles) tend to be more popular in computational geodynamics because they are not prone to excessive numerical diffusion. However, these approaches are generally computationally expensive, especially in 3D, and can suffer from spurious statistical noise. As an alternative to these aforementioned approaches, we have applied a relatively recent Particle Level set method [Enright et al., 2002] for modeling advection of quantities with the presence of sharp discontinuities. We have tested this improved method, which combines the best of Eulerian and Lagrangian approaches, against well known benchmarks and classical Geodynamic flows. In each case the Particle Level Set method accuracy equals or is better than other Eulerian and Lagrangian methods, and leads to significantly smaller computational cost, in particular in three-dimensional flows, where the reduction of computational time for modeling advection processes is most needed.

  10. Fast and accurate advection of sharp discontinuities in Geophysical flows using hybrid implicit surfaces

    NASA Astrophysics Data System (ADS)

    Samuel, Henri

    2010-05-01

    Advection is one of the major processes that commonly acts on various scales in nature (core formation, mantle convective stirring, multi-phase flows in magma chambers, salt diapirism ...). While this process can be modeled numerically by solving conservation equations, various geodynamic scenarios involve advection of quantities with sharp discontinuities. Unfortunately, in these cases modeling numerically pure advection becomes very challenging, in particular because sharp discontinuities lead to numerical instabilities, which prevent the local use of high order numerical schemes. Several approaches have been used in computational geodynamics in order to overcome this difficulty, with variable amounts of success. Despite the use of correcting filters or non-oscillatory, shock-preserving schemes, Eulerian (fixed grid) techniques generally suffer from artificial numerical diffusion. Lagrangian approaches (dynamic grids or particles) tend to be more popular in computational geodynamics because they are not prone to excessive numerical diffusion. However, these approaches are generally computationally expensive, especially in 3D, and can suffer from spurious statistical noise. As an alternative to these aforementioned approaches, I have applied a relatively recent Particle Level set method [Enright et al., 2002] for modeling advection of quantities with the presence of sharp discontinuities. I have adapted this improved method, which combines the best of Eulerian and Lagrangian approaches, and I have tested it against well known benchmarks and classical Geodynamic flows. In each case the Particle Level Set method accuracy equals or is better than other Eulerian and Lagrangian methods, and leads to significantly smaller computational cost, in particular in three-dimensional flows, where the reduction of computational time for modeling advection processes is most needed.

  11. High-resolution stochastic downscaling of climate models: simulating wind advection, cloud cover and precipitation

    NASA Astrophysics Data System (ADS)

    Peleg, Nadav; Fatichi, Simone; Burlando, Paolo

    2015-04-01

    A new stochastic approach to generate wind advection, cloud cover and precipitation fields is presented with the aim of formulating a space-time weather generator characterized by fields with high spatial and temporal resolution (e.g., 1 km x 1 km and 5 min). Its use is suitable for stochastic downscaling of climate scenarios in the context of hydrological, ecological and geomorphological applications. The approach is based on concepts from the Advanced WEather GENerator (AWE-GEN) presented by Fatichi et al. (2011, Adv. Water Resour.), the Space-Time Realizations of Areal Precipitation model (STREAP) introduced by Paschalis et al. (2013, Water Resour. Res.), and the High-Resolution Synoptically conditioned Weather Generator (HiReS-WG) presented by Peleg and Morin (2014, Water Resour. Res.). Advection fields are generated on the basis of the 500 hPa u and v wind direction variables derived from global or regional climate models. The advection velocity and direction are parameterized using Kappa and von Mises distributions respectively. A random Gaussian fields is generated using a fast Fourier transform to preserve the spatial correlation of advection. The cloud cover area, total precipitation area and mean advection of the field are coupled using a multi-autoregressive model. The approach is relatively parsimonious in terms of computational demand and, in the context of climate change, allows generating many stochastic realizations of current and projected climate in a fast and efficient way. A preliminary test of the approach is presented with reference to a case study in a complex orography terrain in the Swiss Alps.

  12. Advective removal of intraparticle uranium from contaminated vadose zone sediments, Hanford, U.S.

    PubMed

    Ilton, Eugene S; Qafoku, Nikolla P; Liu, Chongxuan; Moore, Dean A; Zachara, John M

    2008-03-01

    A column study on U(VI)-contaminated vadose zone sediments from the Hanford Site, WA, was performed to investigate U(VI) release kinetics with water advection and variable geochemical conditions. The sediments were collected from an area adjacent to and below tank BX-102 that was contaminated as a result of a radioactive tank waste overfill event. The primary reservoir for U(VI) in the sediments are micrometer-size precipitates composed of nanocrystallite aggregates of a Na-U-Silicate phase, most likely Na-boltwoodite, that nucleated and grew within microfractures of the plagioclase component of sand-sized granitic clasts. Two sediment samples, with different U(VI) concentrations and intraparticle mass transfer properties, were leached with advective flows of three different solutions. The influent solutions were all calcite-saturated and in equilibrium with atmospheric CO2. One solution was prepared from DI water, the second was a synthetic groundwater (SGW) with elevated Na that mimicked groundwater at the Hanford site, and the third was the same SGW but with both elevated Na and Si. The latter two solutions were employed, in part, to test the effect of saturation state on U(VI) release. For both sediments, and all three electrolytes, there was an initial rapid release of U(VI) to the advecting solution followed by slower near steady-state release. U(VI)aq concentrations increased during subsequent stop-flow events. The electrolytes with elevated Na and Si depressed U(VL)aq concentrations in effluent solutions. Effluent U(VI)aq concentrations for both sediments and all three electrolytes were simulated reasonably well by a three domain model (the advecting fluid, fractures, and matrix) that coupled U(VI) dissolution, intraparticle U(VI)aq diffusion, and interparticle advection, where diffusion and dissolution properties were parameterized in a previous batch study.

  13. Quantification of numerical diffusivity due to TVD schemes in the advection equation

    NASA Astrophysics Data System (ADS)

    Bidadi, Shreyas; Rani, Sarma L.

    2014-03-01

    In this study, the numerical diffusivity νnum inherent to the Roe-MUSCL scheme has been quantified for the scalar advection equation. The Roe-MUSCL scheme employed is a combination of: (1) the standard extension of the original Roe's formulation to the advection equation, and (2) van Leer's Monotone Upwind Scheme for Conservation Laws (MUSCL) technique that applies a linear variable reconstruction in a cell along with a scaled limiter function. An explicit expression is derived for the numerical diffusivity in terms of the limiter function, the distance between the cell centers on either side of a face, and the face-normal velocity. The numerical diffusivity formulation shows that a scaled limiter function is more appropriate for MUSCL in order to consistently recover the central-differenced flux at the maximum value of the limiter. The significance of the scaling factor is revealed when the Roe-MUSCL scheme, originally developed for 1-D scenarios, is applied to 2-D scalar advection problems. It is seen that without the scaling factor, the MUSCL scheme may not necessarily be monotonic in multi-dimensional scenarios. Numerical diffusivities of the minmod, superbee, van Leer and Barth-Jesperson TVD limiters were quantified for four problems: 1-D advection of a step function profile, and 2-D advection of step, sinusoidal, and double-step profiles. For all the cases, it is shown that the superbee scheme provides the lowest numerical diffusivity that is also most confined to the vicinity of the discontinuity. The minmod scheme is the most diffusive, as well as active in regions away from high gradients. As expected, the grid resolution study demonstrates that the magnitude and the spatial extent of the numerical diffusivity decrease with increasing resolution.

  14. Improving estimates of ecosystem metabolism by reducing effects of tidal advection on dissolved oxygen time series-Abstract

    EPA Science Inventory

    Continuous time series of dissolved oxygen (DO) have been used to compute estimates of metabolism in aquatic ecosystems. Central to this open water or "Odum" method is the assumption that the DO time is not strongly affected by advection and that effects due to advection or mixin...

  15. Explicit and implicit forms of differential quadrature method for advection-diffusion equation with variable coefficients in semi-infinite domain

    NASA Astrophysics Data System (ADS)

    Gharehbaghi, Amin

    2016-10-01

    In this paper, a numerical solution of one-dimensional time-dependent advection-diffusion equation with variable coefficients in semi-infinite domain is presented by using the differential quadrature method. Both the explicit and implicit approaches are provided. Totally, two solute dispersion problems are employed to simulate various conditions. The inhomogeneity of the domain is supplied by the spatially dependent flow. The problem domains are modeled with Chebyshev-Gauss-Lobatto grid points. In order to examine the accuracy and the efficiency of the suggested explicit and implicit approaches, analytical solutions, which are presented in the literature, are employed. In addition, the results of the above-mentioned method are compared with outcomes of the finite difference method. The results show that both of the explicit and implicit forms of the differential quadrature method are efficient, robust and reliable. But between these two forms, numerical predictions of implicit form are more accurate than explicit form.

  16. The inverse problem of the kinetics of redox sorption taking into account the size of ultradisperse metal particles in an electron-ion exchanger

    NASA Astrophysics Data System (ADS)

    Konev, D. V.; Fertikov, V. V.; Kravchenko, T. A.; Kalinichev, A. I.

    2008-08-01

    The inverse kinetic problem of reducing sorption of molecular oxygen by a copper-containing electron-ion exchanger was formulated and solved taking into account the influence of the size of ultradisperse metal particles on the total rate of the process. These results were used to determine the inside diffusion coefficient of oxygen and rate constants for its interaction with disperse copper from the experimental kinetic curves. The diffusion coefficient obtained was compared with the result of an independent experiment. The kinetic parameters found were used to perform a theoretical analysis of the contributions of various factors influencing the rate of the process under consideration. The reason for the experimentally observed acceleration of the reducing sorption of oxygen by a high-dispersity electron-ion exchanger sample was shown to be an increase in the surface area of metal because of a decrease in the size of its particles and a comparatively high copper content in the surface layer of grains.

  17. Validating Mechanistic Sorption Model Parameters and Processes for Reactive Transport in Alluvium

    SciTech Connect

    Zavarin, M; Roberts, S K; Rose, T P; Phinney, D L

    2002-05-02

    The laboratory batch and flow-through experiments presented in this report provide a basis for validating the mechanistic surface complexation and ion exchange model we use in our hydrologic source term (HST) simulations. Batch sorption experiments were used to examine the effect of solution composition on sorption. Flow-through experiments provided for an analysis of the transport behavior of sorbing elements and tracers which includes dispersion and fluid accessibility effects. Analysis of downstream flow-through column fluids allowed for evaluation of weakly-sorbing element transport. Secondary Ion Mass Spectrometry (SIMS) analysis of the core after completion of the flow-through experiments permitted the evaluation of transport of strongly sorbing elements. A comparison between these data and model predictions provides additional constraints to our model and improves our confidence in near-field HST model parameters. In general, cesium, strontium, samarium, europium, neptunium, and uranium behavior could be accurately predicted using our mechanistic approach but only after some adjustment was made to the model parameters. The required adjustments included a reduction in strontium affinity for smectite, an increase in cesium affinity for smectite and illite, a reduction in iron oxide and calcite reactive surface area, and a change in clinoptilolite reaction constants to reflect a more recently published set of data. In general, these adjustments are justifiable because they fall within a range consistent with our understanding of the parameter uncertainties. These modeling results suggest that the uncertainty in the sorption model parameters must be accounted for to validate the mechanistic approach. The uncertainties in predicting the sorptive behavior of U-1a and UE-5n alluvium also suggest that these uncertainties must be propagated to nearfield HST and large-scale corrective action unit (CAU) models.

  18. Mathematical analysis of electromigration dispersion fronts

    NASA Astrophysics Data System (ADS)

    Christov, Ivan C.

    2016-11-01

    It is of interest to understand traveling electromigration wave phenomena, such as isotachophoretic boundaries, because of their applications in electrophoretic separation methods. To this end, we construct exact solutions to an unusual nonlinear advection-diffusion equation arising in the study of Taylor-Aris (also known as shear) dispersion due to electroosmotic flow during electromigration in a capillary. An exact reduction to a Darboux equation is found under a traveling-wave anzats. The equilibria of this ordinary differential equation are analyzed, showing that their stability is determined solely by the (dimensionless) wave speed without regard to any (dimensionless) physical parameters. Integral curves, connecting the appropriate equilibria of the Darboux equation that governs traveling waves, are constructed, which in turn are shown to be asymmetric kink solutions (i.e., non-Taylor shocks). Furthermore, it is shown that the governing Darboux equation exhibits bistability, which leads to two coexisting non-negative kink solutions for (dimensionless) wave speeds greater than unity.

  19. Sorption-cooled continuous miniature dilution refrigeration for astrophysical applications

    NASA Astrophysics Data System (ADS)

    May, Andrew J.; Calisse, Paolo G.; Coppi, Gabriele; Haynes, Vic; Martinis, Lorenzo; McCulloch, Mark A.; Melhuish, Simon J.; Piccirillo, Lucio

    2016-07-01

    A progress report is provided on the development of a tiltable continuous miniature dilution refrigerator and associated 3He/4He sorption coolers. These systems are currently being developed to provide sub-Kelvin cooling of the bolometer arrays for several ground- and balloon-based experiments which aim to measure the polarization of the Cosmic Microwave Background (QUBIC, LSPE and POLARBEAR-2). The novel tiltable miniaturised system benefits from a lack of external circulation pumps and a mechanically simple design. The condenser of the twin-pumped recirculating diluter is cooled continuously by two 3He/4He sorption coolers. The sorption pumps are operated by convective heat switches. The dilution unit features a thermally separated mixing chamber, still and step heat exchangers. The designs and analyses of both the sorption coolers and the diluter are reported; both systems have been manufactured and are presently under test.

  20. Sorption kinetics and mechanism of various oils into kapok assembly.

    PubMed

    Dong, Ting; Wang, Fumei; Xu, Guangbiao

    2015-02-15

    Sorption rates of kapok fibers on different oils, such as diesel, cooking oil, used motor oil, and motor oil, were quantitatively evaluated by using a wicking method. Kapok fibers absorbing different oils exhibited large differences in terms sorption coefficients. Microscopic observations of oil wetting on a single kapok showed that the four oils had varying wettability and adhesiveness to kapok, but that all of them penetrated into kapok lumens quickly because of the fiber's low surface energy, which was 40.64 mN/m, and extreme hydrophobicity, with a water contact angle up to 151°. After treatment with chloroform, there were slight changes in oil absorbencies to kapok, but the sorption coefficients for the four oils increased markedly. SEM demonstrated that chloroform treatments caused the smooth surface of the kapok fibers to become highly roughened, with densely vertical grooves that provided more available surface and a larger driving force for oil sorption through the fiber assembly.

  1. Sorption of chlorobenzenes to cape cod aquifer sediments

    USGS Publications Warehouse

    Barber, L.B.

    1994-01-01

    Sorption of tetra- and pentachlorobenzene by sediment from a glacial outwash aquifer on Cape Cod, MA, was evaluated. Particle size and mineralogical fractions (separated based on paramagnetic susceptibility) were characterized with respect to sediment organic carbon (SOC), mineralogy, surface area, metal oxide coatings, and spatial variability. SOC increases by a factor of 10 as particle size decreases from 500-1000 to ?? 25 % in the <63-??m fraction, and SOC is preferentially associated with the magnetic minerals. Sorption increases with decreasing particle size (increasing SOC, magnetic minerals, surface area, and metal oxyhydroxides), and the magnetic mineral fraction has greater sorption than the bulk or nonmagnetic fractions. Removal of SOC decreases sorption proportional to the decrease in SOC and results in a nonlinear isotherm.

  2. Evaluation of hydride compressor elements for the Planck sorption cryocooler

    NASA Technical Reports Server (NTRS)

    Bowman, R. C.; Prina, M.; Barber, D. S.; Bhandari, P.; Crumb, D.; Loc, A. S.; Morgante, G.; Reiter, J. W.; Schmelzel, M. E.

    2002-01-01

    Hydrogen sorption crycoolers are being developed for the European Space Agency Planck mission to provide nominal 19 K cooling to instruments for measuring the temperature anisotropy of the cosmic microwave background with extreme sensitivity and resolution.

  3. SPECTROSCOPIC STUDY OF SORPTION OF NITROGEN HETEROCYCLIC COMPOUNDS ON PHYLLOSILICATES

    EPA Science Inventory

    The present study focused on understanding the sorption characteristics of acridine (AcN)and acridine-9-carboxylic acid (AcNCOOH), two typical nitrogen heterocyclic compounds (NHCs), on well-characterized phyllosilicates (hectorite, saponite, and muscovite). Results presented in...

  4. Kinetics of plutonium and americium sorption to natural clay.

    PubMed

    Lujanienė, Galina; Beneš, Petr; Štamberg, Karel; Ščiglo, Tomas

    2012-06-01

    Kinetics of Pu(IV) and Am(III) sorption from natural groundwater to three types of clays were studied at trace concentrations of the elements. Higher K(d) values were determined for sorption of Pu than of Am, and no clear dependence of the K(d) values and the kinetic coefficients on the composition of the clays can be deduced. Kinetic data evaluated by models for six different control processes indicated a sorption mechanism controlled by Pu or Am diffusion in the inert layer on the surface of the clays. Apart from the kinetics of the elements sorption, time-dependent changes in their bonding nature were also studied using a sequential extraction. It was found that Pu(IV) was predominantly associated with amorphous and crystalline Fe oxides as well as natural organic matter sites on the clays, whereas in the case of Am(III) the exchangeable and carbonate sites played the principal role.

  5. SORPTION ON WASTEWATER SOLIDS: ELIMINATION OF BIOLOGICAL ACTIVITY

    EPA Science Inventory

    Sorption was found to be greatly affected by the biological activity in wastewater solids. wo experimental techniques, cyanide treatment and pasteurization, were developed for eliminating the biological activity during isotherm measurements. oth methods are effective; however, pa...

  6. Sorption of cesium ions by nanostructured calcium aluminosilicates

    NASA Astrophysics Data System (ADS)

    Gordienko, P. S.; Shabalin, I. A.; Yarusova, S. B.; Suponina, A. P.; Zhevtun, I. G.

    2016-10-01

    Data on the sorption properties of synthetic calcium aluminosilicates (CASes) with Al: Si ratios of 2: 2, 2: 6, and 2: 10, fabricated within the multicomponent system CaCl2-AlCl3-KOM-SiO2-H2O, are presented. Isotherms of the sorption of Cs+ ions from aqueous solutions with Cs+ concentrations of 0.2 to 6.0 mmol L-1 are analyzed. The CAS maximum sorption capacity and the Langmuir constants are determined. Kinetic data are obtained, and the energy of cation-exchange activation upon the sorption of Cs+ ions is determined. The effect of a salt background (1% KCl + 6% NaCl) has on the values of distribution coefficient ( K d) and the degree of Cs+ ion removal is established.

  7. Sorption properties of greenwaste biochar for two triazine pesticides.

    PubMed

    Zheng, Wei; Guo, Mingxin; Chow, Teresa; Bennett, Douglas N; Rajagopalan, Nandakishore

    2010-09-15

    Biochar is a carbon-rich product generated from biomass through pyrolysis. This study evaluated the ability of an unmodified biochar to sorb two triazine pesticides - atrazine and simazine, and thereby explored potential environmental values of biochar on mitigating pesticide pollution in agricultural production and removing contaminants from wastewater. A greenwaste biochar was produced by heating waste biomass under the oxygen-limited condition at 450 degrees C. The effects of several experimental parameters, including biochar particle size, contact time, solid/solution ratio, and solution pH on the sorption of atrazine and simazine were comprehensively investigated. The biochar with small particle size needed less time to reach sorption equilibrium. The sorption affinity of the biochar for the two pesticides increased with decreasing solid/solution ratio. The sorbed amounts (C(s)) of atrazine and simazine increased from 451 to 1158 mg/kg and 243 to 1066 mg/kg, respectively, when the solid/solution ratio decreased from 1:50 to 1:1000 (g/mL). The sorption of the biochar for both pesticides was favored by low pH. The sorption isotherms of atrazine and simazine on the biochar are nonlinear and follow a Freundlich model. When atrazine and simazine co-existed, a competitive sorption occurred between these two pesticides on the biochar, reflecting a decrease in sorption capacity (K(f)) from 435 to 286 for atrazine and from 514 to 212 for simazine. Combined adsorption and partition mechanisms well depicted sorption of atrazine and simazine on carbonized and noncarbonized fractions of the biochar in the single-solute and co-solute systems.

  8. [Sorption of amino acids from aqueous solutions on activated charcoal].

    PubMed

    Nekliudov, A D; Tsibanov, V V

    1985-03-01

    Various methods for quantitative description of amino acid sorption from solutions for parenteral nutrition on activated charcoal were studied under dynamic and static conditions. With the use of the well-known Freindlich and Langmuir absorption isotherms it was shown to be possible to describe in a simplified way the complex multicomponent process of sorption of the amino acids and to estimate their loss at the filtration stage.

  9. Numerical Experiments on Advective Transport in Large Three-Dimensional Discrete Fracture Networks

    NASA Astrophysics Data System (ADS)

    Makedonska, N.; Painter, S. L.; Karra, S.; Gable, C. W.

    2013-12-01

    Modeling of flow and solute transport in discrete fracture networks is an important approach for understanding the migration of contaminants in impermeable hard rocks such as granite, where fractures provide dominant flow and transport pathways. The discrete fracture network (DFN) model attempts to mimic discrete pathways for fluid flow through a fractured low-permeable rock mass, and may be combined with particle tracking simulations to address solute transport. However, experience has shown that it is challenging to obtain accurate transport results in three-dimensional DFNs because of the high computational burden and difficulty in constructing a high-quality unstructured computational mesh on simulated fractures. An integrated DFN meshing [1], flow, and particle tracking [2] simulation capability that enables accurate flow and particle tracking simulation on large DFNs has recently been developed. The new capability has been used in numerical experiments on advective transport in large DFNs with tens of thousands of fractures and millions of computational cells. The modeling procedure starts from the fracture network generation using a stochastic model derived from site data. A high-quality computational mesh is then generated [1]. Flow is then solved using the highly parallel PFLOTRAN [3] code. PFLOTRAN uses the finite volume approach, which is locally mass conserving and thus eliminates mass balance problems during particle tracking. The flow solver provides the scalar fluxes on each control volume face. From the obtained fluxes the Darcy velocity is reconstructed for each node in the network [4]. Velocities can then be continuously interpolated to any point in the domain of interest, thus enabling random walk particle tracking. In order to describe the flow field on fractures intersections, the control volume cells on intersections are split into four planar polygons, where each polygon corresponds to a piece of a fracture near the intersection line. Thus

  10. Single-relaxation-time lattice Boltzmann scheme for advection-diffusion problems with large diffusion-coefficient heterogeneities and high-advection transport.

    PubMed

    Perko, Janez; Patel, Ravi A

    2014-05-01

    The paper presents an approach that extends the flexibility of the standard lattice Boltzmann single relaxation time scheme in terms of spatial variation of dissipative terms (e.g., diffusion coefficient) and stability for high Péclet mass transfer problems. Spatial variability of diffusion coefficient in SRT is typically accommodated through the variation of relaxation time during the collision step. This method is effective but cannot deal with large diffusion coefficient variations, which can span over several orders of magnitude in some natural systems. The approach explores an alternative way of dealing with large diffusion coefficient variations in advection-diffusion transport systems by introducing so-called diffusion velocity. The diffusion velocity is essentially an additional convective term that replaces variations in diffusion coefficients vis-à-vis a chosen reference diffusion coefficient which defines the simulation time step. Special attention is paid to the main idea behind the diffusion velocity formulation and its implementation into the lattice Boltzmann framework. Finally, the performance, stability, and accuracy of the diffusion velocity formulation are discussed via several advection-diffusion transport benchmark examples. These examples demonstrate improved stability and flexibility of the proposed scheme with marginal consequences on the numerical performance.

  11. Surface complexation modeling of americium sorption onto volcanic tuff.

    PubMed

    Ding, M; Kelkar, S; Meijer, A

    2014-10-01

    Results of a surface complexation model (SCM) for americium sorption on volcanic rocks (devitrified and zeolitic tuff) are presented. The model was developed using PHREEQC and based on laboratory data for americium sorption on quartz. Available data for sorption of americium on quartz as a function of pH in dilute groundwater can be modeled with two surface reactions involving an americium sulfate and an americium carbonate complex. It was assumed in applying the model to volcanic rocks from Yucca Mountain, that the surface properties of volcanic rocks can be represented by a quartz surface. Using groundwaters compositionally representative of Yucca Mountain, americium sorption distribution coefficient (Kd, L/Kg) values were calculated as function of pH. These Kd values are close to the experimentally determined Kd values for americium sorption on volcanic rocks, decreasing with increasing pH in the pH range from 7 to 9. The surface complexation constants, derived in this study, allow prediction of sorption of americium in a natural complex system, taking into account the inherent uncertainty associated with geochemical conditions that occur along transport pathways.

  12. Sorption of aromatic organic pollutants to grasses from water

    USGS Publications Warehouse

    Barbour, J.P.; Smith, J.A.; Chiou, C.T.

    2005-01-01

    The influence of plant lipids on the equilibrium sorption of three aromatic solutes from water was studied. The plant-water sorption isotherms of benzene, 1,2-dichlorobenzene, and phenanthrene were measured over a large range of solute concentrations using sealed vessels containing water, dried plant material, and solute. The plant materials studied include the shoots of annual rye, tall fescue, red fescue, and spinach as well as the roots of annual rye. Seven out of eight sorption isotherms were linear with no evidence of competitive effects between the solutes. For a given plant type, the sorption coefficient increased with decreasing solute water solubility. For a given solute, sorption increased with increasing plant lipid content. The estimated lipid-water partition coefficients of individual solutes were found to be significantly greater than the corresponding octanol-water partition coefficients. This indicates that plant lipids are a more effective partition solvent than octanol for the studied aromatic compounds. As expected, the solute lipid-water partition coefficients were log-linearly related to the respective water solubilities. For the compounds studied, partitioning into the lipids is believed to be the primary sorption mechanism. ?? 2005 American Chemical Society.

  13. Effect of sorption on flocculation kinetics: Experimental studies

    SciTech Connect

    Subramaniam, K.; Yiacoumi, S.; Tsouris, C.

    1997-11-01

    Sorption of copper and cadmium ions from aqueous solutions by ferric oxide particles was studied using batch equilibrium and kinetic experiments. The sorption process was found to be pH dependent, with the uptake increasing at high pH values. An increase in equilibrium pH was observed when the initial pH was in the acidic range and a decrease from initial values was observed in the basic range, in the case of both copper and cadmium sorption. The former phenomenon is due to competition between metal and proton binding and the latter is due to precipitation mechanisms at high initial pH values. A large increase in the zeta potential of the particles from baseline values was observed during equilibrium sorption. This increase occurs as a result of surface charge neutralization due to metal ion uptake. Particle destabilization appears to occur as a result of metal ion sorption. Kinetic experiments indicate that the uptake of copper by ferric oxide particles is a slow process. pH histories were similar to those obtained in the sorption equilibrium experiments. Changes in the size distribution of the ferric oxide particles due to aggregate formation during uptake of ions is observed in the kinetic studies. These findings indicate a potential role of metal ion uptake in particle flocculation kinetics through alteration of the surface electrostatic potential.

  14. The sorption of silver by poorly crystallized manganese oxides

    USGS Publications Warehouse

    Anderson, B.J.; Jenne, E.A.; Chao, T.T.

    1973-01-01

    The sorption of silver by poorly crystallized manganese oxides was studied using synthesized samples of three members of the manganous manganite (birnessite) group, of different chemical composition and crystallinity, and a poorly organized ??-MnO2. All four oxides sorbed significant quantities of silver. The manganous manganites showed the greatest sorption (up to 0.5 moles silver/mole MnOx at pH 7) while the ??-MnO2 showed the least (0.3 moles silver/ mole MnOx at pH 7). Sorption of silver was adequately described by the Langmuir equation over a considerable concentration range. The relationship failed at low pH values and high equilibrium silver concentrations. The sorption capacity showed a direct relationship with pH. However, the rate of increase of sorption capacity decreased at the higher pH values. Silver sorption maxima. were not directly related to surface area but appeared to vary with the amount of occluded sodium and potassium present in the manganese oxide. The important processes involved in the uptake of silver by the four poorly crystallized manganese oxides ara considered to be surface exchange for manganese, potassium and sodium as well as exchange for structural manganese, potassium and sodium. ?? 1973.

  15. Chitosan-glutaraldehyde copolymers and their sorption properties.

    PubMed

    Poon, Louis; Wilson, Lee D; Headley, John V

    2014-08-30

    This study reports the preparation of chitosan-glutaraldehyde (Chi-Glu) copolymers at modified reaction conditions such as the temperature prior to gelation, pH, and reagent ratios. The chitosan copolymers were characterized using infrared spectroscopy (FT-IR), CHN elemental analysis, and thermal gravimetric analysis (TGA). Evidence of self-polymerized glutaraldehyde was supported by CHN and TGA results. The sorption properties of Chi-Glu copolymers were evaluated in aqueous solutions containing p-nitrophenol at variable pH (4.6, 6.6, and 9.0). The sorption properties of the copolymers correlated with the level of the accessibility of the sorption sites in accordance with the relative cross-linker content. The relative sorption capacity of the Chi-Glu copolymers increases as the level of cross-linking increases. Chitosan displays the lowest sorptive uptake while an optimal sorption capacity was concluded at the 4:1 glutaraldehyde:chitosan monomer mole ratio, in close agreement with the three reactive sites (i.e. OH/NH) per glucosamine monomer. The PNP dye probe was determined to bind to chitosan through an electrostatic interaction due to the increased sorption capacity of the phenolate anion, as evidenced by the change in pH from 4.6 to 9.0.

  16. Particulate export vs lateral advection in the Antarctic Polar Front (Southern Pacific Ocean)

    NASA Astrophysics Data System (ADS)

    Tesi, T.; Langone, L.; Ravaioli, M.; Capotondi, L.; Giglio, F.

    2012-04-01

    The overarching goal of our study was to describe and quantify the influence of lateral advection relative to the vertical export in the Antarctic Polar Front (Southern Pacific Ocean). In areas where lateral advection of particulate material is significant, budgets of bioactive elements can be inaccurate if fluxes through the water column and to the seabed are exclusively interpreted as passive sinking of particles. However, detailed information on the influence of lateral advection in the water column in the southern ocean is lacking. With this in mind, our study focused between the twilight zone (i.e. mesopelagic) and the benthic nepheloid layer to understand the relative importance of lateral flux with increasing water depth. Measurements were performed south of the Antarctic Polar Front for 1 year (January 10th 1999-January 3rd 2000) at 900, 1300, 2400, and 3700 m from the sea surface. The study was carried out using a 3.5 km long mooring line instrumented with sediment traps, current meters and sensors of temperature and conductivity. Sediment trap samples were characterized via several parameters including total mass flux, elemental composition (organic carbon, total nitrogen, biogenic silica, and calcium carbonate), concentration of metals (aluminum, iron, barium, and manganese), 210Pb activity, and foraminifera taxonomy. High fluxes of biogenic particles were observed in both summer 1999 and 2000 as a result of seasonal algal blooms associated with sea ice retreat and water column stratification. During no-productive periods, several high energy events occurred and resulted in advecting resuspended biogenic particles from flat-topped summits of the Pacific Antarctic Ridge. Whereas the distance between seabed and uppermost sediment traps was sufficient to avoid lateral advection processes, resuspension was significant in the lowermost sediment traps accounting for ~60 and ~90% of the material caught at 2400 and 3700 m, respectively. Samples collected during

  17. Sorption, degradation and transport phenomena of alcohol ethoxysulfates in agricultural soils. Laboratory studies.

    PubMed

    Fernández-Ramos, C; Rodríguez-Gómez, R; Reis, M S; Zafra-Gómez, A; Verge, C; de Ferrer, J A; Pérez-Pascual, M; Vílchez, J L

    2017-03-01

    In the present work, laboratory studies were conducted in order to determine and model the sorption, degradation and transport processes of alcohol ethoxysulfates (AES), one of the most important groups of anionic surfactants. Adsorption/desorption isotherms were obtained for several structurally related AES ethoxymers (homologue AES-C12En with n = 0-10 ethoxymer units and homologue AES-C14En with n = 0-7 ethoxymer units) using a batch equilibrium method. Data were fitted to a linear and a Freundlich isotherm models. Additionally, experiments in continuous-flow soil columns were also carried out and the breakthrough curves observed for each compound were studied. Breakthrough curves were used to determine the fundamental parameters of the transport model (hydrodynamic dispersion coefficient, degradation rate constant and adsorption/desorption isotherm slope), that is the main phenomena that take place simultaneously when AES move through agricultural soil. When the results obtained for the AES ethoxymers are combined, they reveal a clear and consistent trend towards a sorption increase with the number of ethoxylated units and with the length of the alkyl chain that opens the possibility to estimate the values of the transport parameters for other structurally related ethoxymers.

  18. Interaction between chitosan and uranyl ions. Role of physical and physicochemical parameters on the kinetics of sorption

    SciTech Connect

    Piron, E. |; Accominotti, M.; Domard, A.

    1997-03-19

    This work corresponds to the first part of our studies on the interactions between chitosan particles dispersed in water and uranyl ions. The measurements were obtained by ICP, and we considered the role of various physical and physicochemical parameters related to chitosan. We showed that the crystallinity, the particle dimensions, and the swelling in water of chitosan are parameters which are connected together and govern the kinetic laws of metal diffusion and sorption. The molecular mobility of the polymer chains is then essential parameter. 31 refs., 5 figs., 3 tabs.

  19. Smelling home can prevent dispersal of reef fish larvae

    PubMed Central

    Gerlach, Gabriele; Atema, Jelle; Kingsford, Michael J.; Black, Kerry P.; Miller-Sims, Vanessa

    2007-01-01

    Many marine fish and invertebrates show a dual life history where settled adults produce dispersing larvae. The planktonic nature of the early larval stages suggests a passive dispersal model where ocean currents would quickly cause panmixis over large spatial scales and prevent isolation of populations, a prerequisite for speciation. However, high biodiversity and species abundance in coral reefs contradict this panmixis hypothesis. Although ocean currents are a major force in larval dispersal, recent studies show far greater retention than predicted by advection models. We investigated the role of animal behavior in retention and homing of coral reef fish larvae resulting in two important discoveries: (i) Settling larvae are capable of olfactory discrimination and prefer the odor of their home reef, thereby demonstrating to us that nearby reefs smell different. (ii) Whereas one species showed panmixis as predicted from our advection model, another species showed significant genetic population substructure suggestive of strong homing. Thus, the smell of reefs could allow larvae to choose currents that return them to reefs in general and natal reefs in particular. As a consequence, reef populations can develop genetic differences that might lead to reproductive isolation. PMID:17213323

  20. Applying Dispersive Changes to Lagrangian Particles in Groundwater Transport Models

    USGS Publications Warehouse

    Konikow, L.F.

    2010-01-01

    Method-of-characteristics groundwater transport models require that changes in concentrations computed within an Eulerian framework to account for dispersion be transferred to moving particles used to simulate advective transport. A new algorithm was developed to accomplish this transfer between nodal values and advecting particles more precisely and realistically compared to currently used methods. The new method scales the changes and adjustments of particle concentrations relative to limiting bounds of concentration values determined from the population of adjacent nodal values. The method precludes unrealistic undershoot or overshoot for concentrations of individual particles. In the new method, if dispersion causes cell concentrations to decrease during a time step, those particles in the cell having the highest concentration will decrease the most, and those with the lowest concentration will decrease the least. The converse is true if dispersion is causing concentrations to increase. Furthermore, if the initial concentration on a particle is outside the range of the adjacent nodal values, it will automatically be adjusted in the direction of the acceptable range of values. The new method is inherently mass conservative. ?? US Government 2010.

  1. Applying dispersive changes to Lagrangian particles in groundwater transport models

    USGS Publications Warehouse

    Konikow, Leonard F.

    2010-01-01

    Method-of-characteristics groundwater transport models require that changes in concentrations computed within an Eulerian framework to account for dispersion be transferred to moving particles used to simulate advective transport. A new algorithm was developed to accomplish this transfer between nodal values and advecting particles more precisely and realistically compared to currently used methods. The new method scales the changes and adjustments of particle concentrations relative to limiting bounds of concentration values determined from the population of adjacent nodal values. The method precludes unrealistic undershoot or overshoot for concentrations of individual particles. In the new method, if dispersion causes cell concentrations to decrease during a time step, those particles in the cell having the highest concentration will decrease the most, and those with the lowest concentration will decrease the least. The converse is true if dispersion is causing concentrations to increase. Furthermore, if the initial concentration on a particle is outside the range of the adjacent nodal values, it will automatically be adjusted in the direction of the acceptable range of values. The new method is inherently mass conservative.

  2. Measurement of Sorption-Induced Strain

    SciTech Connect

    Eric P. Robertson; Richard L. Christiansen

    2005-05-01

    Strain caused by the adsorption of gases was measured in samples of subbituminous coal from the Powder River basin of Wyoming, U.S.A. and high-volatile bituminous coal from east-central Utah, U.S.A. using an apparatus developed jointly at the Idaho National Laboratory (Idaho Falls, Idaho, U.S.A.) and Colorado School of Mines (Golden, Colorado, U.S.A.). The apparatus can be used to measure strain on multiple small coal samples based on the optical detection of the longitudinal strain instead of the more common usage of strain gauges, which require larger samples and longer equilibration times. With this apparatus, we showed that the swelling and shrinkage processes were reversible and that accurate strain data could be obtained in a shortened amount of time. A suite of strain curves was generated for these coals using gases that included carbon dioxide, nitrogen, methane, helium, and various mixtures of these gases. A Langmuir-type equation was applied to satisfactorily model the strain data obtained for pure gases. The sorption-induced strain measured in the subbituminous coal was larger than the high-volatile bituminous coal for all gases tested over the range of pressures used in the experimentation, with the CO2-induced strain for the subbituminous coal over twice as great at the bituminous coal.

  3. Water sorption mechanisms for MIS materials.

    SciTech Connect

    Veirs, D. K.; Mason, R. E.; Erickson, R. M.

    2002-01-01

    The fundamental processes that control the amount of water sorbed by impure plutonium-containing materials after calcination are reviewed. Of particular interest is the amount of and rate of moisture sorption at 1000 PPMv (parts-per-million vapor; -3% RH at 25 'C) and 10,000 PPMv (32% RH at 25 'C). Pure plutonium oxide powders will remain below the 0.5 wt% criterion for packaging in the DOE 3013 Standard at both water vapor concentrations [I]. Deliquescent salts that have been observed in calcined materials by DOES Materials Identification and Surveillance (MIS) program will exceed the 0.5 wt% criterion at 10,000 PPMv and will meet that standard at 1,000 PPMv. Hydrated salts will exceed the 0.5 wt% criterion at all technologically achievable water vapor concentrations if allowed to reach equilibrium. Controlling the moisture availability by controlling the atmospheric content at 1000 PPM' and limiting the access to atmospheric moisture after stabilization through the use of a properly configured stabilization boat will minimize moisture uptake by these materials.

  4. Selenite sorption by carbonate substituted apatite

    SciTech Connect

    Moore, Robert C.; Rigali, Mark J.; Brady, Patrick

    2016-08-31

    The sorption of selenite, SeO32–, by carbonate substituted hydroxylapatite was investigated using batch kinetic and equilibrium experiments. The carbonate substituted hydroxylapatite was prepared by a precipitation method and characterized by SEM, XRD, FT-IR, TGA, BET and solubility measurements. The material is poorly crystalline, contains approximately 9.4% carbonate by weight and has a surface area of 210.2 m2/g. Uptake of selenite by the carbonated hydroxylapatite was approximately an order of magnitude higher than the uptake by uncarbonated hydroxylapatite reported in the literature. Distribution coefficients, Kd, determined for the carbonated apatite in this work ranged from approximately 4200 to over 14,000 L/kg. A comparison of the results from kinetic experiments performed in this work and literature kinetic data indicates the carbonated apatite synthesized in this study sorbed selenite 23 times faster than uncarbonated hydroxylapatite based on values normalized to the surface area of each material. Furthermore, the results indicate carbonated apatite is a potential candidate for use as a sorbent for pump-and-treat technologies, soil amendments or for use in permeable reactive barriers for the remediation of selenium contaminated sediments and groundwaters.

  5. Selenite sorption by carbonate substituted apatite

    DOE PAGES

    Moore, Robert C.; Rigali, Mark J.; Brady, Patrick

    2016-08-31

    The sorption of selenite, SeO32–, by carbonate substituted hydroxylapatite was investigated using batch kinetic and equilibrium experiments. The carbonate substituted hydroxylapatite was prepared by a precipitation method and characterized by SEM, XRD, FT-IR, TGA, BET and solubility measurements. The material is poorly crystalline, contains approximately 9.4% carbonate by weight and has a surface area of 210.2 m2/g. Uptake of selenite by the carbonated hydroxylapatite was approximately an order of magnitude higher than the uptake by uncarbonated hydroxylapatite reported in the literature. Distribution coefficients, Kd, determined for the carbonated apatite in this work ranged from approximately 4200 to over 14,000 L/kg.more » A comparison of the results from kinetic experiments performed in this work and literature kinetic data indicates the carbonated apatite synthesized in this study sorbed selenite 23 times faster than uncarbonated hydroxylapatite based on values normalized to the surface area of each material. Furthermore, the results indicate carbonated apatite is a potential candidate for use as a sorbent for pump-and-treat technologies, soil amendments or for use in permeable reactive barriers for the remediation of selenium contaminated sediments and groundwaters.« less

  6. CO2 Sorption to Subsingle Hydration Layer Montmorillonite Clay Studied by Excess Sorption and Neutron Diffraction Measurements

    SciTech Connect

    Rother, Gernot; Ilton, Eugene S.; Wallacher, Dirk; Hauβ, Thomas; Schaef, Herbert T.; Qafoku, Odeta; Rosso, Kevin M.; Felmy, Andrew R.; Krukowski, Elizabeth G.; Stack, Andrew G.; Grimm, Nico; Bodnar, Robert J.

    2013-01-02

    Geologic storage of CO2 requires that the caprock sealing the storage rock is highly impermeable to CO2. Swelling clays, which are important components of caprocks, may interact with CO2 leading to volume change and potentially impacting the seal quality. The interactions of supercritical (sc) CO2 with Na saturated montmorillonite clay containing a subsingle layer of water in the interlayer region have been studied by sorption and neutron diffraction techniques. The excess sorption isotherms show maxima at bulk CO2 densities of ≈0.15 g/cm3, followed by an approximately linear decrease of excess sorption to zero and negative values with increasing CO2 bulk density. Neutron diffraction experiments on the same clay sample measured interlayer spacing and composition. The results show that limited amounts of CO2 are sorbed into the interlayer region, leading to depression of the interlayer peak intensity and an increase of the d(001) spacing by ca. 0.5 Å. The density of CO2 in the clay pores is relatively stable over a wide range of CO2 pressures at a given temperature, indicating the formation of a clay-CO2 phase. Finally, at the excess sorption maximum, increasing CO2 sorption with decreasing temperature is observed while the high-pressure sorption properties exhibit weak temperature dependence.

  7. CO2 sorption to subsingle hydration layer montmorillonite clay studied by excess sorption and neutron diffraction measurements.

    PubMed

    Rother, Gernot; Ilton, Eugene S; Wallacher, Dirk; Hauβ, Thomas; Schaef, Herbert T; Qafoku, Odeta; Rosso, Kevin M; Felmy, Andrew R; Krukowski, Elizabeth G; Stack, Andrew G; Grimm, Nico; Bodnar, Robert J

    2013-01-02

    Geologic storage of CO(2) requires that the caprock sealing the storage rock is highly impermeable to CO(2). Swelling clays, which are important components of caprocks, may interact with CO(2) leading to volume change and potentially impacting the seal quality. The interactions of supercritical (sc) CO(2) with Na saturated montmorillonite clay containing a subsingle layer of water in the interlayer region have been studied by sorption and neutron diffraction techniques. The excess sorption isotherms show maxima at bulk CO(2) densities of ≈ 0.15 g/cm(3), followed by an approximately linear decrease of excess sorption to zero and negative values with increasing CO(2) bulk density. Neutron diffraction experiments on the same clay sample measured interlayer spacing and composition. The results show that limited amounts of CO(2) are sorbed into the interlayer region, leading to depression of the interlayer peak intensity and an increase of the d(001) spacing by ca. 0.5 Å. The density of CO(2) in the clay pores is relatively stable over a wide range of CO(2) pressures at a given temperature, indicating the formation of a clay-CO(2) phase. At the excess sorption maximum, increasing CO(2) sorption with decreasing temperature is observed while the high-pressure sorption properties exhibit weak temperature dependence.

  8. Estimation and correction of advection effects with single and multiple, conventional and Doppler radars

    NASA Technical Reports Server (NTRS)

    Gal-Chen, T.

    1981-01-01

    The laws of fluid motion are invariant under a Gallilean transformation. For a perfect observing system, the data analysis should, therefore, also be invariant under a Gallilean transformation. This invariance is often not preserved in practical observing systems. In this connection, it is often advisable to perform mesoscale analysis in a frame moving with respect to the earth's surface. In the present investigation the velocity of such a frame is referred to as an advection velocity. The investigation is concerned with remaining problems regarding the Gallilean transformation. The establishment of a frame of reference for the achievement of maximum coherence is considered, taking into account the case of given nonsimultaneous observations of scalars or Cartesian vectors. It is found that advection speed can be estimated objectively if a scalar or Cartesian vector can be observed directly and if, in addition, the time and position of each observation is approximately known.

  9. The effect of advection on the nutrient reservoir in the North Atlantic subtropical gyre.

    PubMed

    Palter, Jaime B; Lozier, M Susan; Barber, Richard T

    2005-09-29

    Though critically important in sustaining the ocean's biological pump, the cycling of nutrients in the subtropical gyres is poorly understood. The supply of nutrients to the sunlit surface layer of the ocean has traditionally been attributed solely to vertical processes. However, horizontal advection may also be important in establishing the availability of nutrients. Here we show that the production and advection of North Atlantic Subtropical Mode Water introduces spatial and temporal variability in the subsurface nutrient reservoir beneath the North Atlantic subtropical gyre. As the mode water is formed, its nutrients are depleted by biological utilization. When the depleted water mass is exported to the gyre, it injects a wedge of low-nutrient water into the upper layers of the ocean. Contrary to intuition, cold winters that promote deep convective mixing and vigorous mode water formation may diminish downstream primary productivity by altering the subsurface delivery of nutrients.

  10. Scalar variance decay in chaotic advection and Batchelor-regime turbulence

    NASA Astrophysics Data System (ADS)

    Fereday, D. R.; Haynes, P. H.; Wonhas, A.; Vassilicos, J. C.

    2002-03-01

    The decay of the variance of a diffusive scalar in chaotic advection flow (or equivalently Batchelor-regime turbulence) is analyzed using a model in which the advection is represented by an inhomogeneous baker's map on the unit square. The variance decays exponentially at large times, with a rate that has a finite limit as the diffusivity κ tends to zero and is determined by the action of the inhomogeneous map on the gravest Fourier modes in the scalar field. The decay rate predicted by recent theoretical work that follows scalar evolution in linear flow and then averages over all stretching histories is shown to be incorrect. The exponentially decaying scalar field is shown to have a spatial power spectrum of the form P(k)~k-σ at wave numbers small enough for diffusion to be neglected, with σ<1.

  11. Analytic radiative-advective equilibrium as a model for high-latitude climate

    NASA Astrophysics Data System (ADS)

    Cronin, Timothy W.; Jansen, Malte F.

    2016-01-01

    We propose radiative-advective equilibrium as a basic-state model for the high-latitude atmosphere. Temperature profiles are determined by a competition between stabilization by atmospheric shortwave absorption and advective heat flux convergence, and destabilization by surface shortwave absorption. We derive analytic expressions for temperature profiles, assuming power law atmospheric heating profiles as a function of pressure and two-stream windowed-gray longwave radiative transfer. We discuss example profiles with and without an atmospheric window and show that the sensitivity of surface temperature to forcing depends on the nature of the forcing, with greatest sensitivity to radiative forcing by increased optical thickness and least sensitivity to increased atmospheric heat transport. These differences in sensitivity of surface temperature to forcing can be explained in terms of a forcing-dependent lapse-rate feedback.

  12. Advective-diffusive motion on large scales from small-scale dynamics with an internal symmetry

    NASA Astrophysics Data System (ADS)

    Marino, Raffaele; Aurell, Erik

    2016-06-01

    We consider coupled diffusions in n -dimensional space and on a compact manifold and the resulting effective advective-diffusive motion on large scales in space. The effective drift (advection) and effective diffusion are determined as a solvability conditions in a multiscale analysis. As an example, we consider coupled diffusions in three-dimensional space and on the group manifold SO(3) of proper rotations, generalizing results obtained by H. Brenner [J. Colloid Interface Sci. 80, 548 (1981), 10.1016/0021-9797(81)90214-9]. We show in detail how the analysis can be conveniently carried out using local charts and invariance arguments. As a further example, we consider coupled diffusions in two-dimensional complex space and on the group manifold SU(2). We show that although the local operators may be the same as for SO(3), due to the global nature of the solvability conditions the resulting diffusion will differ and generally be more isotropic.

  13. Comparison of Nonlinear and Linear Stabilization Schemes for Advection-Diffusion Equations

    NASA Astrophysics Data System (ADS)

    Grove, R. R.; Heister, T.

    2015-12-01

    Accurately solving advection-diffusion equations that appear in the finite element discretization of a mantle convection simulation is an important computational issue to the computational geoscience community. This is because it allows for users studying mantle convection to create reliable simulations for something as small and simple as a 2D simulation on their personal laptop to something as complex as a massively parallel 3D simulation on their university supercomputer. Standard finite element discretizations of advection-diffusion equations introduce unphysical oscillations around steep gradients. Therefore, stabilization must be added to the discrete formulation to obtain correct solutions. Using the open source scientific library ASPECT, the SUPG and Entropy Viscosity schemes are compared using stationary and non-stationary test equations. Differences in maximum overshoot and undershoot, smear, and convergence orders are compared to see if improvements can be made to the existing numerical method existing in ASPECT.

  14. Two-dimensional atmospheric transport and chemistry model - Numerical experiments with a new advection algorithm

    NASA Technical Reports Server (NTRS)

    Shia, Run-Lie; Ha, Yuk Lung; Wen, Jun-Shan; Yung, Yuk L.

    1990-01-01

    Extensive testing of the advective scheme proposed by Prather (1986) has been carried out in support of the California Institute of Technology-Jet Propulsion Laboratory two-dimensional model of the middle atmosphere. The original scheme is generalized to include higher-order moments. In addition, it is shown how well the scheme works in the presence of chemistry as well as eddy diffusion. Six types of numerical experiments including simple clock motion and pure advection in two dimensions have been investigated in detail. By comparison with analytic solutions, it is shown that the new algorithm can faithfully preserve concentration profiles, has essentially no numerical diffusion, and is superior to a typical fourth-order finite difference scheme.

  15. Oxygen Advection and Diffusion in a Three Dimensional Vascular Anatomical Network

    PubMed Central

    Fang, Qianqian; Sakadžić, Sava; Ruvinskaya, Lana; Devor, Anna; Dale, Anders M.; Boas, David A.

    2008-01-01

    There is an increasing need for quantitative and computationally affordable models for analyzing tissue metabolism and hemodynamics in microvascular networks. In this work, we develop a hybrid model to solve for the time-varying oxygen advection-diffusion equation in the vessels and tissue. To obtain a three-dimensional temporal evolution of tissue oxygen concentration for realistic complex vessel networks, we used a graph-based advection model combined with a finite-element based diffusion model and an implicit time-advancing scheme. We validated this algorithm for both static and dynamic conditions. We also applied it to a complex vascular network obtained from a rodent somatosensory cortex. Qualitative agreement was found with in-vivo experiments. PMID:18958033

  16. Advection and the Efficiency of Spectral Energy Transfer in Two-Dimensional Turbulence.

    PubMed

    Fang, Lei; Ouellette, Nicholas T

    2016-09-02

    We report measurements of the geometric alignment of the small-scale turbulent stress and the large-scale rate of strain that together lead to the net flux of energy from small scales to large scales in two-dimensional turbulence. We find that the instantaneous alignment between these two tensors is weak and, thus, that the spectral transport of energy is inefficient. We show, however, that the strain rate is much better aligned with the stress at times in the past, suggesting that the differential advection of the two is responsible for the inefficient spectral transfer. We provide evidence for this conjecture by measuring the alignment statistics conditioned on weakly changing stress history. Our results give new insight into the relationship between scale-to-scale energy transfer, geometric alignment, and advection in turbulent flows.

  17. Reaction-diffusion-advection approach to spatially localized treadmilling aggregates of molecular motors

    NASA Astrophysics Data System (ADS)

    Yochelis, Arik; Bar-On, Tomer; Gov, Nir S.

    2016-04-01

    Unconventional myosins belong to a class of molecular motors that walk processively inside cellular protrusions towards the tips, on top of actin filament. Surprisingly, in addition, they also form retrograde moving self-organized aggregates. The qualitative properties of these aggregates are recapitulated by a mass conserving reaction-diffusion-advection model and admit two distinct families of modes: traveling waves and pulse trains. Unlike the traveling waves that are generated by a linear instability, pulses are nonlinear structures that propagate on top of linearly stable uniform backgrounds. Asymptotic analysis of isolated pulses via a simplified reaction-diffusion-advection variant on large periodic domains, allows to draw qualitative trends for pulse properties, such as the amplitude, width, and propagation speed. The results agree well with numerical integrations and are related to available empirical observations.

  18. Sorption cooling: a valid extension to passive cooling

    NASA Astrophysics Data System (ADS)

    Doornink, Jan; Burger, Johannes; ter Brake, Marcel

    2007-10-01

    Passive cooling has shown to be a very dependable cryogenic cooling method for space missions. Several missions employ passive radiators to cool down their delicate sensor systems for many years, without consuming power, without exporting vibrations or producing electromagnetic interference. So for a number of applications, passive cooling is a good choice. At lower temperatures, the passive coolers run into limitations that prohibit accommodation on a spacecraft. The approach to this issue has been to find a technology able to supplement passive cooling for lower temperatures, which maintains as much as possible of the advantages of passive coolers. Sorption cooling employs a closed cycle Joule-Thomson expansion process to achieve the cooling effect. Sorption cells perform the compression phase in this cycle. At a low temperature and pressure, these cells adsorb the working fluid. At a higher temperature they desorb the fluid and thus produce a high-pressure flow to the restriction in the cold stage. The sorption process selected for this application is of the physical type, which is completely reversible. It does not suffer from degradation as is the case with chemical sorption of e.g. hydrogen in metal hydrides. Sorption coolers include no moving parts except for some check valves, they export neither mechanical vibrations nor electromagnetic interference, and are potentially very dependable due to their simplicity. The required cooling temperature determines the type of working fluid to be applied. Sorption coolers can be used in conjunction with passive cooling for heat rejection at different levels. This paper starts with a brief discussion on applications of passive coolers in different types of orbits and the limitations on passive cooling at low cooling temperatures. Next, the working principle of sorption cooling is summarized. The DARWIN mission is chosen as an example application of sorption and passive cooling and special attention is paid to the

  19. Sorption cooling: A valid extension to passive cooling

    NASA Astrophysics Data System (ADS)

    Doornink, D. J.; Burger, J. F.; ter Brake, H. J. M.

    2008-05-01

    Passive cooling has shown to be a very dependable cryogenic cooling method for space missions. Several missions employ passive radiators to cool down their delicate sensor systems for many years, without consuming power, without exporting vibrations or producing electromagnetic interference. So for a number of applications, passive cooling is a good choice. At lower temperatures, the passive coolers run into limitations that prohibit accommodation on a spacecraft. The approach to this issue has been to find a technology able to supplement passive cooling for lower temperatures, which maintains as much as possible of the advantages of passive coolers. Sorption cooling employs a closed cycle Joule-Thomson expansion process to achieve the cooling effect. Sorption cells perform the compression phase in this cycle. At a low temperature and pressure, these cells adsorb the working fluid. At a higher temperature they desorb the fluid and thus produce a high-pressure flow to the expander in the cold stage. The sorption process selected for this application is of the physical type, which is completely reversible. It does not suffer from degradation as is the case with chemical sorption of, e.g., hydrogen in metal hydrides. Sorption coolers include no moving parts except for some check valves, they export neither mechanical vibrations nor electromagnetic interference, and are potentially very dependable due to their simplicity. The required cooling temperature determines the type of working fluid to be applied. Sorption coolers can be used in conjunction with passive cooling for heat rejection at different levels. This paper starts with a brief discussion on applications of passive coolers in different types of orbits and on the limitations of passive cooling for lower cooling temperatures. Next, the working principle of sorption cooling is summarized. The DARWIN mission is chosen as an example application of sorption and passive cooling and special attention is paid to the

  20. Characteristics of and sorption to biochars derived from waste material

    NASA Astrophysics Data System (ADS)

    Sun, Huichao; Kah, Melanie; Sigmund, Gabriel; Hofmann, Thilo

    2015-04-01

    Biochars can exhibit a high sorption potential towards heavy metals and organic contaminants in various environmental matrices (e.g., water, soil). They have therefore been proposed for environmental remediation purposes to sequester contaminants. To date, most studies have focused on the physicochemical and sorption properties of mineral phases poor biochars, which are typically produced from plant residues. Only little knowledge is available for biochars derived from human and animal waste material, which are typically characterized by high mineral contents (e.g., sewage sludge, manure). Using human and animal waste as source material to produce biochars would support the development of attractive combined strategies for waste management and remediation. The potential impact of mineral phases on the physicochemical and sorption properties of biochars requires further studies so that the potential as sorbent material can be evaluated. With this purpose, different source material biochars were produced at 200°C, 350°C and 500°C, to yield a series of biochars representing a range of mineral content. The derived biochars from wood shavings (<1% ash), sewage sludge (50-70% ash) and pig manure (30-60% ash), as well as a commercial biochar derived from grain husks (40% ash), were extensively characterized (e.g., element composition, surface area, porosity, Fourier transform infrared spectroscopy). The contents of potentially toxic elements (i.e., heavy metals and polycyclic aromatic hydrocarbons) of all materials were within the guidelines values proposed by the International Biochar Initiative, indicating their suitability for environmental application. Single point sorption coefficients for the model sorbate pyrene were measured to investigate the effect of mineral content, feedstock, pyrolysis temperature, particle size fractions and acid demineralization on sorption behavior. Overall, sorption of pyrene was strong for all materials (4 < Log Kd < 6.5 L

  1. Estimating Advective Near-surface Currents from Ocean Color Satellite Images

    DTIC Science & Technology

    2015-01-01

    RESPONSIBLE PERSON 19b. TELEPHONE NUMBER (Include area code) 01/23/2015 Journal Article Estimating advective near-surface currents from ocean color ...currents from the sequential ocean color imagery provided by multiple newer generations of satellite sensors on hourly scales in the Yellow Sea and the...optical properties are discussed regarding the performances of various color products on the retrieval of currents. Similarities of velocity

  2. A family of compact high order coupled time-space unconditionally stable vertical advection schemes

    NASA Astrophysics Data System (ADS)

    Lemarié, Florian; Debreu, Laurent

    2016-04-01

    Recent papers by Shchepetkin (2015) and Lemarié et al. (2015) have emphasized that the time-step of an oceanic model with an Eulerian vertical coordinate and an explicit time-stepping scheme is very often restricted by vertical advection in a few hot spots (i.e. most of the grid points are integrated with small Courant numbers, compared to the Courant-Friedrichs-Lewy (CFL) condition, except just few spots where numerical instability of the explicit scheme occurs first). The consequence is that the numerics for vertical advection must have good stability properties while being robust to changes in Courant number in terms of accuracy. An other constraint for oceanic models is the strict control of numerical mixing imposed by the highly adiabatic nature of the oceanic interior (i.e. mixing must be very small in the vertical direction below the boundary layer). We examine in this talk the possibility of mitigating vertical Courant-Friedrichs-Lewy (CFL) restriction, while avoiding numerical inaccuracies associated with standard implicit advection schemes (i.e. large sensitivity of the solution on Courant number, large phase delay, and possibly excess of numerical damping with unphysical orientation). Most regional oceanic models have been successfully using fourth order compact schemes for vertical advection. In this talk we present a new general framework to derive generic expressions for (one-step) coupled time and space high order compact schemes (see Daru & Tenaud (2004) for a thorough description of coupled time and space schemes). Among other properties, we show that those schemes are unconditionally stable and have very good accuracy properties even for large Courant numbers while having a very reasonable computational cost.

  3. Statistical evaluation of thermal advection and stratification effects in scatterometer observations

    NASA Technical Reports Server (NTRS)

    Levy, Gad; Tiu, F. S.

    1991-01-01

    The effects of thermal advection and atmospheric stratification are statistically evaluated using Seasat scatterometer observations as a data base. The results indicate that, whenever the surface winds or wind stress are related to the atmospheric pressure field, the appropriate stratification and baroclinic corrections should be applied. Without such corrections, errors of 15-25 percent are likely to arise in the surface fluxes computed from model low-level winds or pressure measurements.

  4. An advection-based model to increase the temporal resolution of PIV time series.

    PubMed

    Scarano, Fulvio; Moore, Peter

    A numerical implementation of the advection equation is proposed to increase the temporal resolution of PIV time series. The method is based on the principle that velocity fluctuations are transported passively, similar to Taylor's hypothesis of frozen turbulence. In the present work, the advection model is extended to unsteady three-dimensional flows. The main objective of the method is that of lowering the requirement on the PIV repetition rate from the Eulerian frequency toward the Lagrangian one. The local trajectory of the fluid parcel is obtained by forward projection of the instantaneous velocity at the preceding time instant and backward projection from the subsequent time step. The trajectories are approximated by the instantaneous streamlines, which yields accurate results when the amplitude of velocity fluctuations is small with respect to the convective motion. The verification is performed with two experiments conducted at temporal resolutions significantly higher than that dictated by Nyquist criterion. The flow past the trailing edge of a NACA0012 airfoil closely approximates frozen turbulence, where the largest ratio between the Lagrangian and Eulerian temporal scales is expected. An order of magnitude reduction of the needed acquisition frequency is demonstrated by the velocity spectra of super-sampled series. The application to three-dimensional data is made with time-resolved tomographic PIV measurements of a transitional jet. Here, the 3D advection equation is implemented to estimate the fluid trajectories. The reduction in the minimum sampling rate by the use of super-sampling in this case is less, due to the fact that vortices occurring in the jet shear layer are not well approximated by sole advection at large time separation. Both cases reveal that the current requirements for time-resolved PIV experiments can be revised when information is poured from space to time. An additional favorable effect is observed by the analysis in the frequency

  5. Noise Prevents Infinite Stretching of the Passive Field in a Stochastic Vector Advection Equation

    NASA Astrophysics Data System (ADS)

    Flandoli, Franco; Maurelli, Mario; Neklyudov, Mikhail

    2014-09-01

    A linear stochastic vector advection equation is considered; the equation may model a passive magnetic field in a random fluid. When the driving velocity field is rough but deterministic, in particular just Hölder continuous and bounded, one can construct examples of infinite stretching of the passive field, arising from smooth initial conditions. The purpose of the paper is to prove that infinite stretching is prevented if the driving velocity field contains in addition a white noise component.

  6. New Solution of Diffusion-Advection Equation for Cosmic-Ray Transport Using Ultradistributions

    NASA Astrophysics Data System (ADS)

    Rocca, M. C.; Plastino, A. R.; Plastino, A.; Ferri, G. L.; de Paoli, A.

    2015-11-01

    In this paper we exactly solve the diffusion-advection equation (DAE) for cosmic-ray transport. For such a purpose we use the Theory of Ultradistributions of J. Sebastiao e Silva, to give a general solution for the DAE. From the ensuing solution, we obtain several approximations as limiting cases of various situations of physical and astrophysical interest. One of them involves Solar cosmic-rays' diffusion.

  7. Multiphase Advection and Radiation Diffusion with Material Interfaces on Unstructured Meshes

    SciTech Connect

    Anninos, P

    2002-10-03

    A collection of numerical methods are presented for the advection or remapping of material properties on unstructured and staggered polyhedral meshes in arbitrary Lagrange-Eulerian calculations. The methods include several new procedures to track and capture sharp interface boundaries, and to partition radiation energy into multi-material thermal states. The latter is useful for extending and applying consistently single material radiation diffusion solvers to multi-material problems.

  8. Interpreting layer thickness advection in terms of eddy-topography interaction

    NASA Astrophysics Data System (ADS)

    Liu, Chuanyu; Köhl, Armin; Stammer, Detlef

    2014-09-01

    A parameterization for the spatial pattern of the eddy induced thickness advection parameter estimated from a dynamically consistent data assimilation procedure is presented. Values of the thickness advection parameter are predominantly negative (positive) over seamounts, and positive (negative) over the deep ocean in the southern (northern) hemisphere along strong currents; its magnitude is large at high latitudes but low in the tropical regions. Those characteristics motivate a parameterization based on the Coriolis parameter, the bottom depth and an eddy length scale. As a parameterization for an eddy streamfunction, the associated bolus velocities advect density anti-cyclonically (cyclonically) around seamounts (troughs). Although the parameterization has the same form as Holloway’s streamfunction for the Neptune effect, and is also related to eddy-topography interactions, Holloway’s streamfunction is in contrast applied to the momentum equation. The parameterization is independently confirmed by the flux-mean gradient relation from the output of a high resolution model. The effect of the proposed scheme is investigated using a channel model with idealized bottom topographies and a global ocean circulation model with realistic bottom topography. In agreement with the high resolution model, our scheme generates cold (warm) domes and cyclonic circulations over seamounts (troughs), which is consistent with the eddy movement in presence of the topographic β effect. This provides a different mechanism for eddy-topography interaction than the Neptune effect, which generates circulations of opposing sign.

  9. A computational Lagrangian-Eulerian advection remap for free surface flows

    NASA Astrophysics Data System (ADS)

    Ashgriz, Nasser; Barbat, Tiberiu; Wang, Gang

    2004-01-01

    A VOF-based algorithm for advecting free surfaces and interfaces across a 2-D unstructured grid is presented. This algorithm is based on a combination of a Computational Lagrangian-Eulerian Advection Remap and the Volume of the Fluid method (CLEAR-VOF). A set of geometric tools are used to remap the advected shape of the volume fraction from one cell onto the Eulerian fixed unstructured grid. The geometric remapping is used to compute the fluxes onto a group of neighbouring cells of the mesh. These fluxes are then redistributed and corrected to satisfy the conservation of mass. Here, we present methods for developing identification algorithms for surface cells and incorporating them with CLEAR-VOF. The CLEAR-VOF algorithm is then tested for translation of several geometries. It is also incorporated in a finite element based flow solver and tested in a laminar flow over a broad-crested weir and a turbulent flow over a semi-circular obstacle.

  10. A Comparative Study of Indoor Radon Contributed by Diffusive and Advective Transport through Intact Concrete

    NASA Astrophysics Data System (ADS)

    Chauhan, R. P.; Kumar, Amit

    The present work is aimed that out of diffusive and advective transport which is dominant process for indoor radon entry under normal room conditions. For this purpose the radon diffusion coefficient and permeability of concrete were measured by specially designed experimental set up. The radon diffusion coefficient of concrete was measured by continuous radon monitor. The measured value was (3.78 ± 0.39)×10-8 m2/s and found independent of the radon gas concentration in source chamber. The radon permeability of concrete varied between 1.85×10-17 to 1.36×10-15 m2 for the bulk pressure difference fewer than 20 Pa to 73.3 kPa. From the measured diffusion coefficient and absolute permeability, the radon flux from the concrete surface having concentrations gradient 12-40 kBq/m3 and typical floor thickness 0.1 m was calculated by the application of Fick and Darcy laws. Using the measured flux attributable to diffusive and advective transport, the indoor radon concentration for a typical Indian model room having dimension (5×6×7) m3 was calculated under average room ventilation (0.63 h-1). The results showed that the contribution of diffusive transport through intact concrete is dominant over the advective transport, as expected from the low values of concrete permeability.

  11. Reactive-Diffusive-Advective Traveling Waves in a Family of Degenerate Nonlinear Equations.

    PubMed

    Sánchez-Garduño, Faustino; Pérez-Velázquez, Judith

    This paper deals with the analysis of existence of traveling wave solutions (TWS) for a diffusion-degenerate (at D(0) = 0) and advection-degenerate (at h'(0) = 0) reaction-diffusion-advection (RDA) equation. Diffusion is a strictly increasing function and the reaction term generalizes the kinetic part of the Fisher-KPP equation. We consider different forms of the convection term h(u): (1)  h'(u) is constant k, (2)  h'(u) = ku with k > 0, and (3) it is a quite general form which guarantees the degeneracy in the advective term. In Case 1, we prove that the task can be reduced to that for the corresponding equation, where k = 0, and then previous results reported from the authors can be extended. For the other two cases, we use both analytical and numerical tools. The analysis we carried out is based on the restatement of searching TWS for the full RDA equation into a two-dimensional dynamical problem. This consists of searching for the conditions on the parameter values for which there exist heteroclinic trajectories of the ordinary differential equations (ODE) system in the traveling wave coordinates. Throughout the paper we obtain the dynamics by using tools coming from qualitative theory of ODE.

  12. Reactive-Diffusive-Advective Traveling Waves in a Family of Degenerate Nonlinear Equations

    PubMed Central

    Sánchez-Garduño, Faustino

    2016-01-01

    This paper deals with the analysis of existence of traveling wave solutions (TWS) for a diffusion-degenerate (at D(0) = 0) and advection-degenerate (at h′(0) = 0) reaction-diffusion-advection (RDA) equation. Diffusion is a strictly increasing function and the reaction term generalizes the kinetic part of the Fisher-KPP equation. We consider different forms of the convection term h(u): (1)  h′(u) is constant k, (2)  h′(u) = ku with k > 0, and (3) it is a quite general form which guarantees the degeneracy in the advective term. In Case 1, we prove that the task can be reduced to that for the corresponding equation, where k = 0, and then previous results reported from the authors can be extended. For the other two cases, we use both analytical and numerical tools. The analysis we carried out is based on the restatement of searching TWS for the full RDA equation into a two-dimensional dynamical problem. This consists of searching for the conditions on the parameter values for which there exist heteroclinic trajectories of the ordinary differential equations (ODE) system in the traveling wave coordinates. Throughout the paper we obtain the dynamics by using tools coming from qualitative theory of ODE. PMID:27689131

  13. Thermal advection and stratification effects on surface winds and the low level meridional mass transport

    NASA Technical Reports Server (NTRS)

    Levy, Gad; Tiu, Felice S.

    1990-01-01

    Statistical tests are performed on the Seasat scatterometer observations to examine if and to what degree thermal advection and stratification effects manifest themselves in these remotely sensed measurements of mean wind and wind stress over the ocean. On the basis of a two layer baroclinic boundary layer model which is presented, it is shown that the thermal advection and stratification of the entire boundary layer as well as the geostrophic forcing influence the modeled near surface wind and wind stress profiles. Evidence of diurnal variation in the stratification under barotropic conditions is found in the data, with the daytime marine boundary layer being more convective than its nighttime counterpart. The temporal and spacial sampling pattern of the satellite makes it impossible to recover the full diurnal cycle, however. The observed effects of the thermal advection are shown to be statistically significant during the day (and presumed more convective) hours, causing a systematic increase in the poleward transport of mass and heat. The statistical results are in a qualitative agreement with the model simulations and cannot be reproduced in randomized control tests.

  14. An improved lattice Boltzmann method for simulating advective-diffusive processes in fluids

    NASA Astrophysics Data System (ADS)

    Aursjø, Olav; Jettestuen, Espen; Vinningland, Jan Ludvig; Hiorth, Aksel

    2017-03-01

    Lattice Boltzmann methods are widely used to simulate advective-diffusive processes in fluids. Lattice Bhatnagar-Gross-Krook methods presented in the literature mostly just exhibit first order spatial accuracy and introduce errors proportional to the velocity squared. Formulations proposed to alleviate this have only been partly successful and are valid only in certain specific situations. We present and demonstrate here a formulation that produces no such second order errors. This formulation suggests that a subtle, but important, adjustment is all it takes to improve the accuracy of the method. The key to the improved accuracy of this new model is the non-standard definition of the concentration that relates to the distribution function describing the advection-diffusion in lattice Boltzmann. The main advantage of the algorithm comes to view when simulating situations where fluid density variations appear. The present formulation of the advection-diffusion algorithm will, by taking into account these fluid density variations, drastically reduce the errors produced compared to the standard formulations. We also show how a source term is included in this new formulation without it losing its second order spatial accuracy.

  15. A Petroleum Vapor Intrusion Model Involving Upward Advective Soil Gas Flow Due to Methane Generation.

    PubMed

    Yao, Yijun; Wu, Yun; Wang, Yue; Verginelli, Iason; Zeng, Tian; Suuberg, Eric M; Jiang, Lin; Wen, Yuezhong; Ma, Jie

    2015-10-06

    At petroleum vapor intrusion (PVI) sites at which there is significant methane generation, upward advective soil gas transport may be observed. To evaluate the health and explosion risks that may exist under such scenarios, a one-dimensional analytical model describing these processes is introduced in this study. This new model accounts for both advective and diffusive transport in soil gas and couples this with a piecewise first-order aerobic biodegradation model, limited by oxygen availability. The predicted results from the new model are shown to be in good agreement with the simulation results obtained from a three-dimensional numerical model. These results suggest that this analytical model is suitable for describing cases involving open ground surface beyond the foundation edge, serving as the primary oxygen source. This new analytical model indicates that the major contribution of upward advection to indoor air concentration could be limited to the increase of soil gas entry rate, since the oxygen in soil might already be depleted owing to the associated high methane source vapor concentration.

  16. RADIATION PRESSURE-SUPPORTED ACCRETION DISKS: VERTICAL STRUCTURE, ENERGY ADVECTION, AND CONVECTIVE STABILITY

    SciTech Connect

    Gu Weimin

    2012-07-10

    By taking into account the local energy balance per unit volume between the viscous heating and the advective cooling plus the radiative cooling, we investigate the vertical structure of radiation pressure-supported accretion disks in spherical coordinates. Our solutions show that the photosphere of the disk is close to the polar axis and therefore the disk seems to be extremely thick. However, the density profile implies that most of the accreted matter exists in a moderate range around the equatorial plane. We show that the well-known polytropic relation between the pressure and the density is unsuitable for describing the vertical structure of radiation pressure-supported disks. More importantly, we find that the energy advection is significant even for slightly sub-Eddington accretion disks. We argue that the non-negligible advection may help us understand why the standard thin disk model is likely to be inaccurate above {approx}0.3 Eddington luminosity, which was found by some works on black hole spin measurement. Furthermore, the solutions satisfy the Solberg-Hoiland conditions, which indicate the disk to be convectively stable. In addition, we discuss the possible link between our disk model and ultraluminous X-ray sources.

  17. Pointwise interactions of finite element modeling of advection-diffusion equations

    SciTech Connect

    Yeh, G.T.

    1984-07-01

    Pointwise iteration techniques including successive under-relaxation (SUR), Gauss-Seidel (G-S), and successive over-relaxation (SOR) schemes, are applied to advection-diffusion equations to derive the matrix equation with finite element methods. These schemes are tested using two simple examples for which analytical solutions are available so that numerical results can be checked to ensure code consistency. Numerical experiments indicate that the iteration schemes, if convergent, produce almost identical solutions as those obtained by the direct elimination scheme. For diffusion dominant transport, all three iteration schemes generate convergent computations. However, for advection-diffusion equally dominant or advection dominant transport, only SUR and G-S schemes yield convergent calculations, the SOR scheme leads to divergent computations. Pointwise iteration schemes offer substantial savings in central process unit (CPU) memory over the direct elimination scheme, even for the small, two-dimensional verification example, without complicating the programming efforts and, in the meantime, keeps the CPU time comparable. A realistic, hypothetical problem is used to demonstrate the applicability and versatility of pointwise iterations and direct elimination schemes. The saving in CPU memory using the pointwise iterations is more than tenfold that using the direct elimination solution for this hypothetical problem. The saving in CPU time is even better, more than 40 fold.

  18. A particle-mesh algorithm for advection-reaction-diffusion equations with applications to plankton modeling

    NASA Astrophysics Data System (ADS)

    Paparella, F.; Oliveri, F.

    2009-04-01

    The interplay of advection, reaction and diffusion terms in ADR equations is a rather difficult one to be modeled numerically. The kind of spurious oscillations that is usually harmless for non-reacting scalars is often amplified without bounds by reaction terms. Furthermore, in most biogeochimical applications, such as mesoscale or global-scale plankton modeling, the diffusive fluxes may be smaller than the numerical ones. Inspired by the particle-mesh methods used by cosmologists, we propose to discretize on a grid only the diffusive term of the equation, and solve the advection-reaction terms as ordinary differential equations along the characteristic lines. Diffusion happens by letting the concentration field carried by each particle to relax towards the diffusive field known on the grid, without redistributing the particles. This method, in the limit of vanishing diffusivity and for a fixed mesh size, recovers the advection-reaction solution with no numerical diffusion. We show some example numerical solutions of the ADR equations stemming from a simple predator-prey model.

  19. An advection scheme based on the combination of particle mesh method and pure Lagrangian approach

    NASA Astrophysics Data System (ADS)

    Arsenic, Ilija; Mihailovic, Dragutin T.; Kapor, Darko

    2011-11-01

    Possibility of using pure Lagrangian approach in modeling transport phenomena is described in this paper. The application of pure Lagrangian approach in real atmospheric field induces highly irregular spatial distribution of grid points, after only a few time steps. In order to avoid problems caused by that irregularity, a quasi interpolation procedure is proposed. Proposed interpolation procedure is similar to the radial basis functions interpolation and does not impose any demands about spatial distribution of the grid points or about continuity and differentiability of the field that needs to be interpolated. Besides that, proposed procedure is explicitly mass conserving. Combination of particle mesh method and pure Lagrangian approach creates efficient transport scheme that does not produce any new local maxima and minima in advected field. In proposed advection scheme motion of points are performed in Lagrangian manner while spatial derivatives are evaluated on the basis of values interpolated onto regular grid. Applicability of proposed advection scheme in an unambiguous way is proved by performing "standard" numerical tests with (i) the slotted cylinder under solid body rotation, (ii) the test with Doswell's idealized cyclogenesis as well as (iii) integration of shallow water equations.

  20. Advection-Dominant MHD Computation for External Kinks and Edge-Localized Modes

    NASA Astrophysics Data System (ADS)

    Sovinec, C. R.

    2016-10-01

    Separation of temporal and spatial scales is the primary consideration for computation of macroscopic dynamics in magnetically confined plasma. Dynamic shock capturing is not needed, but nonlinear external kinks and ELMs advect large gradients near the plasma surface. Using an implicit time-advance with Galerkin projection can be problematic in these applications when advection is stronger than dissipation on the spatial scale of the mesh. The applied math community has investigated many approaches to stabilizing numerical advection. One approach is the least-squares finite element method, which has previously been applied to MHD and plasma-fluid models. Here, we adapt this technique for MHD computation with the NIMROD code, starting with the scalar dependent fields that need to have definite sign: density and temperature. Time-splitting physical diffusion maintains the original size of the algebraic systems that are solved at each time-step. Upwinding explicit terms where derivatives are discontinuous avoids overshoot error while minimizing numerical dissipation. Work supported by U.S. DOE Grant DE-FC02-08ER54975.

  1. Sorption of tylosin and sulfamethazine on solid humic acid.

    PubMed

    Guo, Xuetao; Tu, Bei; Ge, Jianhua; Yang, Chen; Song, Xiaomei; Dang, Zhi

    2016-05-01

    Tylosin (TYL) and sulfamethazine (SMT) are ionizable and polar antimicrobial compounds, which have seeped into the environment in substantial amounts via fertilizing land with manure or sewage. Sorption of TYL and SMT onto humic acid (HA) may affect their environmental fate. In this study, the sorption of TYL and SMT on HA at different conditions (pH, ionic strength) was investigated. All sorption isotherms fitted well to the Henry and Freundlich models and they were highly nonlinear with values of n between 0.5 and 0.8, which suggested that the HA had high heterogeneity. The sorption of TYL and SMT on HA decreased with increasing pH (2.0-7.5), implying that the primary sorption mechanism could be due to cation exchange interactions between TYL(+)/SMT(+) species and the functional groups of HA. Increasing ionic strength resulted in a considerable reduction in the Kd values of TYL and SMT, hinting that interactions between H bonds and π-π EDA might be an important factor in the sorption of TYL and SMT on HA. Results of Fourier transform infrared (FT-IR) and (13)C-nuclear magnetic resonance (NMR) analysis further demonstrated that carboxyl groups and O-alkyl structures in the HA could interact with TYL and SMT via ionic interactions and H bonds, respectively. Overall, this work gives new insights into the mechanisms of sorption of TYL and SMT on HA and hence aids us in assessing the environmental risk of TYL and SMT under diverse conditions.

  2. Catalytic gasification of biomass (Miscanthus) enhanced by CO2 sorption.

    PubMed

    Zamboni, I; Debal, M; Matt, M; Girods, P; Kiennemann, A; Rogaume, Y; Courson, C

    2016-11-01

    The main objective of this work concerns the coupling of biomass gasification reaction and CO2 sorption. The study shows the feasibility to promote biomass steam gasification in a dense fluidized bed reactor with CO2 sorption to enhance tar removal and hydrogen production. It also proves the efficiency of CaO-Ca12Al14O33/olivine bi-functional materials to reduce heavy tar production. Experiments have been carried out in a fluidized bed gasifier using steam as the fluidizing medium to improve hydrogen production. Bed materials consisting of CaO-based oxide for CO2 sorption (CaO-Ca12Al14O33) deposited on olivine for tar reduction were synthesized, their structural and textural properties were characterized by Brunauer-Emmett-Teller (BET), X-ray diffraction (XRD), and temperature-programmed reduction (TPR) methods, and the determination of their sorption capacity and stability analyzed by thermogravimetric analysis (TGA). It appears that this CaO-Ca12Al14O33/olivine sorbent/catalyst presents a good CO2 sorption stability (for seven cycles of carbonation/decarbonation). Compared to olivine and Fe/olivine in a fixed bed reactor for steam reforming of toluene chosen as tar model compound, it shows a better hydrogen production rate and a lower CO2 selectivity due to its sorption on the CaO phase. In the biomass steam gasification, the use of CaO-Ca12Al14O33/olivine as bed material at 700 °C leads to a higher H2 production than olivine at 800 °C thanks to CO2 sorption. Similar tar concentration and lighter tar production (analyzed by HPLC/UV) are observed. At 700 °C, sorbent addition allows to halve tar content and to eliminate the heaviest tars.

  3. Pyrethroid sorption to Sacramento River suspended solids and bed sediments

    PubMed Central

    Fojut, Tessa L.; Young, Thomas M.

    2011-01-01

    Sorption of pyrethroid insecticides to solid materials will typically dominate the fate and transport of these hydrophobic compounds in aquatic environments. Batch reactor isotherm experiments were performed with bifenthrin and λ-cyhalothrin with suspended material and bed sediment collected from the Sacramento River, CA. These batch reactor experiments were performed with low spiking concentrations and a long equilibration time (28 d) to be more relevant to environmental conditions. Sorption to suspended material and bed sediment was compared to examine the role of differential sorption between these phases in the environmental transport of pyrethroids. The equilibrium sorption data were fit to the Freundlich isotherm model and fit with r2 > 0.87 for all experiments. Freundlich exponents ranged from 0.72 ± 0.19 to 1.07 ± 0.050, indicating sorption nonlinearity for some of the experimental conditions and linearity for others over the concentration range tested. The Freundlich capacity factors were larger for the suspended solids than for the bed sediments and the suspended material had a higher specific surface area and higher organic carbon content compared to the bed sediment. Calculated organic carbon-normalized distribution coefficients were larger than those previously reported in the literature by approximately an order of magnitude and ranged from 106.16 to 106.68 at an equilibrium aqueous concentration of 0.1 µg/L. Higher than expected sorption of pyrethroids to the tested materials may be explained by sorption to black carbon and/or mineral surfaces. PMID:21191877

  4. Highly dispersive slot waveguides.

    PubMed

    Zhang, Lin; Yue, Yang; Xiao-Li, Yinying; Beausoleil, Raymond G; Willner, Alan E

    2009-04-27

    We propose a slot-waveguide with high dispersion, in which a slot waveguide is coupled to a strip waveguide. A negative dispersion of up to -181520 ps/nm/km is obtained due to a strong interaction of the slot and strip modes. A flat and large dispersion is achievable by cascading the dispersive slot-waveguides with varied waveguide thickness or width for dispersion compensation and signal processing applications. We show - 31300 ps/nm/km dispersion over 147-nm bandwidth with <1% variance.

  5. A new Remesh-Lagrange technique for advecting temperature that minimizes numerical diffusion

    NASA Astrophysics Data System (ADS)

    Hasenclever, J.; Phipps Morgan, J.; Shi, C.

    2007-12-01

    The proper treatment of heat-advection is a generally underappreciated problem within CFD, yet particularly critical for calculating physically sound erosion in plume-lithosphere interactions and temperature sensitive melting processes. Typically, Eulerian (fixed-mesh) codes have been preferred to solve for fluid flow and they are almost essential for finite-difference-based algorithms. Unfortunately, the Eulerian approach introduces numerical artifacts into the solution of the advection-diffusion heat transport problem that can only be suppressed by adding 'too-diffusive' artificial diffusion to the equations, as for example in the Smolarkiewicz formulation for heat advection. We have developed a 'Remesh-Lagrange' method using a partly deforming finite element mesh and find it to be significantly more accurate than our previous methods. In several test scenarios we show the large improvement in accuracy that can be obtained by using a Lagrangian approach for 10-30 time steps (depending upon the distortion of the finite elements in the deformed Lagrangian mesh) and then regridding to the initial mesh. When an element becomes too distorted the nodes connected to it become fixed and we switch from Lagrange to a Semi-Lagrange formulation for these nodes. Instead of the standard 'linear backward' Semi-Lagrange we are also experimenting with a more accurate interpolation scheme for an unstructured mesh that additionally includes the nodal derivatives of the temperature field when calculating the value at the Semi-Lagrange traceback point. The same bicubic interpolation method for an unstructured grid is used to remesh the 'too-distorted' Lagrange grid back to the initial undistorted mesh. We compare the Remesh-Lagrange technique against the following Eulerian methods in a series of 2-D numerical experiments advecting stripes and Gaussian peaks in steady circulating flow: linear back-interpolation Semi-Lagrange method; bicubic back-interpolation Semi-Lagrange method

  6. Sorption Properties of Aerogel in Liquid Nitrogen

    NASA Technical Reports Server (NTRS)

    Johnson, Wesley L.

    2006-01-01

    Aerogel products are now available as insulation materials of the future. The Cryogenics Test Laboratory at the NASA Kennedy Space Center is developing aerogel-based thermal insulation systems for space launch applications. Aerogel beads (Cabot Nanogel ) and aerogel blankets (Aspen Aerogels Spaceloft ) have outstanding ambient pressure thermal performance that makes them useful for applications where sealing is not possible. Aerogel beads are open-celled silicone dioxide and have tiny pores that run throughout the body of the bead. It has also recently been discovered that aerogel beads can be used as a filtering device for aqueous compounds at room temperature. With their hydrophobic covering, the beads absorb any non-polar substance and they can be chemically altered to absorb hot gases. The combination of the absorption and cryogenic insulating properties of aerogel beads have never been studied together. For future cryogenic insulation applications, it is crucial to know how the beads react while immersed in cryogenic liquids, most notably liquid nitrogen. Aerogel beads in loose-fill situation and aerogel blankets with composite fiber structure have been tested for absorption properties. Depending on the type of aerogel used and the preparation, preliminary results show the material can absorb up to seven times its own weight of liquid nitrogen, corresponding to a volumetric ratio of 0.70 (unit volume nitrogen per unit volume aerogel). These tests allow for an estimate on how much insulation is needed in certain situations. The theory behind the different processes of sorption is necessary for a better understanding of the preparation of the beads before they are used in an insulation system.

  7. Heat cascading regenerative sorption heat pump

    NASA Technical Reports Server (NTRS)

    Jones, Jack A. (Inventor)

    1995-01-01

    A simple heat cascading regenerative sorption heat pump process with rejected or waste heat from a higher temperature chemisorption circuit (HTCC) powering a lower temperature physisorption circuit (LTPC) which provides a 30% total improvement over simple regenerative physisorption compression heat pumps when ammonia is both the chemisorbate and physisorbate, and a total improvement of 50% or more for LTPC having two pressure stages. The HTCC contains ammonia and a chemisorbent therefor contained in a plurality of canisters, a condenser-evaporator-radiator system, and a heater, operatively connected together. The LTPC contains ammonia and a physisorbent therefor contained in a plurality of compressors, a condenser-evaporator-radiator system, operatively connected together. A closed heat transfer circuit (CHTC) is provided which contains a flowing heat transfer liquid (FHTL) in thermal communication with each canister and each compressor for cascading heat from the HTCC to the LTPC. Heat is regenerated within the LTPC by transferring heat from one compressor to another. In one embodiment the regeneration is performed by another CHTC containing another FHTL in thermal communication with each compressor. In another embodiment the HTCC powers a lower temperature ammonia water absorption circuit (LTAWAC) which contains a generator-absorber system containing the absorbent, and a condenser-evaporator-radiator system, operatively connected together. The absorbent is water or an absorbent aqueous solution. A CHTC is provided which contains a FHTL in thermal communication with the generator for cascading heat from the HTCC to the LTAWAC. Heat is regenerated within the LTAWAC by transferring heat from the generator to the absorber. The chemical composition of the chemisorbent is different than the chemical composition of the physisorbent, and the absorbent. The chemical composition of the FHTL is different than the chemisorbent, the physisorbent, the absorbent, and ammonia.

  8. Modeling and predicting competitive sorption of organic compounds in soil.

    PubMed

    Faria, Isabel R; Young, Thomas M

    2010-12-01

    Binary systems consisting of 1,2-dichlorobenzene (12DCB) + competitor were investigated over a range of concentrations of competitor in three natural sorbents with distinct characteristics. Two models, the ideal adsorbed solution theory (IAST) and the potential theory (Polanyi-based multisolute model), widely used in the prediction of multisolute sorption equilibrium from single-solute data, were used to simulate competitive sorption in our systems. The goal was to determine which multisolute model best represented the experimentally obtained multisolute data in natural sorbents of varied properties. Results suggested that for the sorbents and sorbates studied, the IAST model provided much better results. On average, the IAST model provided lower errors (23%) than the potential model (45%). The effect of competitor structure on the degree of competition was also investigated to identify any relationships between competition and structure using molecular descriptors. The competitors chlorobenzene, naphthalene, 1,4-dichlorobenzene, 1,2,4-trichlorobenzene all showed very similar degrees of competition, while benzene, phenanthrene, and pyrene were the least effective competitors toward 12DCB across all sorbents. Different sorption sites or sorption mechanisms might be involved in the sorption of these molecules leading to a lack of competitive behavior. A significant relationship between competitor structure and the degree of competition was observed at environmentally relevant sorbed competitor concentrations for the soil containing the highest fraction of hard carbon (Forbes soil).

  9. Modeling polychlorinated biphenyl sorption isotherms for soot and coal.

    PubMed

    Jantunen, A P K; Koelmans, A A; Jonker, M T O

    2010-08-01

    Sorption isotherms (pg-ng/L) were measured for 11 polychlorinated biphenyls (PCBs) of varying molecular planarity from aqueous solution to two carbonaceous geosorbents, anthracite coal and traffic soot. All isotherms were reasonably log-log-linear, but smooth for traffic soot and staircase-shaped for coal, to which sorption was stronger and more nonlinear. The isotherms were modeled using seven sorption models, including Freundlich, (dual) Langmuir, and Polanyi-Dubinin-Manes (PDM). PDM provided the best combination of reliability and mechanistically-interpretable parameters. The PDM normalizing factor Z appeared to correlate negatively with sorbate molecular volume, dependent on the degree of molecular planarity. The modeling results supported the hypothesis that maximum adsorption capacities (Q(max)) correlate positively with the sorbent's specific surface area. Q(max) did not decrease with increasing sorbate molecular size, and adsorption affinities clearly differed between the sorbents. Sorption was consistently stronger but not less linear for planar than for nonplanar PCBs, suggesting surface rather than pore sorption.

  10. Thermodynamic analysis of sorption isotherms of cassava (Manihot esculenta).

    PubMed

    Koua, Blaise Kamenan; Koffi, Paul Magloire Ekoun; Gbaha, Prosper; Toure, Siaka

    2014-09-01

    Sorption isotherms of cassava were determined experimentally using a static gravimetric method at 30, 45 and 60 °C and within the range of 0.10-0.90 water activity. At a constant water activity, equilibrium moisture content decreased with increasing temperature. The equilibrium moisture content increased with increasing water activity at a given temperature. The experimental results were modelled using seven sorption models using non-linear regression technique. Results demonstrated that the GAB model adequately predicted equilibrium moisture content of cassava for the range of temperatures and water activities studied. The thermodynamic functions such as net isosteric heat of sorption, differential entropy of sorption, net integral enthalpy and entropy were evaluated to provide an understanding of the properties of water and energy requirements associated with the sorption behaviour. Net isosteric heat and differential entropy decreased with increasing equilibrium moisture content. The net integral enthalpy decreased while net integral entropy increased with increasing equilibrium moisture content. Net integral entropy was negative in value. All thermodynamic functions were adequately characterised by a power law model. The point of maximum stability was found between 0.053 and 0.154 kg water/kg db for cassava.

  11. Moisture sorption characteristics of freeze-dried human platelets*

    PubMed Central

    Xu, Meng-jie; Chen, Guang-ming; Fan, Ju-li; Liu, Jin-hui; Xu, Xian-guo; Zhang, Shao-zhi

    2011-01-01

    Freeze-drying is a promising method for a long-term storage of human platelets. The moisture sorption characteristics of freeze-dried human platelets (FDHPs) were studied in this paper. The moisture sorption isotherms of FDHPs and freeze-dried lyophilization buffer (FDLB) were measured at 4, 25, and 37 °C. The experimental data were fitted to Brunauer-Emmett-Teller (BET) and Guggenheim-Anderson-de Boer (GAB) equations. There were no significant statistical differences (P>0.05) between the sorption characteristics of FDHPs and FDLB at 4 and 25 °C, while FDHPs absorbed more water at 37 °C. The net isosteric heat of sorption was derived. The heat for FDHPs showed an abnormal negative value at low moisture contents when 25 and 37 °C data were used. Dynamic sorption experiments were carried out at 25 °C with environmental water activity controlled at 0.75, 0.85, and 0.90. The moisture diffusion coefficient was fitted to be 8.24×10−12 m2/s when experimental data at initial time were used. These results would be helpful in choosing prehydration and storage condition for FDHPs. PMID:21370506

  12. Thermodynamic modeling of the sorption of radioelements onto cementitious materials

    SciTech Connect

    Heath, T.G.; Ilett, D.J.; Tweed, C.J.

    1996-08-01

    A model has been developed for the sorption of radioelements onto cementitious materials based on the diffuse-layer modeling approach. The model assumes that silicon sites (>SiOH) and calcium sites (>CaOH) dominate the surface chemistry and the sorption of radioelements onto the cementitious materials. Both types of site may undergo surface protonation and deprotonation reactions. Cement-based systems vary greatly in their chemistry depending on their calcium-to-silicon molar ratio, and the corresponding variation in the surface chemistry has been incorporated by allowing sorption of calcium ions onto silicon sites. This process results in a change from a silica-type surface, at very low calcium-silicon ratios, to a calcium hydroxide-type surface for high-calcium cement-based materials. The predicted variation in the surface chemistry is consistent with literature data on measured zeta potentials of cements. The model has been applied successfully to describe the sorption of simple caesium and iodide ions at varying calcium-silicon ratios. In a Nirex repository for low and intermediate level wastes, a high-calcium cementitious backfill would be specified. This model has allowed a consistent interpretation of experimental data for sorption of key radioelements, including uranium and plutonium, onto the backfill, under saline and non-saline conditions.

  13. Importance of structural makeup of biopolymers for organic contaminant sorption.

    PubMed

    Wang, Xilong; Xing, Baoshan

    2007-05-15

    Sorption of pyrene, phenanthrene, naphthalene, and 1-naphthol by original (lignin, chitin, and cellulose) and coated biopolymers was examined. Organic carbon normalized distribution coefficients (Koc) of all compounds by the original biopolymers followed the order lignin > chitin > cellulose, in line with the order of their hydrophobicity. Hydrophobicity of structurally similar organic compounds is the main factor determining their ability to occupy sorption sites in biopolymers. Specific interactions (e.g., H-bonding) between 1-naphthol and chitin or cellulose increased its ability to occupy sorption sites. Lignin coating resulted in an increased Koc for phenanthrene (13.6 times for chitin and 6.9 times for cellulose) and 1-naphthol (6.0 times for chitin and 3.7 times for cellulose) relative to the acetone-treated chitin and cellulose. Also, these coated biopolymers had increased isotherm nonlinearity, due to the newly formed condensed domains. An increase in phenanthrene and 1-naphthol sorption by lignin-coated biopolymers as compared to chitin and cellulose was contributed by the newly created high-energy sites in condensed domains and coated lignin. Results of this study highlight the importance of the structural makeup of biopolymers in controlling the sorption of hydrophobic organic compounds.

  14. Sorption of organic gases in a furnished room

    NASA Astrophysics Data System (ADS)

    Singer, Brett C.; Revzan, Kenneth L.; Hotchi, Toshifumi; Hodgson, Alfred T.; Brown, Nancy J.

    We present experimental data and semi-empirical models describing the sorption of organic gases in a simulated indoor residential environment. Two replicate experiments were conducted with 20 volatile organic compounds (VOCs) in a 50-m 3 room finished with painted wallboard, carpet and cushion, draperies and furnishings. The VOCs span a wide volatility range and include ten hazardous air pollutants. VOCs were introduced to the static chamber as a pulse and their gas-phase concentrations were measured during a net adsorption period and a subsequent net desorption period. Three sorption models were fit to the measured concentrations for each compound to determine the simplest formulation needed to adequately describe the observed behavior. Sorption parameter values were determined by fitting the models to adsorption period data then checked by comparing measured and predicted behavior during desorption. The adequacy of each model was evaluated using a goodness of fit parameter calculated for each period. Results indicate that sorption usually does not greatly affect indoor concentrations of methyl- tert-butyl ether, 2-butanone, isoprene and benzene. In contrast, sorption appears to be a relevant indoor process for many of the VOCs studied, including C 8-C 10 aromatic hydrocarbons (HC), terpenes, and pyridine. These compounds sorbed at rates close to typical residential air change rates and exhibited substantial sorptive partitioning at equilibrium. Polycyclic aromatic HCs, aromatic alcohols, ethenylpyridine and nicotine initially adsorbed to surfaces at rates of 1.5->6 h -1 and partitioned 95->99% in the sorbed phase at equilibrium.

  15. Sorption of pharmaceuticals and personal care products to polyethylene debris.

    PubMed

    Wu, Chenxi; Zhang, Kai; Huang, Xiaolong; Liu, Jiantong

    2016-05-01

    Presence of plastic debris in marine and freshwater ecosystems is increasingly reported. Previous research suggested plastic debris had a strong affiliation for many pollutants, such as polycyclic aromatic hydrocarbons (PAHs), polychlorinated biphenyls (PCBs), and heavy metals. In this study, the sorption behavior of pharmaceuticals and personal care products (PPCPs), including carbamazepine (CBZ), 4-methylbenzylidene camphor (4MBC), triclosan (TCS), and 17α-ethinyl estradiol (EE2), to polyethylene (PE) debris (250 to 280 μm) was investigated. The estimated linear sorption coefficients (K d) are 191.4, 311.5, 5140, and 53,225 L/kg for CBZ, EE2, TCS, and 4MBC, and are related to their hydrophobicities. Increase of salinity from 0.05 to 3.5 % did not affect the sorption of 4MBC, CBZ, and EE2 but enhanced the sorption of TCS, likely due to the salting-out effect. Increase of dissolved organic matter (DOM) content using Aldrich humic acid (HA) as a proxy reduced the sorption of 4MBC, EE2, and TCS, all of which show a relatively strong affiliation to HA. Results from this work suggest that microplastics may play an important role in the fate and transport of PPCPs, especially for those hydrophobic ones.

  16. Phenylurea herbicide sorption to biochars and agricultural soil

    PubMed Central

    WANG, DAOYUAN; MUKOME, FUNGAI N. D.; YAN, DENGHUA; WANG, HAO; SCOW, KATE M.; PARIKH, SANJAI J.

    2016-01-01

    Biochar is increasingly been used as a soil amendment to improve water holding capacity, reduce nutrient leaching, increase soil pH and also as a means to reduce contamination through sorption of heavy metals or organic pollutants. The sorption behavior of three phenylurea herbicides (monuron, diuron, linuron) on five biochars (Enhanced Biochar, Hog Waste, Turkey Litter, Walnut Shell and Wood Feedstock) and an agricultural soil (Yolo silt loam) was investigated using a batch equilibration method. Sorption isotherms of herbicides to biochars were well described by the Freundlich model (R2 = 0.93 -- 0.97). The adsorption KF values ranged from 6.94 to 1306.95 mg kg−1 and indicated the sorption of herbicides in the biochars and Yolo soil was in the sequence of linuron > diuron > monuron and walnut shell biochar > wood feedstock biochar > turkey litter biochar > enhanced biochar > hog waste biochar > Yolo soil. These data show that sorption of herbicides to biochar can have both positive (reduced off-site transport) and negative (reduced herbicide efficacy) implications and specific biochar properties, such as H/C ratio and surface area, should be considered together with soil type, agriculture chemical and climate condition in biochar application to agricultural soil to optimize the system for both agricultural and environmental benefits. PMID:26065514

  17. A study of dyes sorption on biobased cryogels

    NASA Astrophysics Data System (ADS)

    Dobritoiu, Rodica; Patachia, Silvia

    2013-11-01

    Three types of biopolymers based materials were synthesized and tested as adsorbents for the dyes from aqueous solutions. Blends based on poly (vinyl alcohol) [PVA] and scleroglucan [Scl], cellulose micro-fibres [cel] and zein, respectively, have been prepared by repeated freezing-thawing cycles. Methylene blue [MB] was selected as a model dye in order to evaluate the capacity of the prepared materials to remove the dyes from aqueous solutions. The effects of the initial dye concentration, contact time and the composition of materials on the kinetic and thermodynamic parameters of sorption were discussed. The pseudo-second-order kinetics was found to better fit the experimental data thus being able to consistently predict the amount of dye adsorbed over the entire sorption period. The sorption equilibrium data obey Freundlich isotherm. Sorption capacity was evaluated both by dye solution and cryogel analysis by using VIS spectrometry and image analysis with CIELAB system. The sorption of monomer or aggregated dye molecules was identified and correlated with the type and morphology of the gel. The highest efficiency in MB removal was obtained for Scl/PVA cryogels in 1:9 weight ratio (9.5279 mg/g MB for an initial concentration by 8 × 10-5 mol/L in MB). These materials are suitable as sorbents for the advanced removal of dyes from waste water.

  18. Chitosan sorbents for platinum sorption from dilute solutions

    SciTech Connect

    Guibal, E.; Larkin, A.; Vincent, T.; Tobin, J.M.

    1999-10-01

    Chitosan has proved efficient at removing platinum in dilute effluents. The maximum uptake capacity reaches 300 mg/g (almost 1.5 mmol/g). The optimum pH for sorption is pH 2. A glutaraldehyde cross-linking pretreatment is necessary to stabilize the biopolymer in acidic solutions. Sorption isotherms have been studied as a function of pH, sorbent particle size, and the cross-linking ratio. Surprisingly, the extent of the cross-linking (determined by the concentration of the cross-linking agent in the treatment bath) has no significant influence on uptake capacity. Competitor anions such as chloride or nitrate induce a large decrease in the sorption efficiency. Sorption kinetics show also that uptake rate is not significantly changed by increasing either the cross-linking ratio or the particle size of the sorbent. Mass transfer rates are significantly affected by the initial platinum concentration and by the conditioning of the biopolymer. Gel-bead conditioning appears to reduce the sorption rate. While for molybdate and vanadate ions, mass transfer was governed by intraparticle mass transfer, for platinum, both external and intraparticle diffusion control the uptake rate. In contrast with the former ions, platinum does not form polynuclear hydrolyzed species, which are responsible for steric hindrance of diffusion into the polymer network.

  19. [Sorption and mechanism of surfactants on bentonite in combined pollution].

    PubMed

    Sun, Xiao-Hui; Lu, Ying-Ying; Chen, Shu-Guang; Li, Ling-Jian; Shen, Xue-You

    2007-04-01

    Sorption of cationic surfactant cetyl pyridinium chloride (CPC), anionic surfactant sodium dodecylbenzene sulfonate (SDBS) and nonionic surfactant Triton X-100 (TX-100) on bentonite was studied. The influences of cation-exchange capacity (CEC), temperature and salinity on the sorption of CPC were also discussed. The results indicate that the sorption of CPC on Na-bentonite is greater than that of TX-100 and SDBS, and SDBS hardly shows any sorption. CPC is adsorbed to Na-bentonite through a combination of hydrophobic bonding and cation-exchange. While TX-100 is adsorbed to Na-bentonite via the formation of an adsorption layer of twain surfactant molecule and hydrogenolysis of silicon-oxygen surface of bentonite and TX-100. The amount of SDBS adsorbed on Ca-bentonite increases with increasing surfactant concentration, reaching a maximum at 1.5 critical micelle concentration (CMC), and then decreases with increasing surfactant loading. The mechanism of the retention appears to be formation of a sparingly soluble Ca-SDBS species, and dissolution in the micelle. The amount of CPC adsorbed on bentonite decreases with increasing temperature, and increases with increasing CEC. NaCl can enhance the sorption of CPC on bentonite.

  20. Sorption and transport of atrazine in an agricultural soil

    NASA Astrophysics Data System (ADS)

    Hakan Akyol, Nihat

    2014-05-01

    Sorption and transport of atrazine in an agricultural soil Atrazine is one of the most commonly used herbicides in large quantity worldwide. The objective of this study was to perform some batch and column experiments to examine the transport of atrazine in an agricultural soil from Turkey. Batch experiments indicated that sorption isotherm was nonlinear with a freundlich isotherm over a range of concentration (0.2-10 mg/L) examined. Column experiments showed that transport of atrazine in the soil was moderately retarded compared to non-reactive tracer (R = 2.9-4.0). The degree of retardation decreased with increasing atrazine concentration and residance time had negligable impact on degree of sorption. Flow interruption tests in the column experiments indicated that the rate-limited desorption of atrazine mainly controlled the non-ideal transport of atrazine due to the presence of organic matter fraction (0.83 %) in the soil. Sorption and desorption behavior of atrazine in such soils could have important impacts for risk assessment of atrazine-contaminated soil and should be taken into account in the regulation, management, and remediation of atrazine-contaminated sites. Keywords: Atrazine, Agricultural soil, Batch, Column, Desorption, Rate-limited desorption, Sorption, Transport.

  1. Persistence and sorption of imazapyr in three Argentinean soils.

    PubMed

    Gianelli, Valeria Rosana; Bedmar, Francisco; Costa, José Luis

    2014-01-01

    Imazapyr is a herbicide widely used for weed control in imidazolinone-tolerant sunflower. Imazapyr has a high potential for leaching into groundwater because it is highly water-soluble, persistent in soil, and only weakly sorbed by soils. There is a lack of information available in Argentina concerning groundwater leaching of imazapyr. Therefore, the objective of the present study was to determine the persistence and sorption of imazapyr in 3 Argentinean soils (Tandil, Anguil, and Cerro Azul sites). The presence and concentration of imazapyr were determined and quantified by ultra-performance liquid chromatography and tandem mass spectrometry. The persistence in soils followed the order: Cerro Azul > Tandil > Anguil, with half-life values of 121 d, 75 d, and 37 d, respectively. The half-life of imazapyr was negatively associated with soil pH and iron and aluminum content, and was positively related to clay content. Imazapyr sorption was found to be well described by the Freundlich isotherm. Soil pH and clay, iron, and aluminum contents were the main factors affecting the sorption of imazapyr. The sorption had a limiting effect on the degradation rate. Under certain conditions, the weak sorption and high persistence may increase the movement of imazapyr in the soil profile and the risk of groundwater pollution.

  2. Modeling and predicting competitive sorption of organic compounds in soil

    PubMed Central

    Faria, Isabel R.; Young, Thomas M.

    2011-01-01

    Binary systems consisting of 1,2-dichlorobenzene (12DCB) + competitor were investigated over a range of concentrations of competitor in three natural sorbents with distinct characteristics. Two models, the ideal adsorbed solution theory (IAST) and the Potential theory (Polanyi based multi-solute model), widely used in the prediction of multi-solute sorption equilibrium from single solute data were used to simulate competitive sorption in our systems. The goal was to determine which multi-solute model best represented the experimentally obtained multi-solute data in natural sorbents of varied properties. Results suggested that for the sorbents and sorbates studied the IAST model provided much better results. On average the IAST model provided lower errors (23%) than the Potential model (45%). The effect of competitor structure on the degree of competition was also investigated to identify any relationships between competition and structure using molecular descriptors. The competitors chlorobenzene, naphthalene, 1,4-dichlorobenzene, 1,2,4-trichlorobenzene all showed very similar degrees of competition, while benzene, phenanthrene and pyrene were the least effective competitors towards 12DCB across all sorbents. Different sorption sites or sorption mechanisms might be involved in the sorption of these molecules leading to a lack of competitive behavior. A significant relationship between competitor structure and the degree of competition was observed at environmentally relevant sorbed competitor concentrations for the soil containing the highest fraction of hard carbon (Forbes). PMID:21061392

  3. Sorption of polycyclic aromatic hydrocarbons to polystyrene nanoplastic.

    PubMed

    Liu, Lijing; Fokkink, Remco; Koelmans, Albert A

    2016-07-01

    Microplastic has become an emerging contaminant of global concern. Bulk plastic can degrade to form smaller particles down to the nanoscale (<100 nm), which are referred to as nanoplastics. Because of their high surface area, nanoplastic may bind hydrophobic chemicals very effectively, increasing their hazard when such nanoplastics are taken up by biota. The present study reports distribution coefficients for sorption of polycyclic aromatic hydrocarbons (PAHs) to 70 nm polystyrene in freshwater, and PAH adsorption isotherms spanning environmentally realistic aqueous concentrations of 10(-5)  μg/L to 1 μg/L. Nanopolystyrene aggregate state was assessed using dynamic light scattering. The adsorption isotherms were nonlinear, and the distribution coefficients at the lower ends of the isotherms were very high, with values up to 10(9) L/kg. The high and nonlinear sorption was explained from π-π interactions between the planar PAHs and the surface of the aromatic polymer polystyrene and was higher than for micrometer-sized polystyrene. Reduction of nanopolystyrene aggregate sizes had no significant effect on sorption, which suggests that the PAHs could reach the sorption sites on the pristine nanoparticles regardless of the aggregation state. Pre-extraction of the nanopolystyrene with C18 polydimethylsiloxane decreased sorption of PAHs, which could be explained by removal of the most hydrophobic fraction of the nanopolystyrene. Environ Toxicol Chem 2016;35:1650-1655. © 2015 SETAC.

  4. Mechanism of Cu(II), Cd(II) and Pb(II) ions sorption from aqueous solutions by macroporous poly(glycidyl methacrylate-co-ethylene glycol dimethacrylate)

    NASA Astrophysics Data System (ADS)

    Nastasović, Aleksandra B.; Ekmeščić, Bojana M.; Sandić, Zvjezdana P.; Ranđelović, Danijela V.; Mozetič, Miran; Vesel, Alenka; Onjia, Antonije E.

    2016-11-01

    The mechanism of Cu(II), Cd(II) and Pb(II) ions sorption from aqueous solutions by macroporous poly(glycidyl methacrylate-co-ethylene glycol dimethacrylate) (PGME) functionalized by reaction of the pendant epoxy groups with diethylene triamine (PGME-deta) was studied using X-ray photoelectron spectroscopy (XPS) and Fourier transform infrared spectroscopy (FTIR) analysis. Atomic force microscopy (AFM) and scanning energy-dispersive X-ray spectroscopy (SEM-EDX) were used for the determination of surface morphology of the copolymer particles. The sorption behavior of heavy metals Cu(II), Cd(II) and Pb(II) ions sorption was investigated in batch static experiments under non-competitive conditions at room temperature (298 K). The obtained results were fitted to pseudo-first order, pseudo-second order and intraparticle diffusion kinetic model. The kinetics studies showed that Cu(II), Cd(II) and Pb(II) sorption obeys the pseudo-second-order model under all investigated operating conditions with evident influence of pore diffusion.

  5. Lectures on Dispersion Theory

    DOE R&D Accomplishments Database

    Salam, A.

    1956-04-01

    Lectures with mathematical analysis are given on Dispersion Theory and Causality and Dispersion Relations for Pion-nucleon Scattering. The appendix includes the S-matrix in terms of Heisenberg Operators. (F. S.)

  6. Development of the DUSTRAN GIS-Based Complex Terrain Model for Atmospheric Dust Dispersion

    DTIC Science & Technology

    2007-05-10

    scenario and run the underlying models. Through the process of data layering, the model domain, sources, and results—including the calculated wind-vector...advection, diffusion, and deposition calculations . Figure 4.2 shows the linkages of these dust-dispersion models within DUSTRAN. CALMET...interface CALMET, CALPUFF, and CALGRID to routinely available terrain elevation and land-use datasets for use in model calculations . A post-processing

  7. Sorption testing and generalized composite surface complexation models for determining uranium sorption parameters at a proposed in-situ recovery site

    SciTech Connect

    Johnson, Raymond H.; Truax, Ryan A.; Lankford, David A.; Stone, James J.

    2016-02-03

    Solid-phase iron concentrations and generalized composite surface complexation models were used to evaluate procedures in determining uranium sorption on oxidized aquifer material at a proposed U in situ recovery (ISR) site. At the proposed Dewey Burdock ISR site in South Dakota, USA, oxidized aquifer material occurs downgradient of the U ore zones. Solid-phase Fe concentrations did not explain our batch sorption test results,though total extracted Fe appeared to be positively correlated with overall measured U sorption. Batch sorption test results were used to develop generalized composite surface complexation models that incorporated the full genericsorption potential of each sample, without detailed mineralogiccharacterization. The resultant models provide U sorption parameters (site densities and equilibrium constants) for reactive transport modeling. The generalized composite surface complexation sorption models were calibrated to batch sorption data from three oxidized core samples using inverse modeling, and gave larger sorption parameters than just U sorption on the measured solidphase Fe. These larger sorption parameters can significantly influence reactive transport modeling, potentially increasing U attenuation. Because of the limited number of calibration points, inverse modeling required the reduction of estimated parameters by fixing two parameters. The best-fit models used fixed values for equilibrium constants, with the sorption site densities being estimated by the inversion process. While these inverse routines did provide best-fit sorption parameters, local minima and correlated parameters might require further evaluation. Despite our limited number of proxy samples, the procedures presented provide a valuable methodology to consider for sites where metal sorption parameters are required. Furthermore, these sorption parameters can be used in reactive transport modeling to assess downgradient metal attenuation, especially when no other calibration

  8. Sorption testing and generalized composite surface complexation models for determining uranium sorption parameters at a proposed in-situ recovery site

    DOE PAGES

    Johnson, Raymond H.; Truax, Ryan A.; Lankford, David A.; ...

    2016-02-03

    Solid-phase iron concentrations and generalized composite surface complexation models were used to evaluate procedures in determining uranium sorption on oxidized aquifer material at a proposed U in situ recovery (ISR) site. At the proposed Dewey Burdock ISR site in South Dakota, USA, oxidized aquifer material occurs downgradient of the U ore zones. Solid-phase Fe concentrations did not explain our batch sorption test results,though total extracted Fe appeared to be positively correlated with overall measured U sorption. Batch sorption test results were used to develop generalized composite surface complexation models that incorporated the full genericsorption potential of each sample, without detailedmore » mineralogiccharacterization. The resultant models provide U sorption parameters (site densities and equilibrium constants) for reactive transport modeling. The generalized composite surface complexation sorption models were calibrated to batch sorption data from three oxidized core samples using inverse modeling, and gave larger sorption parameters than just U sorption on the measured solidphase Fe. These larger sorption parameters can significantly influence reactive transport modeling, potentially increasing U attenuation. Because of the limited number of calibration points, inverse modeling required the reduction of estimated parameters by fixing two parameters. The best-fit models used fixed values for equilibrium constants, with the sorption site densities being estimated by the inversion process. While these inverse routines did provide best-fit sorption parameters, local minima and correlated parameters might require further evaluation. Despite our limited number of proxy samples, the procedures presented provide a valuable methodology to consider for sites where metal sorption parameters are required. Furthermore, these sorption parameters can be used in reactive transport modeling to assess downgradient metal attenuation, especially when no other

  9. Riparian seed dispersal: transport and depositional processes

    NASA Astrophysics Data System (ADS)

    Cunnings, A.; Johnson, E. A.; Martin, Y. E.

    2012-04-01

    Riparian tree population dynamics are linked to the physical processes controlled by the hydrogeomorphic setting. In particular, fluvial seed dispersal is influenced by a combination of factors including the hydrology, fluvial geomorphology, and seed dispersal traits. This study examines the influence of stream flow patterns on the transportation and deposition of buoyant seeds by applying a one dimensional transport model. Conceptually, the model separates the stream into two components: the main channel and transient storage /deposition zones. The hydrologic processes are governed by an advection-dispersion equation and numerically solved using the Crank-Nicolson method. Additional terms in the equation allow for model variation in the flow regime (lateral inflow and outflow) and the incorporation of a transient storage/deposition component where seeds may be detained. The model parameters are based on a bedrock-gravel bed river with pool-riffle morphology where we conducted field experimentation in Coastal Northern California. The riparian zone of the study reach is inhabited by White Alder (Alnus rhombifolia) which disperses buoyant seeds in late winter/early spring coinciding with the latter part of the wet, Mediterranean climate. Artificial seeds with similar characteristic traits of buoyancy, density and Bond Number to White Alder seeds were used to quantify transport times and identify storage areas. The model output captures a greater number of seeds during a receding hydrograph due to the increase in transient storage. Typically, this is found in shallow stream margins where the flow is divergent such as areas with back-eddies. In the field, this is associated with the ends of gravel bars or riffles where flow expansion causes secondary flows. The results demonstrate the importance of transient storage for seed transport and depositional processes and emphasize the need for improved measurement techniques, in lieu of empirical coefficients, to advance the

  10. Sorption hysteresis of Cd(II) and Pb(II) on natural zeolite and bentonite.

    PubMed

    Hamidpour, Mohsen; Kalbasi, Mahmoud; Afyuni, Majid; Shariatmadari, Hossein; Holm, Peter E; Hansen, Hans Christian Brunn

    2010-09-15

    Sorption hysteresis in natural sorbents has important environmental implications for pollutant transport and bioavailability. We examined sorption reversibility of Cd(II) and Pb(II) on zeolite and bentonite. Sorption isotherms were derived by sorption of Cd(II) and Pb(II) from solutions containing a range of the metal concentrations corresponding to 10-100% maximum sorption capacity (SCmax) of the sorbents. The desorption experiments were performed immediately following the completion of sorption experiments. Sorption and desorption isotherms of Cd(II) and Pb(II) were well described by the Freundlich model. The results revealed that the desorption isotherms of Cd(II) and Pb(II) from zeolite significantly deviated from the sorption isotherms indicating irreversible or very slowly reversible sorption. For bentonite sorption/desorption isotherms were similar indicating reversible sorption. The extent of hysteresis was evaluated from sorption and desorption Freundlich parameters (K(f) and n) through the apparent hysteresis index (HI = n(desorb)/n(sorb); n is the exponent in the Freundlich equation) and differences in Freundlich K(f) parameters. Higher sorption irreversibility was obtained for Pb(II) as compared to Cd(II). The amounts of Cd(II) and Pb(II) desorbed from bentonite were more than from zeolite, indicating that zeolite was a more effective sorbent for water and wastewater treatment.

  11. Upscaling of Solute Transport in Heterogeneous Media with Non-uniform Flow and Dispersion Fields

    SciTech Connect

    Xu, Zhijie; Meakin, Paul

    2013-10-01

    An analytical and computational model for non-reactive solute transport in periodic heterogeneous media with arbitrary non-uniform flow and dispersion fields within the unit cell of length ε is described. The model lumps the effect of non-uniform flow and dispersion into an effective advection velocity Ve and an effective dispersion coefficient De. It is shown that both Ve and De are scale-dependent (dependent on the length scale of the microscopic heterogeneity, ε), dependent on the Péclet number Pe, and on a dimensionless parameter α that represents the effects of microscopic heterogeneity. The parameter α, confined to the range of [-0.5, 0.5] for the numerical example presented, depends on the flow direction and non-uniform flow and dispersion fields. Effective advection velocity Ve and dispersion coefficient De can be derived for any given flow and dispersion fields, and . Homogenized solutions describing the macroscopic variations can be obtained from the effective model. Solutions with sub-unit-cell accuracy can be constructed by homogenized solutions and its spatial derivatives. A numerical implementation of the model compared with direct numerical solutions using a fine grid, demonstrated that the new method was in good agreement with direct solutions, but with significant computational savings.

  12. Hyperbolic Method for Dispersive PDEs: Same High-Order of Accuracy for Solution, Gradient, and Hessian

    NASA Technical Reports Server (NTRS)

    Mazaheri, Alireza; Ricchiuto, Mario; Nishikawa, Hiroaki

    2016-01-01

    In this paper, we introduce a new hyperbolic first-order system for general dispersive partial differential equations (PDEs). We then extend the proposed system to general advection-diffusion-dispersion PDEs. We apply the fourth-order RD scheme of Ref. 1 to the proposed hyperbolic system, and solve time-dependent dispersive equations, including the classical two-soliton KdV and a dispersive shock case. We demonstrate that the predicted results, including the gradient and Hessian (second derivative), are in a very good agreement with the exact solutions. We then show that the RD scheme applied to the proposed system accurately captures dispersive shocks without numerical oscillations. We also verify that the solution, gradient and Hessian are predicted with equal order of accuracy.

  13. Dispersion y dinamica poblacional

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Dispersal behavior of fruit flies is appetitive. Measures of dispersion involve two different parameter: the maximum distance and the standard distance. Standard distance is a parameter that describes the probalility of dispersion and is mathematically equivalent to the standard deviation around ...

  14. Carbon dioxide sorption capacities of coal gasification residues.

    PubMed

    Kempka, Thomas; Fernández-Steeger, Tomás; Li, Dong-Yong; Schulten, Marc; Schlüter, Ralph; Krooss, Bernhard M

    2011-02-15

    Underground coal gasification is currently being considered as an economically and environmentally sustainable option for development and utilization of coal deposits not mineable by conventional methods. This emerging technology in combination with carbon capture and sorptive CO2 storage on the residual coke as well as free-gas CO2 storage in the cavities generated in the coal seams after gasification could provide a relevant contribution to the development of Clean Coal Technologies. Three hard coals of different rank from German mining districts were gasified in a laboratory-scale reactor (200 g of coal at 800 °C subjected to 10 L/min air for 200 min). High-pressure CO2 excess sorption isotherms determined before and after gasification revealed an increase of sorption capacity by up to 42%. Thus, physical sorption represents a feasible option for CO2 storage in underground gasification cavities.

  15. Aroma compound sorption by oak wood in a model wine.

    PubMed

    Ramirez Ramirez, G; Lubbers, S; Charpentier, C; Feuillat, M; Voilley, A; Chassagne, D

    2001-08-01

    Oak wood used for wine barrels was immersed into a model wine containing eight aroma compounds (e.g., aromatic and terpene alcohols, ethyl esters, and aldehyde), for which activity coefficients in water and model wine were determined using the mutual solubility measurement. A mass balance of these volatiles considering their reactivity in model wine was established. For most of the studied aroma compounds, and mainly for linalool and ethyl octanoate, a sorption behavior into wood was reported for the first time. This phenomenon was selective and could not be related to the solubilities in model wine and hydrophobicities of the studied aroma compounds, suggesting that acid-base and polar characteristics of wood were more involved in this sorption mechanism. This study has also shown that the level of sorption is a function of the ratio of wood surface area/solution volume.

  16. The sorption of Zectran on bottom sediments and peat moss

    SciTech Connect

    Matthews, E.W.; Faust, S.D.

    1981-01-01

    A modified analytical method employed to determine the insecticide Zectran in natural waters frequently has resulted in erroneous data. The errors have been attributed to interferences from particulate matter in these waters. In order to evaluate analytical interferences due to sorption of Zectran on particulates, a series of experiments was performed using bottom sediments and a peat moss in contact with aqueous solutions of zectran at a pH values of 6.0 and 20 degrees C. Isotherm studies confirmed that Zectran sorption occurs in a direct relation to the amount of chemically oxidizable carbon present in the bottom sediments or peat moss. However, the extent of sorption was limited, which suggested that particulates may not be the primary interference in the modified analytical method.

  17. Incorporation of aqueous reaction and sorption kinetics andbiodegradation into TOUGHREACT

    SciTech Connect

    Xu, Tianfu

    2006-04-17

    The needs for considering aqueous and sorption kinetics and microbiological processes arises in many subsurface problems, such as environmental and acid mine remediation. A general rate expression has been implemented into TOUGHREACT, which considers multiple mechanisms(pathways) and includes multiple product, Monod, and inhibition terms. In this paper, the formulation for incorporating kinetic rates among primary species into the mass balance equations is presented. A batch sulfide oxidation problem is simulated. The resulting concentrations are consistent with simple hand calculations. A 1-D reactive transport problem with kinetic biodegradation and sorption was investigated, which models the processes when a pulse of water containing NTA (nitrylotriacetate) and cobalt is injected into a column. The problem has several interacting chemical processes that are common to many environmental problems: biologically-mediated degradation of an organic substrate, bacterial cell growth and decay, metal sorption and aqueous speciation including metal-ligand complexation. The TOUGHREACT simulation results agree very well with those obtained with other simulators.

  18. Investigation of hybrid membrane-sorption technologies for air fractionating

    NASA Astrophysics Data System (ADS)

    Laguntsov, N. I.; Kurchatov, I. M.; Korolev, M. V.; Tishin, A. V.

    2016-09-01

    Main aim of the work is to develop and to research single-circuit hybrid membrane- sorption system for enriching air with oxygen. The developed system allows to produce air, enriched with air up to 50%, purified from dust of any size, including nanoscale dust received in consequence of sorbent abrasion. In the course of the work the research of existing systems for air enrichment with oxygen, and the possibility of combining two methods of gas separation: membrane, and sorption, was conducted. The developed system differs from its analogues in that it has improved energy efficiency compared to methods of the membrane and sorption separation. Also work presents method of cyclogram determining of the hybrid system. In this methodic an algorithm for calculating of the cycles number, and determining of the stages duration in order to obtain the desired performance was presented.

  19. EXAFS studies of uranium sorption on layer-silicate minerals

    SciTech Connect

    Hudson, E.A.; Terminello, L.J.; Viani, B.E.

    1995-12-31

    The local structure of uranium sorbed on mineral surfaces was investigated by uranium L{sub 3}-edge EXAFS. Solutions of uranyl chloride, UO{sub 2}Cl{sub 2}, were exposed to vermiculite, an expansible layer silicate mineral, under conditions which favor sorption by either cation exchange or surface complexation. EXAFS of the resulting mineral samples indicates a larger distortion of the uranyl equatorial shell for cation exchange, possibly due to steric effects of interlayer sorption. The uranyl U-O axial bond distance is greater for surface complexation than for ion exchange. Uranyl sorption on talc and pyrophyllite, layer silicate minerals with essentially no cation-exchange capacity, gives results which generally support the trends for surface complexation on vermiculite.

  20. EFFECTS OF BIOSOLIDS ON SORPTION AND DESORPTION BEHAVIOR OF CADMIUM IN BIOSOLIDS-AMENDED SOILS

    EPA Science Inventory

    Cadmium sorption and desorption experiments were conducted on different fractions of soils amended with different biosolids with varying chemical properties and unamended soil (control). Biosolids addition increased the slope of the Cd sorption isotherms compared to the control s...

  1. USING METHANOL-WATER SYSTEMS TO INVESTIGATE PHENANTHRENE SORPTION-DESORPTION ON SEDIMENT

    EPA Science Inventory

    Sorption isotherm nonlinearity, sorption-desorption hysteresis, slow desorption kinetics, and other nonideal phenomena have been attributed to the differing sorptive characteristics of the natural organic matter (NOM) polymers associated with soils and sediments. A conceptualizat...

  2. MOLECULAR DYNAMICS MODELING OF SORPTION OF PESTICIDES ONTO THE SURFACES OF KAOLINITE

    EPA Science Inventory

    To accurately predict the fate of contaminants in the environment and to make sound decisions about environmental remediation, we must accurately understand sorption mechanisms and surface reactivity of environmental particles. Sorption of selected pesticides on kaolinite surface...

  3. Sorption of polycyclic aromatic hydrocarbons (PAHs) to lignin: effects of hydrophobicity and temperature.

    PubMed

    Zhang, Ming; Ahmad, Mahtab; Lee, Sang Soo; Xu, Li Heng; Ok, Yong Sik

    2014-07-01

    The study of the sorption of contaminants to lignin is significant for understanding the migration of contaminants in the environment as well as developing low cost sorbent. In this study, sorption of three polycyclic aromatic hydrocarbons (PAHs), naphthalene, acenaphthene and phenanthrene, to lignin was investigated. Sorption isotherms were well described by both linear and Freundlich sorption models. Sorption coefficients of PAHs to lignin from water obtained from regression of both linear model (K d) and Freundlich model (K f) were highly positively correlated with hydrophobicity of PAHs. The amorphous structure of lignin provided sufficient sorption domain for partitioning of PAHs, and the attraction between PAHs molecules and aromatic fractions in lignin via π-π electron-donor-acceptor (π-π EDA) interaction is hypothesized to provide a strong sorption force. Thermodynamic modeling revealed that sorption of PAHs to lignin was a spontaneous and exothermic process.

  4. Dispersion in the Surfzone: Tracer Dispersion Studies

    DTIC Science & Technology

    2011-09-30

    objective is to improve understanding and modeling of dispersion of tracers (pol­ lution, fecal indicator bacteria, fine sediments) within the...discussed further here. Stochastic Particle Simulation for Surfzone Dispersion Drifter-derived diffusivities are time-dependent. In an unbounded...diffusion. Here HB06 particle trajectories are stochastically simulated with the Langevin equations with a shoreline boundary to explain the observed

  5. Sorption of 2,4-dinitroanisole (DNAN) on lignin.

    PubMed

    Saad, Rabih; Radovic-Hrapovic, Zorana; Ahvazi, Behzad; Thiboutot, Sonia; Ampleman, Guy; Hawari, Jalal

    2012-01-01

    The present study describes the use of two commercially available lignins, namely, alkali and organosolv lignin, for the removal of 2,4-dinitroanisole (DNAN), a chemical widely used by the military and the dye industry, from water. Sorption of DNAN on both lignins reached equilibrium within 10 hr and followed pseudo second-order kinetics with sorption being faster with alkali than with organosolv lignin, i.e. k2 10.3 and 0.3 g/(mg x hr), respectively. In a separate study we investigated sorption of DNAN between 10 and 40 degrees C and found that the removal of DNAN by organosolv lignin increased from 0.8 to 7.5 mg/g but reduced slightly from 8.5 to 7.6 mg/g in the case of alkali lignin. Sorption isotherms for either alkali or organosolv lignin best fitted Freundlich equation with enthalpy of formation, deltaH0 equaled to 14 or 80 kJ/mol. To help understand DNAN sorption mechanisms we characterized the two lignins by elemental analysis, BET nitrogen adsorption-desorption and 31P NMR. Variations in elemental compositions between the two lignins indicated that alkali lignin should have more sites (O- and S-containing functionalities) for H-bonding. The BET surface area and calculated total pore volume of alkali lignin were almost 10 times greater than that of organosolv lignin suggesting that alkali lignin should provide more sites for sorption. 31P NMR showed that organosolv lignin contains more phenolic -OH groups than alkali lignin, i.e., 70% and 45%, respectively. The variations in the type of OH groups between the two lignins might have affected the strength of H-bonding between DNAN and the type of lignin used.

  6. Atrazine sorption-desorption hysteresis by sugarcane mulch residue.

    PubMed

    Selim, H M; Zhu, H

    2005-01-01

    Sorption and desorption kinetics are essential components for modeling the movement and retention of applied agricultural chemicals in soils and the fraction of chemicals susceptible to runoff. In this study, we investigated the retention characteristics of sugarcane (Saccharum spp. hybrid) mulch residue for atrazine (2-chloro-4-ethylamino-6-isopropylamino-1,3,5-triazine) based on studies of sorption-desorption kinetics. A sorption kinetic batch method was used to quantify retention of the mulch residue for a wide range of atrazine concentrations and reaction times. Desorption was performed following 504 h of sorption using successive dilutions, followed by methanol extraction. Atrazine retention by the mulch residue was well described using a linear model where the partitioning coefficient (K(d)) increased with reaction time from 10.40 to 23.4 cm3 g(-1) after 2 and 504 h, respectively. Values for mulch residue K(d) were an order of magnitude higher than those found for Commerce silt loam (fine-silty, mixed, superactive, nonacid, thermic Fluvaquentic Endoaquepts) where the sugarcane crop was grown. A kinetic multireaction model was successful in describing sorption behavior with reaction time. The model was equally successful in describing observed hysteretic atrazine behavior during desorption for all input concentrations. The model was concentration independent where one set of model parameters, which was derived from all batch results, was valid for the entire atrazine concentration range. Average atrazine recovery following six successive desorption steps were 63.67 +/- 4.38% of the amount adsorbed. Moreover, a hysteresis coefficient based on the difference in the area between sorption and desorption isotherms was capable of quantifying hysteresis of desorption isotherms.

  7. Theory of dispersive microlenses

    NASA Technical Reports Server (NTRS)

    Herman, B.; Gal, George

    1993-01-01

    A dispersive microlens is a miniature optical element which simultaneously focuses and disperses light. Arrays of dispersive mircolenses have potential applications in multicolor focal planes. They have a 100 percent optical fill factor and can focus light down to detectors of diffraction spot size, freeing up areas on the focal plane for on-chip analog signal processing. Use of dispersive microlenses allows inband color separation within a pixel and perfect scene registration. A dual-color separation has the potential for temperature discrimination. We discuss the design of dispersive microlenses and present sample results for efficient designs.

  8. Application of a Particle Method to the Advection-Diffusion-Reaction Equation

    NASA Astrophysics Data System (ADS)

    Paster, A.; Bolster, D.; Benson, D. A.

    2012-12-01

    A reaction between two chemical species can only happen if molecules collide and react. Thus, the mixing of a system can become a limiting factor in the onset of reaction. Solving for reaction rate in a well-mixed system is typically a straightforward task. However, when incomplete mixing kicks in, obtaining a solution becomes more challenging. Since reaction can only happen in regions where both reactants co-exist, the incomplete mixing may slow down the reaction rate, when compared to a well-mixed system. The effect of incomplete mixing upon reaction is a highly important aspect of various processes in natural and engineered systems, ranging from mineral precipitation in geological formations to groundwater remediation in aquifers. We study a relatively simple system with a bi-molecular irreversible kinetic reaction A+B → Ø where the underlying transport of reactants is governed by an advection-diffusion equation, and the initial concentrations are given in terms of an average and a perturbation. Such a system does not have an analytical solution to date, even for the zero advection case. We model the system by a Monte Carlo particle tracking method, where particles represent some reactant mass. In this method, diffusion is modeled by a random walk of the particles, and reaction is modeled by annihilation of particles. The probability of the annihilation is proportional to the reaction rate constant and the probability density associated with particle co-location. We study the numerical method in depth, characterizing typical numerical errors and time step restrictions. In particular, we show that the numerical method converges to the advection-diffusion-reaction equation at the limit Δt →0. We also rigorously derive the relationship between the initial number of particles in the system and the initial concentrations perturbations represented by that number. We then use the particle simulations of zero-advection system to demonstrate the well

  9. Computer model of one-dimensional equilibrium controlled sorption processes

    USGS Publications Warehouse

    Grove, D.B.; Stollenwerk, K.G.

    1984-01-01

    A numerical solution to the one-dimensional solute-transport equation with equilibrium-controlled sorption and a first-order irreversible-rate reaction is presented. The computer code is written in FORTRAN language, with a variety of options for input and output for user ease. Sorption reactions include Langmuir, Freundlich, and ion-exchange, with or without equal valance. General equations describing transport and reaction processes are solved by finite-difference methods, with nonlinearities accounted for by iteration. Complete documentation of the code, with examples, is included. (USGS)

  10. Hydrogen peroxide modified sodium titanates with improved sorption capabilities

    DOEpatents

    Nyman, May D.; Hobbs, David T.

    2009-02-24

    The sorption capabilities (e.g., kinetics, selectivity, capacity) of the baseline monosodium titanate (MST) sorbent material currently being used to sequester Sr-90 and alpha-emitting radioisotopes at the Savannah River Site are significantly improved when treated with hydrogen peroxide; either during the original synthesis of MST, or, as a post-treatment step after the MST has been synthesized. It is expected that these peroxide-modified MST sorbent materials will have significantly improved sorption capabilities for non-radioactive cations found in industrial processes and waste streams.

  11. Effect of sorption/curved interface thermodynamics on pressure transient

    SciTech Connect

    Lim, K.T.; Aziz, K.

    1995-01-26

    A simulation model capable of handling the effects of sorption was constructed. It accounts for the curved interface thermodynamics associated with adsorption and desorption. Data from several laboratory experiments were used to verify the model. The results indicated that simulation runs using sorption isotherms adequately model the pressure transient behavior observed in the laboratory experiments. Dry steam models severely underestimated the effective compressibility. Models using flat-interface (steam table) thermodynamics over-estimated the compressibility of the system, indicated by slower than actual rate of pressure transient propagation.

  12. Influence of turbulent advection on a phytoplankton ecosystem with nonuniform carrying capacity.

    PubMed

    McKiver, William J; Neufeld, Zoltán

    2009-06-01

    In this work we study a plankton ecosystem model in a turbulent flow. The plankton model we consider contains logistic growth with a spatially varying background carrying capacity and the flow dynamics are generated using the two-dimensional (2D) Navier-Stokes equations. We characterize the system in terms of a dimensionless parameter, gamma identical with TB/TF, which is the ratio of the ecosystem biological time scales TB and the flow time scales TF. We integrate this system numerically for different values of gamma until the mean plankton reaches a statistically stationary state and examine how the steady-state mean and variance of plankton depends on gamma. Overall we find that advection in the presence of a nonuniform background carrying capacity can lead to very different plankton distributions depending on the time scale ratio gamma. For small gamma the plankton distribution is very similar to the background carrying capacity field and has a mean concentration close to the mean carrying capacity. As gamma increases the plankton concentration is more influenced by the advection processes. In the largest gamma cases there is a homogenization of the plankton concentration and the mean plankton concentration approaches the harmonic mean, <1/K>(-1). We derive asymptotic approximations for the cases of small and large gamma. We also look at the dependence of the power spectra exponent, beta, on gamma where the power spectrum of plankton is proportional to k(-beta). We find that the power spectra exponent closely obeys beta=1+2/gamma as predicted by earlier studies using simple models of chaotic advection.

  13. A tracer-based inversion method for diagnosing eddy-induced diffusivity and advection

    NASA Astrophysics Data System (ADS)

    Bachman, S. D.; Fox-Kemper, B.; Bryan, F. O.

    2015-02-01

    A diagnosis method is presented which inverts a set of tracer flux statistics into an eddy-induced transport intended to apply for all tracers. The underlying assumption is that a linear flux-gradient relationship describes eddy-induced tracer transport, but a full tensor coefficient is assumed rather than a scalar coefficient which allows for down-gradient and skew transports. Thus, Lagrangian advection and anisotropic diffusion not necessarily aligned with the tracer gradient can be diagnosed. In this method, multiple passive tracers are initialized in an eddy-resolving flow simulation. Their spatially-averaged gradients form a matrix, where the gradient of each tracer is assumed to satisfy an identical flux-gradient relationship. The resulting linear system, which is overdetermined when using more than three tracers, is then solved to obtain an eddy transport tensor R which describes the eddy advection (antisymmetric part of R) and potentially anisotropic diffusion (symmetric part of R) in terms of coarse-grained variables. The mathematical basis for this inversion method is presented here, along with practical guidelines for its implementation. We present recommendations for initialization of the passive tracers, maintaining the required misalignment of the tracer gradients, correcting for nonconservative effects, and quantifying the error in the diagnosed transport tensor. A method is proposed to find unique, tracer-independent, distinct rotational and divergent Lagrangian transport operators, but the results indicate that these operators are not meaningfully relatable to tracer-independent eddy advection or diffusion. With the optimal method of diagnosis, the diagnosed transport tensor is capable of predicting the fluxes of other tracers that are withheld from the diagnosis, including even active tracers such as buoyancy, such that relative errors of 14% or less are found.

  14. An evaluation and intercomparison of four new advection schemes for use in global chemistry models

    NASA Astrophysics Data System (ADS)

    Petersen, Arthur C.; Spee, Edwin J.; van Dop, Han; Hundsdorfer, Willem

    1998-08-01

    The need to use a higher spatial resolution and to include more chemical species in global atmospheric chemistry models has led to a demand for efficient advection schemes with high accuracy. We test four newly developed three-dimensional advection schemes named Mol-rg, Split-u, Split-us, and Split-rg. We compare the new schemes with the existing schemes Slopes and Second Moments, both implemented on a uniform grid. Mol-rg and Split-rg make use of a reduced grid. Split-us is an unconditionally stable scheme on a uniform grid. Two tests are performed with all schemes: a solid-body rotation test and a radon transport test. The radon transport test is performed with the off-line global tracer model TM2. The solid-body rotation test shows that none of the new schemes generates undershoot and overshoot and that all of them are mass conservative. Slopes and Second Moments both generate small undershoot and overshoot at all resolutions. The accuracy of the new and old schemes for rotation of a smooth profile is similar for the horizontal resolutions studied. Since the new schemes are slightly more diffusive than the old schemes, they perform worse for rotation of a cone. The radon test shows that the errors related to the numerical schemes are much smaller than other model errors. The main advantage of the new schemes is that they use 75% and 90% less memory than Slopes and Second Moments, respectively. At horizontal resolutions higher than 5° × 5° Split-us and Split-rg are the most efficient of the schemes in terms of cpu time. The new advection schemes are available through Internet.

  15. Variational Integration for Ideal MHD with Built-in Advection Equations

    SciTech Connect

    Zhou, Yao; Qin, Hong; Burby, J. W.; Bhattacharjee, A.

    2014-08-05

    Newcomb's Lagrangian for ideal MHD in Lagrangian labeling is discretized using discrete exterior calculus. Variational integrators for ideal MHD are derived thereafter. Besides being symplectic and momentum preserving, the schemes inherit built-in advection equations from Newcomb's formulation, and therefore avoid solving them and the accompanying error and dissipation. We implement the method in 2D and show that numerical reconnection does not take place when singular current sheets are present. We then apply it to studying the dynamics of the ideal coalescence instability with multiple islands. The relaxed equilibrium state with embedded current sheets is obtained numerically.

  16. Observations of the microclimate of a lake under cold air advective conditions

    NASA Technical Reports Server (NTRS)

    Bill, R. G., Jr.; Sutherland, R. A.; Bartholic, J. F.

    1977-01-01

    The moderating effects of Lake Apopka, Florida, on downwind surface temperatures were evaluated under cold air advective conditions. Point temperature measurements north and south of the lake and data obtained from the NOAA satellite and a thermal scanner flown at 1.6 km, indicate that, under conditions of moderate winds (approximately 4m/sec), surface temperatures directly downwind may be higher than surrounding surface temperatures by as much as 5 C. With surface wind speed less than 1m/sec, no substantial temperature effects were observed. Results of this study are being used in land use planning, lake level control and in agriculture for selecting planting sites.

  17. Multigrid techniques for the solution of the passive scalar advection-diffusion equation

    NASA Technical Reports Server (NTRS)

    Phillips, R. E.; Schmidt, F. W.

    1985-01-01

    The solution of elliptic passive scalar advection-diffusion equations is required in the analysis of many turbulent flow and convective heat transfer problems. The accuracy of the solution may be affected by the presence of regions containing large gradients of the dependent variables. The multigrid concept of local grid refinement is a method for improving the accuracy of the calculations in these problems. In combination with the multilevel acceleration techniques, an accurate and efficient computational procedure is developed. In addition, a robust implementation of the QUICK finite-difference scheme is described. Calculations of a test problem are presented to quantitatively demonstrate the advantages of the multilevel-multigrid method.

  18. Preconditioned iterative methods for space-time fractional advection-diffusion equations

    NASA Astrophysics Data System (ADS)

    Zhao, Zhi; Jin, Xiao-Qing; Lin, Matthew M.

    2016-08-01

    In this paper, we propose practical numerical methods for solving a class of initial-boundary value problems of space-time fractional advection-diffusion equations. First, we propose an implicit method based on two-sided Grünwald formulae and discuss its stability and consistency. Then, we develop the preconditioned generalized minimal residual (preconditioned GMRES) method and preconditioned conjugate gradient normal residual (preconditioned CGNR) method with easily constructed preconditioners. Importantly, because resulting systems are Toeplitz-like, fast Fourier transform can be applied to significantly reduce the computational cost. We perform numerical experiments to demonstrate the efficiency of our preconditioners, even in cases with variable coefficients.

  19. Reformulations for general advection-diffusion-reaction equations and locally implicit ADER schemes

    NASA Astrophysics Data System (ADS)

    Montecinos, Gino I.; Toro, Eleuterio F.

    2014-10-01

    Following Cattaneo's original idea, in this article we first present two relaxation formulations for time-dependent, non-linear systems of advection-diffusion-reaction equations. Such formulations yield time-dependent non-linear hyperbolic balance laws with stiff source terms. Then we present a locally implicit version of the ADER method to solve these stiff systems to high accuracy. The new ingredient of the numerical methodology is a locally implicit solution of the generalised Riemann problem. We illustrate the formulations and the resulting numerical approach by solving the compressible Navier-Stokes equations.

  20. Design and analysis of ADER-type schemes for model advection-diffusion-reaction equations

    NASA Astrophysics Data System (ADS)

    Busto, S.; Toro, E. F.; Vázquez-Cendón, M. E.

    2016-12-01

    We construct, analyze and assess various schemes of second order of accuracy in space and time for model advection-diffusion-reaction differential equations. The constructed schemes are meant to be of practical use in solving industrial problems and are derived following two related approaches, namely ADER and MUSCL-Hancock. Detailed analysis of linear stability and local truncation error are carried out. In addition, the schemes are implemented and assessed for various test problems. Empirical convergence rate studies confirm the theoretically expected accuracy in both space and time.