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Sample records for adsorption isotherm experiments

  1. Probing the mechanism of water adsorption in carbon micropores with multitemperature isotherms and water preadsorption experiments.

    PubMed

    Rutherford, S W

    2006-11-21

    The phenomenon of water adsorption in carbon micropores is examined through the study of water adsorption equilibrium in molecular sieving carbon. Adsorption and desorption isotherms are obtained over a wide range of concentrations from less than 0.1% to beyond 80% of the vapor pressure. Evidence is provided in support of a proposed bimodal water adsorption mechanism that involves the interaction of water molecules with functional groups at low relative pressures and the adsorption of water molecules between graphene layers at higher pressures. Decomposition of the equilibrium isotherm data through application of the extended cooperative multimolecular sorption theory, together with favorable quantitative comparison, provides support for the proposed adsorption mechanism. Additional support is obtained from a multitemperature study of water equilibrium. Temperatures of 20, 50, and 60 degrees C were probed in this investigation in order to provide isosteric heat of adsorption data for water interaction with the carbon molecular sieve. At low loading, the derived isosteric heat of adsorption is estimated to be 69 kJ/mol. This value is indicative of the adsorption of water to functional groups. At higher loading, the isosteric heat of adsorption decreases with increasing loading and approaches the heat of condensation, indicative of adsorption between graphene layers. Further support for the proposed adsorption mechanism is derived from carbon dioxide adsorption experiments on carbon molecular sieve that is preadsorbed with various amounts of water. Significant exclusion of carbon dioxide occurs, and a quantitative analysis that is based on the proposed bimodal water adsorption mechanism is employed in this investigation.

  2. The Calculation of Adsorption Isotherms from Chromatographic Peak Shapes

    ERIC Educational Resources Information Center

    Neumann, M. G.

    1976-01-01

    Discusses the relationship between adsorption isotherms and elution peak shapes in gas chromatography, and describes a laboratory experiment which involves the adsorption of hexane, cyclohexane, and benzene on alumina at different temperatures. (MLH)

  3. Adsorption isotherms of charged nanoparticles.

    PubMed

    Dos Santos, Alexandre P; Bakhshandeh, Amin; Diehl, Alexandre; Levin, Yan

    2016-10-19

    We present theory and simulations which allow us to quantitatively calculate the amount of surface adsorption excess of charged nanoparticles onto a charged surface. The theory is very accurate for weakly charged nanoparticles and can be used at physiological concentrations of salt. We have also developed an efficient simulation algorithm which can be used for dilute suspensions of nanoparticles of any charge, even at very large salt concentrations. With the help of the new simulation method, we are able to efficiently calculate the adsorption isotherms of highly charged nanoparticles in suspensions containing multivalent ions, for which there are no accurate theoretical methods available.

  4. A Simple Adsorption Experiment

    ERIC Educational Resources Information Center

    Guirado, Gonzalo; Ayllon, Jose A.

    2011-01-01

    The study of adsorption phenomenon is one of the most relevant and traditional physical chemistry experiments performed by chemistry undergraduate students in laboratory courses. In this article, we describe an easy, inexpensive, and straightforward way to experimentally determine adsorption isotherms using pieces of filter paper as the adsorbent…

  5. Adsorption Isotherms and Surface Reaction Kinetics

    ERIC Educational Resources Information Center

    Lobo, L. S.; Bernardo, C. A.

    1974-01-01

    Explains an error that occurs in calculating the conditions for a maximum value of a rate expression for a bimolecular reaction. The rate expression is derived using the Langmuir adsorption isotherm to relate gas pressures and corresponding surface coverages. (GS)

  6. Adsorption isotherm of non-azeotropic solution onto porous adsorbents

    NASA Astrophysics Data System (ADS)

    Bono, A.; Ramlan, N. A.; Anisuzzaman, S. M.; Chu, C. M.; Farm, Y. Y.

    2016-06-01

    Adsorption isotherm is essential component in the understanding of the adsorption process. Several methods of the measurements, analysis and interpretation of adsorption from solution have been reported in the literature. Most of the measurements of adsorption isotherm from solution were involved the measurement of excess isotherm conducted at low region of sorbates concentration. Direct interpretation of excess adsorption isotherm as adsorption isotherm is always been practice. Therefore, in this work a study on the measurement of the adsorption isotherm from solution of non-azeotropic organic solvent mixture onto porous adsorbents for whole range of liquid concentration was conducted. The study included the measurement of excess adsorption isotherm using conventional technique. Theoretical analysis and interpretation of adsorption isotherm from the excess isotherm were conducted using Pseudo Ideal Adsorption, Gibbs Dividing Plane Model and Langmuir-Fruendlich binary isotherm model. For organic solvents, acetone and propanol were chosen as the adsorbates due to the non-azeotropic properties in the mixture. Activated carbon and silicalite were chosen as adsorbents due to the different in their porosity such as macro porous and micro porous structure. The result of the study has revealed that the adsorption isotherm of non-azeotropic mixture onto activated carbon and silicalite can be interpreted as monolayer type of adsorption.

  7. Determination of adsorption isotherms in supercritical fluid chromatography.

    PubMed

    Enmark, Martin; Forssén, Patrik; Samuelsson, Jörgen; Fornstedt, Torgny

    2013-10-18

    In this study we will demonstrate the potential of modern integrated commercial analytical SFC-systems for rapid and reliable acquisition of thermodynamic data. This will be done by transferring the following adsorption isotherm determination methods from liquid chromatography (LC) to supercritical fluid chromatography (SFC): Elution by Characteristic Points (ECP), the Retention Time Method (RTM), the Inverse Method (IM) and the Perturbation Peak (PP) method. In order to transfer these methods to SFC in a reliable, reproducible way we will demonstrate that careful system verification using external sensors of mass flow, temperature and pressure are needed first. The adsorption isotherm data generated by the different methods were analyzed and compared and the adsorption isotherms ability to predict new experimental elution profiles was verified by comparing experiments with simulations. It was found that adsorption isotherm data determined based on elution profiles, i.e., ECP, IM and RTM, were able to accurately predict overloaded experimental elution profiles while the more tedious and time-consuming PP method, based on small injections on concentration plateaus, failed in doing so.

  8. Adsorption isotherm special study. Final report

    SciTech Connect

    1993-05-01

    The study was designed to identify methods to determine adsorption applicable to Uranium Mill Tailings Remedial Action (UMTRA) Project sites, and to determine how changes in aquifer conditions affect metal adsorption, resulting retardation factors, and estimated contaminant migration rates. EPA and ASTM procedures were used to estimate sediment sorption of U, As, and Mo under varying groundwater geochemical conditions. Aquifer matrix materials from three distinct locations at the DOE UMTRA Project site in Rifle, CO, were used as the adsorbents under different pH conditions; these conditions stimulated geochemical environments under the tailings, near the tailings, and downgradient from the tailings. Grain size, total surface area, bulk and clay mineralogy, and petrography of the sediments were characterized. U and Mo yielded linear isotherms, while As had nonlinear ones. U and Mo were adsorbed strongly on sediments acidified to levels similar to tailings leachate. Changes in pH had much less effect on As adsorption. Mo was adsorbed very little at pH 7-7.3, U was weakly sorbed, and As was moderately sorbed. Velocities were estimated for metal transport at different pHs. Results show that the aquifer materials must be characterized to estimate metal transport velocities in aquifers and to develop groundwater restoration strategies for the UMTRA project.

  9. Kinetics and isotherms of Neutral Red adsorption on peanut husk.

    PubMed

    Han, Runping; Han, Pan; Cai, Zhaohui; Zhao, Zhenhui; Tang, Mingsheng

    2008-01-01

    Adsorption of Neutral Red (NR) onto peanut husk in aqueous solutions was investigated at 295 K. Experiments were carried out as function of pH, adsorbent dosage, contact time, and initial concentration. The equilibrium adsorption data were analyzed by Langmuir, Freundlich, Temkin, Dubinin-Radushkevich, and Toth isotherm models. The results indicated that the Toth and Langmuir models provided the best correlation of the experimental data. The adsorption capacity of peanut husk for the removal of NR was determined with the Langmuir and found to be 37.5 mg/g at 295 K. The adsorption kinetic data were modeled using the pseudo-first order, pseudo-second order, and intra-particle diffusion kinetic equations. It was seen that the pseudo-first order and pseudo-second order kinetic equations could describe the adsorption kinetics. The intraparticle diffusion model was also used to express the adsorption process at the two-step stage. It was implied that peanut husk may be suitable as adsorbent material for adsorption of NR from aqueous solutions.

  10. Isothermal Dendritic Growth Experiment Video

    NASA Technical Reports Server (NTRS)

    1997-01-01

    This video, captured during the Isothermal Dendritic Growth Experiment (IDGE) flown on STS-87 as a part of the fourth United States Microgravity payload, shows the growth of a dendrite, and the surface solidification that occurred on the front and back windows of the growth chamber. Dendrites are tiny, tree like structures that form as metals solidify.

  11. IDGE: Isothermal Dendritic Growth Experiment

    NASA Technical Reports Server (NTRS)

    1994-01-01

    The Isothermal Dendritic Growth Experiment (IDGE) flew on STS-62 to study the microscopic, tree-like structures (dendrites) that form within metals as they solidify from molten materials. The size, shape, and orientation of these dendrites affect the strength and usefulness of metals. Data from this experiment will be used to test and improve the mathematical models that support the industrial production of metals.

  12. Derivation of the Freundlich Adsorption Isotherm from Kinetics

    ERIC Educational Resources Information Center

    Skopp, Joseph

    2009-01-01

    The Freundlich adsorption isotherm is a useful description of adsorption phenomena. It is frequently presented as an empirical equation with little theoretical basis. In fact, a variety of derivations exist. Here a new derivation is presented using the concepts of fractal reaction kinetics. This derivation provides an alternative basis for…

  13. Adsorption of nitrophenol onto activated carbon: isotherms and breakthrough curves.

    PubMed

    Chern, Jia-Ming; Chien, Yi-Wen

    2002-02-01

    The adsorption isotherm of p-nitrophenol onto granular activated carbon in 25 degrees C aqueous solution was experimentally determined by batch tests. Both the Freundlich and the Redlich-Peterson models were found to fit the adsorption isotherm data well. A series of column tests were performed to determine the breakthrough curves with varying bed depths (3-6 cm) and water flow rates (21.6-86.4 cm3/h). Explicit equations for the breakthrough curves of the fixed-bed adsorption processes with the Langmuir and the Freundlich adsorption isotherms were developed by the constant-pattern wave approach using a constant driving force model in the liquid phase. The results show that the half breakthrough time increases proportionally with increasing bed depth but decreases inverse proportionally with increasing water flow rate. The constant-pattern wave approach using the Freundlich isotherm model fits the experimental breakthrough curves quite satisfactorily. A correlation was proposed to predict the volumetric mass-transfer coefficient in the liquid phase successfully. The effects of solution temperature and pH on the adsorption isotherm were also studied and the Tóth model was found to fit the isotherm data well at varying solution temperatures and pHs.

  14. Determination of the Surface Energy of Sand Using Adsorption Isotherm

    NASA Astrophysics Data System (ADS)

    Ma, Lianxi; Holste, James; Hall, Kenneth

    2003-03-01

    The BET isotherm equation for multiplayer adsorption was applied to hexane, methyl propyl ketone, and water adsorption by sand (particle size > 75 mm) at 25¡ãC and accordingly, specific surface area of sand was obtained. Spreading pressures and surface energies of sand were calculated from adsorption isotherms. Hysteresis loops were observed in all isotherms but desorption isotherms approach to original points at low vapor pressure. A modified Toth-Freundlich equation was developed, which agrees with experimental data well over a wider p/p0 range. Plots of Dubinin-Radushkevich show that at low-pressure linear relation was obtained therefore our sand sample can be treated as microporous materials.

  15. Experimental adsorption isotherms based on inverse gas chromatography.

    PubMed

    Kalogirou, E; Bassiotis, I; Artemiadi, Th; Margariti, S; Siokos, V; Roubani-Kalantzopoulou, F

    2002-09-06

    A new chromatographic perturbation method is used for studying the adsorption-desorption equilibrium in various gas-solid heterogeneous systems. It is the reversed-flow method giving accurate and precise values of many physicochemical constants including the basic and necessary adsorption isotherm values. For four inorganic oxides, namely, Cr2O3, Fe2O3, TiO2 and PbO, and two aromatic hydrocarbons (benzene, toluene) these adsorption isotherms have been determined through a non-linear model.

  16. Pattern of adsorption isotherms in Ono-Kondo coordinates.

    PubMed

    Sumanatrakul, Panita; Abaza, Sarah; Aranovich, Gregory L; Sangwichien, Chayanoot; Donohue, Marc D

    2012-02-15

    The Ono-Kondo lattice density functional theory is used to analyze adsorbate-adsorbate interactions for supercritical systems. In prior work, this approach has been used to study intermolecular interactions in subcritical adsorbed phases, and this has included the study of adsorbate-adsorbate repulsions in the regime of adsorption compression. In this paper, we present the general pattern of adsorption isotherms in Ono-Kondo coordinates; this has not been done in the past. For this purpose, experimental isotherms for adsorption of supercritical fluids (including nitrogen, methane, and carbon dioxide) are plotted in Ono-Kondo coordinates. In addition, we performed Grand Canonical Monte Carlo simulations of adsorption for Lennard-Jones molecules and plotted isotherms in Ono-Kondo coordinates. Our results indicate a pattern of isotherms with regimes of adsorbate-adsorbate attractions at low surface coverage and adsorbate-adsorbate repulsions at high surface coverage. When the generalized Ono-Kondo model is used over a wide range of pressures - from low pressures of the Henry's law regime to supercritical pressures - the slope of the isotherm varies from positive at low pressures to negative at high pressures. The linear sections of these graphs show when the adsorbate-adsorbate interaction energies are approximately constant. When these linear sections have negative slopes, it indicates that the system is in a state of adsorption compression.

  17. Moisture adsorption isotherms and glass transition temperature of pectin.

    PubMed

    Basu, Santanu; Shivhare, U S; Muley, S

    2013-06-01

    The moisture adsorption isotherms of low methoxyl pectin were determined at 30-70°C and water activity ranging from 0.11 to 0.94. The moisture adsorption isotherms revealed that the equilibrium moisture content increased with water activity. Increase in temperature, in general, resulted in decreased equilibrium moisture content. However in some cases, equilibrium moisture content values increased with temperature at higher water activities. Selected sorption models (GAB, Halsey, Henderson, Oswin, modified Oswin) were tested for describing the adsorption isotherms. Parameters of each sorption models were determined by nonlinear regression analysis. Oswin model gave the best fit for pectin sorption behaviour. Isosteric heat of sorption decreased with increase in moisture content and varied between 14.607 and 0.552 kJ/mol. Glass transition temperature decreased with increase in moisture content of pectin.

  18. Isotherm, thermodynamic, kinetics and adsorption mechanism studies of methyl orange by surfactant modified silkworm exuviae.

    PubMed

    Chen, Hao; Zhao, Jie; Wu, Junyong; Dai, Guoliang

    2011-08-15

    This paper reports on the development of organo-modified silkworm exuviae (MSE) adsorbent prepared by using hexadecyltrimethylammonium bromide (HDTMAB) for removing methyl orange (MO), a model anionic dye, from aqueous solution. The natural and modified samples were characterized by scanning electron microscope (SEM), energy dispersive spectrometer (EDS) and Fourier transform infrared spectroscopy (FT-IR). Batch adsorption experiments were carried out to remove MO from its aqueous solutions using SE and MSE. It was observed that the adsorption capacity of MSE is 5-6 times of SE. The different parameters effecting on the adsorption capacity such as pH of the solution, initial dye concentration, temperature and contact time have been investigated. Analysis of adsorption results obtained at different temperatures showed that the adsorption pattern on the MSE can be described perfectly with Langmuir isotherm model compared with Freundlich and Dubinin-Radushkevich (D-R) isotherm models, and the characteristic parameters for each adsorption isotherm were also determined. The adsorption process has been found exothermic in nature and thermodynamic parameters have been calculated. The adsorption kinetic followed the pseudo-second order kinetic model. The results of FT-IR, EDS and desorption studies all suggest that methyl orange adsorption onto the MSE should be mainly controlled by the hydrophobic interaction mechanism, along with a considerable contribution of the anionic exchange mechanism. The results indicate that HDTMAB-modified silkworm exuviae could be employed as low-cost material for the removal of methyl orange anionic dye from wastewater.

  19. Adsorption and disjoining pressure isotherms of confined polymers using dissipative particle dynamics.

    PubMed

    Goicochea, A Gama

    2007-11-06

    The adsorption and disjoining pressure isotherms of polymers confined by planar walls are obtained using Monte Carlo (MC) simulations in the Grand Canonical (GC) ensemble in combination with the mesoscopic technique known as dissipative particle dynamics (DPD). Two models of effective potentials for the confining surfaces are used: one with both an attractive and a repulsive term and one with a purely repulsive term. As for the polymer, seven-bead linear model of polyethylene glycol (PEG) dissolved in water is used. The results indicate remarkably good agreement between the trends shown by our adsorption isotherms and those obtained from experiments of PEG on oxide surfaces. Additionally, the disjoining pressure isotherm of water shows oscillations, while those of PEG display the same trend for both wall models. Moreover, it is found that the disjoining pressure isotherms are in qualitative agreement with those from experiments on confined linear polymers.

  20. The Isothermal Dendritic Growth Experiment

    NASA Technical Reports Server (NTRS)

    Glicksman, M. E.; Koss, M. B.; Malarik, D. C.

    1998-01-01

    The growth of dendrites is one of the commonly observed forms of solidification encountered when metals and alloys freeze under low thermal gradients, as occurs in most casting and welding processes. In engineering alloys, the details of the dendritic morphology directly relates to important material responses and properties. Of more generic interest, dendritic growth is also an archetypical problem in morphogenesis, where a complex pattern evolves from simple starting conditions. Thus, the physical understanding and mathematical description of how dendritic patterns emerge during the growth process are of interest to both scientists and engineers. The Isothermal Dendritic Growth Experiment (IDGE) is a basic science experiment designed to measure, for a fundamental test of theory, the kinetics and morphology of dendritic growth without complications induced by gravity-driven convection. The IDGE, a collaboration between Rensselaer Polytechnic Institute, in Troy NY, and NASA's Lewis Research Center (LeRC) was developed over a ten year period from a ground-based research program into a space flight experiment. Important to the success of this flight experiment was provision of in situ near-real-time teleoperations during the spaceflight experiment.

  1. ISOTHERMAL AIR INGRESS VALIDATION EXPERIMENTS

    SciTech Connect

    Chang H Oh; Eung S Kim

    2011-09-01

    Idaho National Laboratory carried out air ingress experiments as part of validating computational fluid dynamics (CFD) calculations. An isothermal test loop was designed and set to understand the stratified-flow phenomenon, which is important as the initial air flow into the lower plenum of the very high temperature gas cooled reactor (VHTR) when a large break loss-of-coolant accident occurs. The unique flow characteristics were focused on the VHTR air-ingress accident, in particular, the flow visualization of the stratified flow in the inlet pipe to the vessel lower plenum of the General Atomic’s Gas Turbine-Modular Helium Reactor (GT-MHR). Brine and sucrose were used as heavy fluids, and water was used to represent a light fluid, which mimics a counter current flow due to the density difference between the stimulant fluids. The density ratios were changed between 0.87 and 0.98. This experiment clearly showed that a stratified flow between simulant fluids was established even for very small density differences. The CFD calculations were compared with experimental data. A grid sensitivity study on CFD models was also performed using the Richardson extrapolation and the grid convergence index method for the numerical accuracy of CFD calculations . As a result, the calculated current speed showed very good agreement with the experimental data, indicating that the current CFD methods are suitable for predicting density gradient stratified flow phenomena in the air-ingress accident.

  2. Multifractal characteristics of Nitrogen adsorption isotherms from tropical soils

    NASA Astrophysics Data System (ADS)

    Vidal Vázquez, Eva; Paz Ferreiro, Jorge

    2010-05-01

    One of the primary methods used to characterize a wide range of porous materials, including soils, are gas adsorption isotherms. An adsorption isotherm is a function relating the amount of adsorbed gas or vapour to the respective equilibrium pressure, during pressure increase at constant temperature. Adsorption data allow easily estimates of specific surface area and also can provide a characterization of pore surface heterogeneity. Most of the properties and the reactivity of soil colloids are influenced by their specific surface area and by parameters describing the surface heterogeneity. For a restricted scale range, linearity between applied pressure and volume of adsorbate holds, which is the basis for current estimations of specific surface area. However, adsorption isotherms contain also non-linear segments of pressure versus volume so that evidence of multifractal scale has been demonstrated. The aim of this study was to analyze the multifractal behaviour of nitrogen adsorption isotherms from a set of tropical soils. Samples were collected form 54 horizons belonging to 19 soil profiles in the state of Minas Gerais, Brazil. The most frequent soil type was Oxisol, according to the Soil Survey Staff, equivalent to Latossolo in the Brazilian soil classification system. Nitrogen adsorption isotherms at standard 77 K were measured using a Thermo Finnigan Sorptomatic 1990 gas sorption analyzer (Thermo Scientific, Waltham, MA). From the raw data a distributions of mass along a support was obtained to perform multifractal analysis. The probability distribution was constructed by dividing the values of the measure in a given segment by the sum of the measure in the whole scale range. The box-counting method was employed to perform multifractal analysis. All the analyzed N2 adsorption isotherms behave like a multifractal system. The singularity spectra, f(α), showed asymmetric concave down parabolic shapes, with a greater tendency toward the left side, where moments

  3. Adsorption of water vapor by poly(styrenesulfonic acid), sodium salt: isothermal and isobaric adsorption equilibria.

    PubMed

    Toribio, F; Bellat, J P; Nguyen, P H; Dupont, M

    2004-12-15

    Air conditioning and dehumidifying systems based on sorption on solids are of great interest, especially in humid climates, because they allow reduction of thermal loads and use of chlorofluorocarbons. Previous studies have shown that hydrophilic polymers such as sulfonic polymers can have very high performance in water adsorption from air. The aim of this study was to characterize the water vapor adsorption properties of fully sulfonated and monosulfonated poly(styrenesulfonic acid), sodium salt, and to elucidate the mechanism of adsorption on these materials. Adsorption isotherms have been determined by TGA between 298 and 317 K for pressures ranging from 0.1 to 45 hPa. They have type II of the IUPAC classification and a small hysteresis loop between adsorption and desorption processes was observed only for the monosulfonated sample. Water content is up to 80% weight at 80% relative humidity. Adsorption isotherms have been well fitted with the FHH model. Adsorption-desorption isobars have been determined by TGA under 37 hPa in the temperature range 298-373 K. They show that these polymers can be completely regenerated by heating at 313 K under humidified air. No degradation of the adsorption properties has been observed after several regenerations. Adsorption enthalpies and entropies have been deduced from the Clapeyron equation and from DSC measurements. A good agreement was found. A mechanism of adsorption is proposed considering two kinds of adsorbate: bounded water in electrostatic interaction with functional groups and free water resulting from condensation.

  4. A model free method for estimation of complicated adsorption isotherms in liquid chromatography.

    PubMed

    Forssén, Patrik; Fornstedt, Torgny

    2015-08-28

    Here we show that even extremely small variations in the adsorption isotherm can have a tremendous effect on the shape of the overloaded elution profiles and that the earlier in the adsorption isotherms the variation take place, the larger its impact on the shape of the elution profile. These variations are so small that they can be "hidden" by the discretization and in the general experimental noise when using traditional experimental methods, such as frontal analysis, to measure adsorption isotherms. But as the effects of these variations are more clearly visible in the elution profiles, the Inverse Method (IM) of adsorption isotherm estimation is an option. However, IM usually requires that one selects an adsorption isotherm model prior to the estimation process. Here we show that even complicated models might not be able to estimate the adsorption isotherms with multiple inflection points that small variations might give rise to. We therefore developed a modified IM that, instead of fixed adsorption isotherm models, uses monotone piecewise interpolation. We first validated the method with synthetic data and showed that it can be used to estimate an adsorption isotherm, which accurately predicts an extremely "strange" elution profile. For this case it was impossible to estimate the adsorption isotherm using IM with a fixed adsorption model. Finally, we will give an example of a real chromatographic system where adsorption isotherm with inflection points is estimated by the modified IM.

  5. Numerical estimation of adsorption energy distributions from adsorption isotherm data with the expectation-maximization method

    SciTech Connect

    Stanley, B.J.; Guiochon, G. |

    1993-08-01

    The expectation-maximization (EM) method of parameter estimation is used to calculate adsorption energy distributions of molecular probes from their adsorption isotherms. EM does not require prior knowledge of the distribution function or the isotherm, requires no smoothing of the isotherm data, and converges with high stability towards the maximum-likelihood estimate. The method is therefore robust and accurate at high iteration numbers. The EM algorithm is tested with simulated energy distributions corresponding to unimodal Gaussian, bimodal Gaussian, Poisson distributions, and the distributions resulting from Misra isotherms. Theoretical isotherms are generated from these distributions using the Langmuir model, and then chromatographic band profiles are computed using the ideal model of chromatography. Noise is then introduced in the theoretical band profiles comparable to those observed experimentally. The isotherm is then calculated using the elution-by-characteristic points method. The energy distribution given by the EM method is compared to the original one. Results are contrasted to those obtained with the House and Jaycock algorithm HILDA, and shown to be superior in terms of robustness, accuracy, and information theory. The effect of undersampling of the high-pressure/low-energy region of the adsorption is reported and discussed for the EM algorithm, as well as the effect of signal-to-noise ratio on the degree of heterogeneity that may be estimated experimentally.

  6. Reliable prediction of adsorption isotherms via genetic algorithm molecular simulation.

    PubMed

    LoftiKatooli, L; Shahsavand, A

    2017-01-01

    Conventional molecular simulation techniques such as grand canonical Monte Carlo (GCMC) strictly rely on purely random search inside the simulation box for predicting the adsorption isotherms. This blind search is usually extremely time demanding for providing a faithful approximation of the real isotherm and in some cases may lead to non-optimal solutions. A novel approach is presented in this article which does not use any of the classical steps of the standard GCMC method, such as displacement, insertation, and removal. The new approach is based on the well-known genetic algorithm to find the optimal configuration for adsorption of any adsorbate on a structured adsorbent under prevailing pressure and temperature. The proposed approach considers the molecular simulation problem as a global optimization challenge. A detailed flow chart of our so-called genetic algorithm molecular simulation (GAMS) method is presented, which is entirely different from traditions molecular simulation approaches. Three real case studies (for adsorption of CO2 and H2 over various zeolites) are borrowed from literature to clearly illustrate the superior performances of the proposed method over the standard GCMC technique. For the present method, the average absolute values of percentage errors are around 11% (RHO-H2), 5% (CHA-CO2), and 16% (BEA-CO2), while they were about 70%, 15%, and 40% for the standard GCMC technique, respectively.

  7. Effect of pore blockage on adsorption isotherms and dynamics: Anomalous adsorption of iodine on activated carbon

    SciTech Connect

    Bhatia, S.K.; Liu, F.; Arvind, G.

    2000-04-18

    Isotherm hysteresis and pore-clocking effects of trapped molecules on adsorption dynamics is studied here, using the iodine-carbon system in the 300--343 K temperature range. It is found that a portion of the iodine is strongly adsorbed, and does not desorb, even over very long time scales, while the remainder adsorbs reversibly as a homogeneous monolayer with a Langmuirian isotherm in mesopores. The strongly adsorbed iodine appears to adsorb in micropores and at the mesopore mouths, hindering uptake of the reversible iodine. The uptake data for the adsorption and desorption dynamics of the reversible part is found to be best explained by means of a pore mouth resistance control mechanism. it is concluded that the dynamics of the adsorption and desorption at the pore mouth is important at early stages of the process.

  8. Enhanced fluoride adsorption by nano crystalline γ-alumina: adsorption kinetics, isotherm modeling and thermodynamic studies

    NASA Astrophysics Data System (ADS)

    Chinnakoti, Prathibha; Chunduri, Avinash L. A.; Vankayala, Ranganayakulu K.; Patnaik, Sandeep; Kamisetti, Venkataramaniah

    2016-06-01

    Nano materials in particular nano oxides with enhanced surface area and an excellent catalytic surface serve as potential adsorbents for defluoridation of water. In the present study nano γ-alumina was synthesized through a simple and low cost, surfactant assisted solution combustion method. As synthesized material was characterized by XRD and FESEM for its phase, size and morphological characteristics. Surface properties have been investigated by BET method. Nano γ-alumina was further used for a detailed adsorption study to remove fluoride from water. Batches of experiments were performed at various experimental conditions such as solution pH, adsorbent dose, initial fluoride concentration and contact time to test the defluoridation ability of γ-alumina. Fluoride Adsorption by nano sized γ-alumina was rapid and reached equilibrium within two hours. The adsorption worked well at pH 4.0, where ˜96 % of fluoride was found to be adsorbed on adsorbent. It was possible to reduce fluoride levels to as low as 0.3 mg/L (within the safe limit of WHO: ≤1.5 mg/L) from an initial fluoride levels of 10 mg/L. This could be achieved using a very small quantity, 1 g/L of γ-alumina at pH 4 within 1 h of contact time. Defluoridation capacity of nano γ-alumina was further investigated by fitting the equilibrium data to various isotherm as well as kinetic models. The present study revealed that γ-alumina could be an efficient adsorbent for treating fluoride contaminated water.

  9. Adsorption isotherms of 2,2,4-trimethylpentane and toluene vapors on hydrocarbon adsorber and light-off catalyst.

    PubMed

    Kim, Dae Jung

    2004-01-15

    Two monolithic hydrocarbon adsorbers and a monolithic light-off catalyst were selected as adsorbents, and the adsorptive capacity of a hydrocarbon for the adsorbents was measured by using a precise volumetric adsorption apparatus. 2,2,4-Trimethylpentane and toluene vapors were chosen as adsorbates. Equilibrium experiments were carried out at three different temperatures of 303.15, 323.15, and 343.15 K. Adsorption data of each hydrocarbon was fitted to the well-known isotherms such as the Langmuir equation and the Freundlich equation. The Freundlich isotherm predicted equilibrium data better than the Langmuir isotherm. Furthermore, the surface energetic heterogeneity of the adsorbents was evaluated using the isosteric heat of adsorption based on Clausius-Clapeyron equation. The surface energetic heterogeneity of the adsorbents depended on the precious metal (PM) loading and H-ZSM5 loading.

  10. Optimal smoothing of site-energy distributions from adsorption isotherms

    SciTech Connect

    Brown, L.F.; Travis, B.J.

    1983-01-01

    The equation for the adsorption isotherm on a heterogeneous surface is a Fredholm integral equation. In solving it for the site-energy distribution (SED), some sort of smoothing must be carried out. The optimal amount of smoothing will give the most information that is possible without introducing nonexistent structure into the SED. Recently, Butler, Reeds, and Dawson proposed a criterion (the BRD criterion) for choosing the optimal smoothing parameter when using regularization to solve Fredholm equations. The BRD criterion is tested for its suitability in obtaining optimal SED's. This criterion is found to be too conservative. While using it never introduces nonexistent structure into the SED, significant information is often lost. At present, no simple criterion for choosing the optimal smoothing parameter exists, and a modeling approach is recommended.

  11. Adsorption intrinsic kinetics and isotherms of lead ions on steel slag.

    PubMed

    Liu, Sheng-Yu; Gao, Jin; Yang, Yi-Jin; Yang, Ying-Chun; Ye, Zhi-Xiang

    2010-01-15

    Batch experiments were carried out to investigate the kinetics of adsorption of lead ions by steel slag on the basis of the external diffusion, intra-particle diffusion and adsorption reaction model (pseudo-first-order, pseudo-second-order). The results showed that the controlling step for the adsorption kinetics changed with the varying experimental parameters. When the particle size of steel slag was larger than 120 mesh, intra-particle diffusion of Pb(2+) was the controlling step, and when the initial concentration of Pb(2+) was less than 150 m gL(-1) or the shaking rate was lower than 150 rpm, external diffusion of Pb(2+) was promoted. Contrary to the former experimental conditions the adsorption reaction was the controlling step, and the adsorption followed second-order kinetics, with an adsorption rate constant of 13.26 g mg(-1)min(-1). The adsorption isotherm of Pb(2+) with steel slag followed the Langmuir model, with a correlation coefficient of 0.99.

  12. Metal adsorption by agricultural biosorbents: Adsorption isotherm, kinetic and biosorbents chemical structures.

    PubMed

    Sadeek, Sadeek A; Negm, Nabel A; Hefni, Hassan H H; Wahab, Mostafa M Abdel

    2015-11-01

    Biosorption of Cu(II), Co(II) and Fe(III) ions from aqueous solutions by rice husk, palm leaf and water hyacinth was investigated as a function of initial pH, initial heavy metal ions concentration and treatment time. The adsorption process was examined by two adsorption isotherms: Langmuir and Freundlich isotherms. The experimental data of biosorption process were analyzed using pseudo-first order, pseudo-second order kinetic models. The equilibrium biosorption isotherms showed that the three studied biosorbents possess high affinity and sorption capacity for Cu(II), Co(II) and Fe(III) ions. Rice husk showed more efficiency than palm leaf and water hyacinth. Adsorption of Cu(II) and Co(II) was more efficient in alkaline medium (pH 9) than neutral medium due to the high solubility of metal ion complexes. The metal removal efficiency of each biosorbent was correlated to its chemical structure. DTA studies showed formation of metal complex between the biosorbents and the metal ions. The obtained results showed that the tested biosorbents are efficient and alternate low-cost biosorbent for removal of heavy metal ions from aqueous media.

  13. Universal singularities of multilayer adsorption isotherms and determination of surface area of adsorbents

    SciTech Connect

    Aranovich, G.L.; Donohue, M.D.

    1996-07-15

    The singularity in the adsorption isotherm for macroporous and nonporous adsorbents is considered as a universal function that can be characterized with two parameters: a coefficient of proportionality, K, and an exponent, d. It is shown that the value of K is proportional to the adsorbent surface area but does not depend on the nature of the adsorbent. This leads to a new method to determine the surface area of an adsorbent, S, that is independent of the form of the adsorption isotherm at low and moderate reduced pressures. Comparison with the BET areas for nitrogen shows that the new method gives the values of S which are very close to the BET results if K = 1.47 {times} 10{sup {minus}5} mol/m{sup 2} (for nitrogen). Analysis of adsorption data for macroporous adsorbents shows that the BET isotherm gives systematic deviations and that the experimental amount adsorbed is smaller than the value predicted by the BET equation (even in the range of the best agreement with experiment). These deviations lead to systematic error in the values of S of about 43%. Using K equal to K{sub f} = 1/{sigma}N{sub A} (=1.025 {times} 10{sup {minus}5} mol/m{sup 2} for nitrogen), the authors are able to eliminate systematic error in the surface area determination. Here {sigma} is the area occupied by one molecule and N{sub A} is the Avogadro number.

  14. Adsorption of ammonium ion by coconut shell-activated carbon from aqueous solution: kinetic, isotherm, and thermodynamic studies.

    PubMed

    Boopathy, Ramasamy; Karthikeyan, Sekar; Mandal, Asit Baran; Sekaran, Ganesan

    2013-01-01

    Ammonium ions are one of the most encountered nitrogen species in polluted water bodies. High level of ammonium ion in aqueous solution imparts unpleasant taste and odor problems, which can interfere with the life of aquatics and human population when discharged. Many chemical methods are developed and being used for removal of ammonium ion from aqueous solution. Among various techniques, adsorption was found to be the most feasible and environmentally friendly with the use of natural-activated adsorbents. Hence, in this study, coconut shell-activated carbon (CSAC) was prepared and used for the removal of ammonium ion by adsorption techniques. Ammonium chloride (analytical grade) was purchased from Merck Chemicals for adsorption studies. The CSAC was used to adsorb ammonium ions under stirring at 100 rpm, using orbital shaker in batch experiments. The concentration of ammonium ion was estimated by ammonia distillate, using a Buchi distillation unit. The influence of process parameters such as pH, temperature, and contact time was studied for adsorption of ammonium ion, and kinetic, isotherm models were validated to understand the mechanism of adsorption of ammonium ion by CSAC. Thermodynamic properties such as ∆G, ∆H, and ∆S were determined for the ammonium adsorption, using van't Hoff equation. Further, the adsorption of ammonium ion was confirmed through instrumental analyses such as SEM, XRD, and FTIR. The optimum conditions for the effective adsorption of ammonium ion onto CSAC were found to be pH 9.0, temperature 283 K, and contact time 120 min. The experimental data was best followed by pseudosecond order equation, and the adsorption isotherm model obeyed the Freundlich isotherm. This explains the ammonium ion adsorption onto CSAC which was a multilayer adsorption with intraparticle diffusion. Negative enthalpy confirmed that this adsorption process was exothermic. The instrumental analyses confirmed the adsorption of ammonium ion onto CSAC.

  15. Moisture Adsorption Isotherms and Thermodynamic Characteristics of Tannic Acid

    NASA Astrophysics Data System (ADS)

    Červenka, L.; Cacková, L.

    2016-09-01

    Moisture adsorption isotherms of tannic acid were determined at 5, 15, and 35°C with the use of the static gravimetric method in the range 0.113-0.980 aw (aw is the water activity). It was shown that tannic acid adsorbed more water at 5°C. The experimental data fitted well to the Guggenheim-Anderson-de Boer and Yanniotis-Blahovec equations, giving the corresponding parameters by nonlinear regression. The monolayer moisture content, number of monolayers, and the surface area of sorption were demonstrated to decrease with increasing temperature. Mesopores dominated below the monolayer moisture content followed by the formation of macropores. The variation of the differential enthalpy and entropy with the moisture content showed that water was strongly bound to the surface of tannic acid below the moisture content 5.0 g water/100 g dry basis. The adsorption process was found to be enthalpy-driven; however, it was not spontaneous at a low moisture content, as follows from the enthalpy-entropy compensation theory. The variation of the net integral enthalpy and entropy (at a constant spreading pressure) with the moisture content exhibited maximum and minimum values, respectively. This behavior indicated that water molecules were strongly bound to the tannic acid surface at the moisture content up to its monolayer values.

  16. Kinetic and isotherms studies of phosphorus adsorption onto natural riparian wetland sediments: linear and non-linear methods.

    PubMed

    Zhang, Liang; Du, Chao; Du, Yun; Xu, Meng; Chen, Shijian; Liu, Hongbin

    2015-06-01

    Riparian wetlands provide critical functions for the improvement of surface water quality and storage of nutrients. Correspondingly, investigation of the adsorption characteristic and capacity of nutrients onto its sediments is benefit for utilizing and protecting the ecosystem services provided by riparian areas. The Langmuir and Freundlich isotherms and pseudo-second-order kinetic model were applied by using both linear least-squares and trial-and-error non-linear regression methods based on the batch experiments data. The results indicated that the transformations of non-linear isotherms to linear forms would affect the determination process significantly, but the non-linear regression method could prevent such errors. Non-linear Langmuir and Freundlich isotherms both fitted well with the phosphorus adsorption process (r (2) > 0.94). Moreover, the influences of temperature and ionic strength on the adsorption of phosphorus onto natural riparian wetland sediments were also studied. Higher temperatures were suitable for phosphorus uptake from aqueous solution using the present riparian wetland sediments. The adsorption capacity increased with the enhancement of ionic strength in agreement with the formation of inner-sphere complexes. The quick adsorption of phosphorus by the sediments mainly occurred within 10 min. The adsorption kinetic was well-fitted by pseudo-second-order kinetic model (r (2) > 0.99). The scanning electron microscopy (SEM) and Fourier transformation infrared (FT-IR) spectra analyses before and after phosphorus adsorption revealed the main adsorption mechanisms in the present system.

  17. A modified Langmuir-Freundlich isotherm model for simulating pH-dependent adsorption effects.

    PubMed

    Jeppu, Gautham P; Clement, T Prabhakar

    2012-03-15

    Analytical isotherm equations such as Langmuir and Freundlich isotherms are widely used for modeling adsorption data. However, these isotherms are primarily useful for simulating data collected at a fixed pH value and cannot be easily adapted to simulate pH-dependent adsorption effects. Therefore, most adsorption studies currently use numerical surface-complexation models (SCMs), which are more complex and time consuming than traditional analytical isotherm models. In this work, we propose a new analytical isotherm model, identified as the modified Langmuir-Freundlich (MLF) isotherm, which can be used to simulate pH-dependent adsorption. The MLF isotherm uses a linear correlation between pH and affinity coefficient values. We validated the proposed MLF isotherm by predicting arsenic adsorption onto two different types of sorbents: pure goethite and goethite-coated sand. The MLF model gave good predictions for both experimental and surface complexation-model predicted datasets for these two sorbents. The proposed analytical isotherm framework can help reduce modeling complexity, model development time, and computational efforts. One of the limitations of the proposed method is that it is currently valid only for single-component systems. Furthermore, the model requires a system-specific pH. vs. affinity coefficient relation. Despite these limitations, the approach provides a promising analytical framework for simulating pH-dependent adsorption effects.

  18. Correlation of adsorption isotherms of hydrogen isotopes on mordenite adsorbents using reactive vacancy solution theory

    SciTech Connect

    Munakata, K.; Nakamura, A.; Kawamura, Y.

    2015-03-15

    The authors have applied the isotherm equations derived from the reactive vacancy solution theory (RVST) to correlation of experimental and highly non-ideal adsorption isotherms of hydrogen and deuterium on a mordenite adsorbent, and have examined the ability of the isotherm equations to match this correlation. Several isotherm equations such as Langmuir, Freundlich, Toth, Vacancy Solution Theory and so forth were also tested, but they did not work. For the Langmuir-Freundlich equation tests have indicated that its 'ability to correlate' of the adsorption isotherms is not satisfactory. For the multi-site Langmuir-Freundlich (MSLF) equation the correlation of the isotherms appears to be somewhat improved but remains unsatisfactory. The results show that the isotherm equations derived from RVST can better correlate the experimental isotherms.

  19. Ni (II) adsorption onto Chrysanthemum indicum: Influencing factors, isotherms, kinetics, and thermodynamics.

    PubMed

    Vilvanathan, Sowmya; Shanthakumar, S

    2016-10-02

    The study explores the adsorption potential of Chrysanthemum indicum biomass for nickel ion removal from aqueous solution. C. indicum flowers in raw (CIF-I) and biochar (CIF-II) forms were used as adsorbents in this study. Batch experiments were conducted to ascertain the optimum conditions of solution pH, adsorbent dosage, contact time, and temperature for varying initial Ni(II) ion concentrations. Surface area, surface morphology, and functionality of the adsorbents were characterized by Brunauer, Emmett, and Teller (BET) surface analysis, scanning electron microscopy (SEM), energy-dispersive X-ray spectroscopy (EDX), and Fourier transform infrared spectroscopy (FTIR). Adsorption kinetics were modeled using pseudo-first order, pseudo-second order, Elovich, intraparticle diffusion, Bangham's, and Boyd's plot. The equilibrium data were modeled using Langmuir, Freundlich, Temkin, and Dubinin-Radushkevich (D-R) isotherm models. Experimental data provided the best fit to pseudo-second-order kinetic model and Langmuir isotherm model for the adsorption of Ni(II) ion on both CIF-I and CIF-II with maximum adsorption capacities of 23.97 and 44.02 mg g(-1), respectively. Thermodynamic analysis of the data proved the process to be spontaneous and endothermic in nature. Desorption studies were conducted to evaluate the possibility of reusing the adsorbents. Findings of the present study provide substantial evidence for the use of C. indicum flower as an eco-friendly and potential adsorbent for the removal of Ni(II) ions from aqueous solution.

  20. Application of water-activated carbon isotherm models to water adsorption isotherms of single-walled carbon nanotubes.

    PubMed

    Kim, Pyoungchung; Agnihotri, Sandeep

    2008-09-01

    The objective of this study is to understand the interactions of water with novel nanocarbons by implementing semiempirical models that were developed to interpret adsorption isotherms of water in common carbonaceous adsorbents. Water adsorption isotherms were gravimetrically determined on several single-walled carbon nanotube (SWNT) and activated carbon samples. Each isotherm was fitted to the Dubinin-Serpinsky (DS) equation, the Dubinin-Astakov equation, the cooperative multimolecular sorption theory, and the Do and Do equations. The applicability of these models was evaluated by high correlation coefficients and the significance of fitting parameters, especially those that delineate the concentration of hydrophilic functional groups, micropore volume, and the size of water clusters. Samples were also characterized by spectroscopic and adsorption techniques, and properties complementary to those quantified by the fitting parameters were extracted from the data collected. The comparison of fitting parameters with sample characterization results was used as the methodology for selecting the most informative and the best-fitting model. We conclude that the Do equation, as modified by Marban et al., is the most suitable semiempirical equation for predicting from experimental isotherms alone the size of molecular clusters that facilitate adsorption in SWNTs, deconvoluting the experimental isotherms into two subisotherms: adsorption onto hydrophilic groups and filling of micropores, and quantifying the concentration of hydrophilic functional groups, as well as determining the micropore volume explored by water. With the exception of the DS equation, the application of other water isotherm models to SWNTs is not computationally tractable. The findings from this research should aid studies of water adsorption in SWNTs by molecular simulation, which remains the most popular tool for understanding the microscopic behavior of water in nanocarbons.

  1. Ciprofloxacin adsorption on graphene and granular activated carbon: kinetics, isotherms, and effects of solution chemistry.

    PubMed

    Zhu, Xuan; Tsang, Daniel C W; Chen, Feng; Li, Shiyu; Yang, Xin

    2015-01-01

    Ciprofloxacin (CIP) is a commonly used antibiotic and widely detected in wastewaters and farmlands nowadays. This study evaluated the efficacy of next-generation adsorbent (graphene) and conventional adsorbent (granular activated carbon, GAC) for CIP removal. Batch experiments and characterization tests were conducted to investigate the adsorption kinetics, equilibrium isotherms, thermodynamic properties, and the influences of solution chemistry (pH, ionic strength, natural organic matter (NOM), and water sources). Compared to GAC, graphene showed significantly faster adsorption and reached equilibrium within 3 min, confirming the rapid access of CIP into the macroporous network of high surface area of graphene as revealed by the Brunner-Emmet-Teller measurements analysis. The kinetics was better described by a pseudo-second-order model, suggesting the importance of the initial CIP concentration related to surface site availability of graphene. The adsorption isotherm on graphene followed Langmuir model with a maximum adsorption capacity of 323 mg/g, which was higher than other reported carbonaceous adsorbents. The CIP adsorption was thermodynamically favourable on graphene and primarily occurred through π - π interaction, according to the FTIR spectroscopy. While the adsorption capacity of graphene decreased with increasing solution pH due to the speciation change of CIP, the adverse effects of ionic strength (0.01-0.5 mol L(-1)), presence of NOM (5 mg L⁻¹), and different water sources (river water or drinking water) were less significant on graphene than GAC. These results indicated that graphene can serve as an alternative adsorbent for CIP removal in commonly encountered field conditions, if proper separation and recovery is available in place.

  2. Kinetics of degradation and adsorption-desorption isotherms of thiobencarb and oxadiargyl in calcareous paddy fields.

    PubMed

    Mahmoudi, Mojtaba; Rahnemaie, Rasoul; Es-haghi, Ali; Malakouti, Mohammad J

    2013-05-01

    Herbicides are an important source of contamination in paddy fields. Monitoring their fate and chemical interactions is therefore imperative for sustaining the environment and human health. To meet this purpose, field experiments were conducted to investigate kinetics of thiobencarb and oxadiargyl dissipation in soil and water of two paddy fields. Their adsorption and desorption isotherms were also determined in the soil samples. Variation in concentration was monitored for 60d in soil solution phase and for 315d in soil solid phase. In soil solution, concentrations of both herbicides were rapidly reduced within 5d and reached steady state within 20-30d. Analysis of experimental data resolved a half-life ≈2-4d for both herbicides. In soil solid phase, adsorption reaction played a dominant role in the first 10d. Afterwards, degradation reactions regulated the process. Variation in concentration was minimized after about 150d for thiobencarb and 80d for oxadiargyl. The half-lives were calculated ≈50d for thiobencarb and ≈20d for oxadiargyl, indicating that association with soil particles protect them effectively against degradation reactions. Adsorption isotherms confirmed that both herbicides were strongly adsorbed on soil particles. Furthermore, desorption data indicated that after four successive desorption steps, less than 9% thiobencarb and 1% oxadiargyl were released. This denotes that electrolyte ions in solution cannot adequately compete with and replace adsorbed thiobencarb and oxadiargyl molecules. This would lead to a considerable hysteresis between adsorption and desorption isotherms as was observed experimentally. Overall, it was concluded that both herbicides are among non-persistent and immobile herbicides in the paddy soils.

  3. Characterizing Nitrogen adsorption and desorption isotherms in soils using multifractal analysis

    NASA Astrophysics Data System (ADS)

    Paz Ferreiro, Jorge; Miranda, José G. V.; Vidal Vázquez, Eva

    2010-05-01

    The specific surface area is an attribute known to characterize the soil ability to retain and transport nutrients and water. A number of studies have shown that specific surface area correlates cation exchange capacity, organic matter content, water retention, aggregate stability and clay swelling. In the past fractal theory has been widely used to study different gas adsorption isotherms like water vapour and nitrogen adsorption isotherms. More recently we have shown that nitrogen adsorption isotherms showed multifractal nature. In this work, both N2 adsorption and desorption isotherms measured in a Mollisol were examined as a probability measure using the multifractal formalism in order to determinate its possible multifractal behaviour. Soil samples were collected in two different series of an Argiudoll located in the north of Buenos Aires and in the south of Santa Fe provinces, Argentina. Two treatments of each soil series were sampled at three depths, without replication, resulting in six samples per soil series and a total of twelve samples analyzed. Multifractal analysis was performed using the box counting method. Both, the N2 adsorption and desorption isotherms exhibited a well defined scaling behaviour indicating a fully developed multifractal structure of each isotherm branch. The singularity spectra and Rényi dimension spectra obtained for adsorption and also for desorption isotherms had shapes similar to the spectra of multifractal measures and several parameters were extracted from these spectra. The capacity dimension, D0, for both N2 adsorption and desorption data sets were not significantly different from 1.00. However, nitrogen adsorption and desorption data showed significantly different values of entropy dimension, D1, and correlation dimension, D2. For instance, entropy dimension values extracted from multifractal spectra of adsorption isotherms were on average 0.578 and varied from 0.501 to 0.666. In contrast, the corresponding figures for

  4. Prediction of the competitive adsorption isotherms of 2-phenylethanol and 3-phenylpropanol by artificial neural networks.

    PubMed

    Wu, Xiuhong; Wang, Shaoyan; Zhang, Renzhuang; Gao, Zhiming

    2014-03-07

    Artificial neural networks (ANNs) were regarded as data-mapping networks with strong nonlinear fitting abilities. A 2-6-2 network was used to determine the competitive adsorption isotherm of 2-phenylethanol (PE) and 3-phenylpropanol (PP). The ANN results were forms of data mapping rather than theoretical mathematical model. The ANN architecture was established after training with a set of experimental data. The established ANN was applied to predict the adsorption isotherms of PE and PP. The selection of parameters for the ANN was discussed. The results indicate that ANN has excellent potential for use in non-linear chromatography for the prediction of adsorption isotherms.

  5. Colloidal stability dependence on polymer adsorption through disjoining pressure isotherms.

    PubMed

    Goicochea, A Gama; Nahmad-Achar, E; Pérez, E

    2009-04-09

    The disjoining pressure of polymers confined by colloidal walls was computed using dissipative particle dynamics simulations at constant chemical potential, volume, and temperature. The polymers are able to adsorb on the surfaces according to two models. In the so-called surface-modifying polymers, all monomers composing the chains have the same affinity for the substrate, whereas for the end-grafted polymer only the monomer at one of the ends of the polymer molecule adsorbs on the colloidal surface, resembling the behavior of dispersing agents. We find that these adsorption models yield markedly different disjoining pressure isotherms, which in turn predict different stability conditions for the colloidal dispersion. Our results show that for end-grafted polymers, a larger degree of polymerization at the same monomer concentration leads to better stability than for the surface-modifying ones. But also the unbound monomers of the surface-modifying type dominate over both kinds of polymers at large surface distances. The origin of these differences when the chemical nature of monomers is the same, and molecular weight and polymer concentration are used to characterize colloidal stability, is found to be mainly entropic.

  6. Adsorption of humic acid from aqueous solutions on crosslinked chitosan-epichlorohydrin beads: kinetics and isotherm studies.

    PubMed

    Wan Ngah, W S; Hanafiah, M A K M; Yong, S S

    2008-08-01

    The adsorption of humic acid on crosslinked chitosan-epichlorohydrin (chitosan-ECH) beads was investigated. Chitosan-ECH beads were characterized by Fourier transform infrared spectroscopy (FTIR), surface area and pore size analyses, and scanning electron microscopy (SEM). Batch adsorption experiments were carried out and optimum humic acid adsorption on chitosan-ECH beads occurred at pH 6.0, agitation rate of 300 rpm and contact time of 50 min. Adsorption equilibrium isotherms were analyzed by Langmuir and Freundlich models. Freundlich model was found to show the best fit for experimental data while the maximum adsorption capacity determined from Langmuir model was 44.84 mg g(-1). The adsorption of humic acid on chitosan-ECH beads was best described with pseudo-first-order kinetic model. For desorption study, more than 60% of humic acid could be desorbed from the adsorbent using 1.0M HCl for 180 min.

  7. Ab Initio Prediction of Adsorption Isotherms for Small Molecules in Metal-Organic Frameworks.

    PubMed

    Kundu, Arpan; Piccini, GiovanniMaria; Sillar, Kaido; Sauer, Joachim

    2016-10-17

    For CO and N2 on Mg(2+) sites of the metal-organic framework CPO-27-Mg (Mg-MOF-74), ab initio calculations of Gibbs free energies of adsorption have been performed. Combined with the Bragg-Williams/Langmuir model and taking into account the experimental site availability (76.5%), we obtained adsorption isotherms in close agreement with those in experiment. The remaining deviations in the Gibbs free energy (about 1 kJ/mol) are significantly smaller than the "chemical accuracy" limit of about 4 kJ/mol. The presented approach uses (i) a DFT dispersion method (PBE+D2) to optimize the structure and to calculate anharmonic frequencies for vibrational partition functions and (ii) a "hybrid MP2:(PBE+D2)+ΔCCSD(T)" method to determine electronic energies. With the achieved accuracy (estimated uncertainty ±1.4 kJ/mol), the ab initio energies become useful benchmarks for assessing different DFT + dispersion methods (PBE+D2, B3LYP+D*, and vdW-D2), whereas the ab initio heats, entropies, and Gibbs free energies of adsorption are used to assess the reliability of experimental values derived from fitting isotherms or from variable-temperature IR studies.

  8. Cadmium-109 Radioisotope Adsorption onto Polypyrrole Coated Sawdust of Dryobalanops aromatic: Kinetics and Adsorption Isotherms Modelling

    PubMed Central

    Olatunji, Michael Adekunle; Khandaker, Mayeen Uddin; Amin, Yusoff Mohd; Mahmud, Habibun Nabi Muhammad Ekramul

    2016-01-01

    A radiotracer study was conducted to investigate the removal characteristics of cadmium (109Cd) from aqueous solution by polypyrrole/ sawdust composite. Several factors such as solution pH, sorbent dosage, initial concentration, contact time, temperature and interfering metal ions were found to have influence on the adsorption process. The kinetics of adsorption was relatively fast, reaching equilibrium within 3 hours. A lowering of the solution pH reduced the removal efficiency from 99.3 to ~ 46.7% and an ambient temperature of 25°C was found to be optimum for maximum adsorption. The presence of sodium and potassium ions inhibited 109Cd removal from its aqueous solution. The experimental data for 109Cd adsorption showed a very good agreement with the Langmuir isotherm and a pseudo-first order kinetic model. The surface condition of the adsorbent before and after cadmium loading was investigated using BET, FESEM and FTIR. Considering the low cost of the precursor’s materials and the toxicity of 109Cd radioactive metal, polypyrrole synthesized on the sawdust of Dryobalanops aromatic could be used as an efficient adsorbent for the removal of 109Cd radioisotope from radionuclide-containing effluents. PMID:27706232

  9. Cadmium-109 Radioisotope Adsorption onto Polypyrrole Coated Sawdust of Dryobalanops aromatic: Kinetics and Adsorption Isotherms Modelling.

    PubMed

    Olatunji, Michael Adekunle; Khandaker, Mayeen Uddin; Amin, Yusoff Mohd; Mahmud, Habibun Nabi Muhammad Ekramul

    2016-01-01

    A radiotracer study was conducted to investigate the removal characteristics of cadmium (109Cd) from aqueous solution by polypyrrole/ sawdust composite. Several factors such as solution pH, sorbent dosage, initial concentration, contact time, temperature and interfering metal ions were found to have influence on the adsorption process. The kinetics of adsorption was relatively fast, reaching equilibrium within 3 hours. A lowering of the solution pH reduced the removal efficiency from 99.3 to ~ 46.7% and an ambient temperature of 25°C was found to be optimum for maximum adsorption. The presence of sodium and potassium ions inhibited 109Cd removal from its aqueous solution. The experimental data for 109Cd adsorption showed a very good agreement with the Langmuir isotherm and a pseudo-first order kinetic model. The surface condition of the adsorbent before and after cadmium loading was investigated using BET, FESEM and FTIR. Considering the low cost of the precursor's materials and the toxicity of 109Cd radioactive metal, polypyrrole synthesized on the sawdust of Dryobalanops aromatic could be used as an efficient adsorbent for the removal of 109Cd radioisotope from radionuclide-containing effluents.

  10. Expanding the elution by characteristic point method for determination of various types of adsorption isotherms.

    PubMed

    Samuelsson, Jörgen; Undin, Torgny; Fornstedt, Torgny

    2011-06-17

    Important improvements have recently been made on the elution by characteristic point (ECP) method to increase the accuracy of the determined adsorption isotherms. However, the method has so far been limited/used for only type I adsorption isotherms (e.g. Langmuir, Tóth, bi-Langmuir). In this study, general strategies are developed to expand the ECP method for the determination of more complex adsorption isotherms including such containing inflection points. We will exemplify the methodology with type II, type III and type V isotherms. Guidelines are given for how to determine such isotherms using the ECP method and for the experimental considerations that must be taken into account or that may be eliminated in the particular case.

  11. Isotherms for Water Adsorption on Molecular Sieve 3A: Influence of Cation Composition

    SciTech Connect

    Lin, Ronghong; Ladshaw, Austin; Nan, Yue; Liu, Jiuxu; Yiacoumi, Sotira; Tsouris, Costas; DePaoli, David W.; Tavlarides, Lawrence L.

    2015-06-16

    This study is part of our continuing efforts to address engineering issues related to the removal of tritiated water from off-gases produced in used nuclear fuel reprocessing facilities. In the current study, adsorption equilibrium of water on molecular sieve 3A beads was investigated. Adsorption isotherms for water on the UOP molecular sieve 3A were measured by a continuous-flow adsorption system at 298, 313, 333, and 353 K. Experimental data collected were analyzed by the Generalized Statistical Thermodynamic Adsorption (GSTA) isotherm model. The K+/Na+ molar ratio of this particular type of molecular sieve 3A was ~4:6. Our results showed that the GSTA isotherm model worked very well to describe the equilibrium behavior of water adsorption on molecular sieve 3A. The optimum number of parameters for the current experimental data was determined to be a set of four equilibrium parameters. This result suggests that the adsorbent crystals contain four energetically distinct adsorption sites. In addition, it was found that water adsorption on molecular sieve 3A follows a three-stage adsorption process. This three-stage adsorption process confirmed different water adsorption sites in molecular sieve crystals. In addition, the second adsorption stage is significantly affected by the K+/Na+ molar ratio. In this stage, the equilibrium adsorption capacity at a given water vapor pressure increases as the K+/Na+ molar ratio increases.

  12. Isotherms for Water Adsorption on Molecular Sieve 3A: Influence of Cation Composition

    DOE PAGES

    Lin, Ronghong; Ladshaw, Austin; Nan, Yue; ...

    2015-06-16

    This study is part of our continuing efforts to address engineering issues related to the removal of tritiated water from off-gases produced in used nuclear fuel reprocessing facilities. In the current study, adsorption equilibrium of water on molecular sieve 3A beads was investigated. Adsorption isotherms for water on the UOP molecular sieve 3A were measured by a continuous-flow adsorption system at 298, 313, 333, and 353 K. Experimental data collected were analyzed by the Generalized Statistical Thermodynamic Adsorption (GSTA) isotherm model. The K+/Na+ molar ratio of this particular type of molecular sieve 3A was ~4:6. Our results showed that themore » GSTA isotherm model worked very well to describe the equilibrium behavior of water adsorption on molecular sieve 3A. The optimum number of parameters for the current experimental data was determined to be a set of four equilibrium parameters. This result suggests that the adsorbent crystals contain four energetically distinct adsorption sites. In addition, it was found that water adsorption on molecular sieve 3A follows a three-stage adsorption process. This three-stage adsorption process confirmed different water adsorption sites in molecular sieve crystals. In addition, the second adsorption stage is significantly affected by the K+/Na+ molar ratio. In this stage, the equilibrium adsorption capacity at a given water vapor pressure increases as the K+/Na+ molar ratio increases.« less

  13. Application of zeolite-activated carbon macrocomposite for the adsorption of Acid Orange 7: isotherm, kinetic and thermodynamic studies.

    PubMed

    Lim, Chi Kim; Bay, Hui Han; Neoh, Chin Hong; Aris, Azmi; Abdul Majid, Zaiton; Ibrahim, Zaharah

    2013-10-01

    In this study, the adsorption behavior of azo dye Acid Orange 7 (AO7) from aqueous solution onto macrocomposite (MC) was investigated under various experimental conditions. The adsorbent, MC, which consists of a mixture of zeolite and activated carbon, was found to be effective in removing AO7. The MC were characterized by scanning electron microscopy (SEM), energy dispersive X-ray, point of zero charge, and Brunauer-Emmett-Teller surface area analysis. A series of experiments were performed via batch adsorption technique to examine the effect of the process variables, namely, contact time, initial dye concentration, and solution pH. The dye equilibrium adsorption was investigated, and the equilibrium data were fitted to Langmuir, Freundlich, and Tempkin isotherm models. The Langmuir isotherm model fits the equilibrium data better than the Freundlich isotherm model. For the kinetic study, pseudo-first-order, pseudo-second-order, and intraparticle diffusion model were used to fit the experimental data. The adsorption kinetic was found to be well described by the pseudo-second-order model. Thermodynamic analysis indicated that the adsorption process is a spontaneous and endothermic process. The SEM, Fourier transform infrared spectroscopy, ultraviolet-visible spectral and high performance liquid chromatography analysis were carried out before and after the adsorption process. For the phytotoxicity test, treated AO7 was found to be less toxic. Thus, the study indicated that MC has good potential use as an adsorbent for the removal of azo dye from aqueous solution.

  14. A Sixth-Form Teaching Unit on the Langmuir Adsorption Isotherm

    ERIC Educational Resources Information Center

    Walkley, G. H.

    1973-01-01

    Presents a teaching unit on the Langmuir absorption isotherm suitable for advanced secondary school chemistry classes. Describes the experimental investigation of the isothermal adsorption of sulfur dioxide on charcoal, and discusses the derivation of the Langmuir equation and some applications. (JR)

  15. Low-cost magnetic adsorbent for As(III) removal from water: adsorption kinetics and isotherms.

    PubMed

    Kango, Sarita; Kumar, Rajesh

    2016-01-01

    Magnetite nanoparticles as adsorbent for arsenic (As) were coated on sand particles. The coated sand was used for the removal of highly toxic element 'As(III)' from drinking water. Here, batch experiments were performed with the variation of solution pH, adsorbent dose, contact time and initial arsenic concentration. The adsorbent showed significant removal efficiency around 99.6 % for As(III). Analysis of adsorption kinetics revealed that the adsorbent follows pseudo-second-order kinetics model showing R (2) = 0.999, whereas for pseudo-first-order kinetics model, the value of R (2) was 0.978. In the case of adsorption equilibrium, the data is well fitted with Langmuir adsorption isotherm model (R (2) > 0.99), indicating monolayer adsorption of As(III) on the surface of adsorbent. The existence of commonly present ions in water influences the removal efficiency of As(III) minutely in the following order PO4 (3-) > HCO3 (-) > Cl(-) > SO4 (2-). The obtained adsorbent can be used to overcome the problem of water filtration in rural areas. Moreover, as the nano-magnetite is coated on the sand, it avoids the problem of extraction of nanoparticles from treated water and can easily be removed by a simple filtration process.

  16. Kafirin adsorption on ion-exchange resins: isotherm and kinetic studies.

    PubMed

    Kumar, Prashant; Lau, Pei Wen; Kale, Sandeep; Johnson, Stuart; Pareek, Vishnu; Utikar, Ranjeet; Lali, Arvind

    2014-08-22

    Kafirin is a natural, hydrophobic and celiac safe prolamin protein obtained from sorghum seeds. Today kafirin is found to be useful in designing delayed delivery systems and coatings of pharmaceuticals and nutraceuticals where its purity is important and this can be obtained by adsorptive chromatography. This study is the first scientific insight into the isotherm and kinetic studies of kafirin adsorption on anion- and cation-exchange resins for practical applications in preparative scale chromatography. Adsorption isotherms of kafirin were determined for five anion- and two cation-exchange resins in batch systems. Isotherm parameters such as maximum binding capacity and dissociation constant were determined from Langmuir isotherm, and adsorptive capacity and affinity constant from Freundlich isotherm. Langmuir isotherm was found to fit the adsorption equilibrium data well. Batch uptake kinetics for kafirin adsorption on these resins was also carried out and critical parameters including the diffusion coefficient, film mass transfer coefficient, and Biot number for film-pore diffusion model were calculated. Both the isotherm and the kinetic parameters were considered for selection of appropriate resin for kafirin purification. UNOsphere Q (78.26 mg/ml) and Toyopearl SP-650M (57.4 mg/ml) were found to offer better kafirin binding capacities and interaction strength with excellent uptake kinetics under moderate operating conditions. With these adsorbents, film diffusion resistance was found to be major governing factor for adsorption (Bi<10 and δ<1). Based on designer objective function, UNOsphere Q was found be best adsorbent for binding of kafirin. The data presented is valuable for designing large scale preparative adsorptive chromatographic kafirin purification systems.

  17. Isotherms for adsorption of cellobiohydrolase I and II from Trichoderma reesei on microcrystalline cellulose

    SciTech Connect

    Medve, J.; Tjerneld, F.; Stahlberg, J.

    1997-04-01

    Adsorption to microcrystalline cellulose (Avicel) of pure cellobiohydrolase I and II (CBH I and CBH II) from Trichoderma reesei has been studied. Adsorption isotherms of the enzymes were measured at 4{degree}C using CBH I and CBH II alone and in reconstituted equimolar mixtures. Several models (Langmuir, Freundlich, Temkin, Jovanovic) were tested to describe the experimental adsorption isotherms. The isotherms did not follow the basic (one site) Langmuir equation that has often been used to describe adsorption isotherms of cellulases; correlation coefficients (R{sup 2}) were only 0.926 and 0.947, for CBH I and II, respectively. The experimental isotherms were best described by a model of Langmuir type with two adsorption sites and by a combined Langmuir-Freundlich model (analogous to the Hill equation); using these models the correlation coefficients were in most cases higher than 0.995. Apparent binding parameters derived from the two sites Langmuir model indicated stronger binding of CBH II compared to CBH I; the distribution coefficients were 20.7 and 3.7 L/g for the two enzymes, respectively. The binding capacity was higher for CBH I than for CBH II. The isotherms when analyzed with the combined model indicated presence of unequal binding sites on cellulose and/or negative cooperativity in the binding of the enzyme molecules. 39 refs., 3 figs., 3 tabs.

  18. A new approach in regression analysis for modeling adsorption isotherms.

    PubMed

    Marković, Dana D; Lekić, Branislava M; Rajaković-Ognjanović, Vladana N; Onjia, Antonije E; Rajaković, Ljubinka V

    2014-01-01

    Numerous regression approaches to isotherm parameters estimation appear in the literature. The real insight into the proper modeling pattern can be achieved only by testing methods on a very big number of cases. Experimentally, it cannot be done in a reasonable time, so the Monte Carlo simulation method was applied. The objective of this paper is to introduce and compare numerical approaches that involve different levels of knowledge about the noise structure of the analytical method used for initial and equilibrium concentration determination. Six levels of homoscedastic noise and five types of heteroscedastic noise precision models were considered. Performance of the methods was statistically evaluated based on median percentage error and mean absolute relative error in parameter estimates. The present study showed a clear distinction between two cases. When equilibrium experiments are performed only once, for the homoscedastic case, the winning error function is ordinary least squares, while for the case of heteroscedastic noise the use of orthogonal distance regression or Margart's percent standard deviation is suggested. It was found that in case when experiments are repeated three times the simple method of weighted least squares performed as well as more complicated orthogonal distance regression method.

  19. A New Approach in Regression Analysis for Modeling Adsorption Isotherms

    PubMed Central

    Onjia, Antonije E.

    2014-01-01

    Numerous regression approaches to isotherm parameters estimation appear in the literature. The real insight into the proper modeling pattern can be achieved only by testing methods on a very big number of cases. Experimentally, it cannot be done in a reasonable time, so the Monte Carlo simulation method was applied. The objective of this paper is to introduce and compare numerical approaches that involve different levels of knowledge about the noise structure of the analytical method used for initial and equilibrium concentration determination. Six levels of homoscedastic noise and five types of heteroscedastic noise precision models were considered. Performance of the methods was statistically evaluated based on median percentage error and mean absolute relative error in parameter estimates. The present study showed a clear distinction between two cases. When equilibrium experiments are performed only once, for the homoscedastic case, the winning error function is ordinary least squares, while for the case of heteroscedastic noise the use of orthogonal distance regression or Margart's percent standard deviation is suggested. It was found that in case when experiments are repeated three times the simple method of weighted least squares performed as well as more complicated orthogonal distance regression method. PMID:24672394

  20. Isothermal Dendritic Growth Experiment - SCN Dendrites

    NASA Technical Reports Server (NTRS)

    1995-01-01

    The Isothermal Dendritic Growth Experiment (IDGE), flown on three Space Shuttle missions, is yielding new insights into virtually all industrially relevant metal and alloy forming operations. IDGE used transparent organic liquids that form dendrites (treelike structures) similar to the crystals that form inside metal alloys. Comparing Earth-based and space-based dentrite growth velocity, tip size and shape provid a better understanding of the fundamentals of dentritic growth, including gravity's effects. These shadowgraphic images show succinonitrile (SCN) dentrites growing in a melt (liquid). The space-grown crystals also have cleaner, better defined sidebranches. IDGE was developed by Rensselaer Polytechnic Institude (RPI) and NASA/ Glenn Research Center(GRC). Advanced follow-on experiments are being developed for flight on the International Space Station. Photo gredit: NASA/Glenn Research Center

  1. On an isotherm thermodynamically consistent in Henry's region for describing gas adsorption in microporous materials.

    PubMed

    Pera-Titus, Marc

    2010-05-15

    The Dubinin-Astakhov and Dubinin-Radushkevich isotherms, originally formulated from the classical volume filling theory of micropores, constitute the most accepted models for describing gas adsorption in microporous materials. The most important weakness of these equations relies on the fact that they do not reduce to Henry's law at low pressures, not providing therefore a proper characterization of adsorbents in the early stage of adsorption. In this paper, we propose a way out of this inherent problem using the thermodynamic isotherm developed in a previous study [J. Llorens, M. Pera-Titus, J. Colloid Interface Sci. 331 (2009) 302]. This isotherm allows the generation of a series of equations that make available a comprehensive description of gas adsorption for the whole set of relative pressures (including Henry's region), also providing explicit information about energy heterogeneity of the adsorbent through the two characteristic m parameters of the thermodynamic isotherm (i.e., m(1) and m(2)). The obtained isotherm converges into the Dubinin-Astakhov isotherm for relative pressures higher than 0.1, the characteristic α parameter of this isotherm being expressed as α=m(2)-1 and the affinity coefficient (β) as a sole function of m(2). An expression differing from the Dubinin-Astakhov isotherm has been obtained for describing Henry's region, providing relevant information about confinement effects when applied to zeolites.

  2. Study and numerical solution of a generalized mathematical model of isothermal adsorption

    SciTech Connect

    Komissarov, Yu.A.; Vetokhin, V.N.; Tsenev, V.A.; Gordeeva, E.L.

    1995-06-01

    A generalized mathematical model of isothermal adsorption that takes into account mass transfer on the surface of a particle, diffusion in micro- and macropores, and dispersion along the length of the apparatus is considered The parameters {lambda} and {var_phi}{sup 2} determine the dominating effect of any of the mass transfer mechanisms of the adsorption process. A numerical algorithm for solving the generalized adsorption model is suggested.

  3. Adsorption of emulsified oil from metalworking fluid on activated bleaching earth-chitosan-SDS composites: Optimization, kinetics, isotherms.

    PubMed

    Naowanat, Nitiya; Thouchprasitchai, Nutthavich; Pongstabodee, Sangobtip

    2016-03-15

    The adsorption of emulsified oil from metalworking fluid (MWF) on activated bleaching earth (BE)-chitosan-sodium dodecyl sulfate (SDS) composites (BE/MCS) was investigated under a statistical design of experiments at a 95% confidence interval to identify the critical factors and to optimize the adsorption capacity. The BE/MCS adsorbents were characterized by means of X-ray diffraction, Fourier transform infrared spectroscopy, Brunauer-Emmett-Teller adsorption/desorption isotherms, contact angle analysis (sessile drop technique) and their zeta potential. From the results of a full 2(5) factorial design with three center points, the adsorbent weight and initial pH of the MWF had a significant antagonistic effect on the adsorption capacity while the initial MWF concentration and BE:chitosan:SDS weight ratio had a synergistic influence. Temperature factor has no discernible effect on the capacity. From the FCCC-RSM design, the optimal capacity range of 2840-2922.5 mg g(-1) was achieved at sorbent weight of 1.6-1.9 g, pH of 5.5-6.5, initial MWF concentration of 52-55 g l(-1) and BE:chitosan:SDS (w/w/w) ratio of 4.7:1:1-6.2:1:1. To test the validation and sensitivity of RSM model, the results showed that the estimated adsorption capacity was close to the experimental capacity within an error range of ±3%, suggesting that the RSM model was acceptable and satisfied. From three kinetics models (pseudo-first-order, pseudo-second-order model and Avrami's equation) and two adsorption isotherms (Langmuir model and Freundlich model), assessed using an error function (Err) and the coefficient of determination (R(2)), Avrami's equation and Freundlich isotherm model provided a good fitting for the data, suggesting the presence of more than one reaction pathway in the MWF adsorption process and the heterogeneous surface adsorption of the BC/ABE-5.5 composite.

  4. Water adsorption-desorption isotherms of two-dimensional hexagonal mesoporous silica around freezing point.

    PubMed

    Endo, Akira; Yamaura, Toshio; Yamashita, Kyohei; Matsuoka, Fumio; Hihara, Eiji; Daiguji, Hirofumi

    2012-02-01

    Zr-doped mesoporous silica with a diameter of approximately 3.8 nm was synthesized via an evaporation-induced self-assembly process, and the adsorption-desorption isotherms of water vapor were measured in the temperature range of 263-298 K. The measured adsorption-desorption isotherms below 273 K indicated that water confined in the mesopores did not freeze at any relative pressure. All isotherms had a steep curve, resulting from capillary condensation/evaporation, and a pronounced hysteresis. The hysteresis loop, which is associated with a delayed adsorption process, increased with a decrease in temperature. Furthermore, the curvature radius where capillary evaporation/condensation occurs was evaluated by the combined Kelvin and Gibbs-Tolman-Koening-Buff (GTKB) equations for the modification of the interfacial tension due to the interfacial curvature. The thickness of the water adsorption layer for capillary condensation was slightly larger, whereas that for capillary evaporation was slightly smaller than 0.7 nm.

  5. Single and binary adsorption of proteins on ion-exchange adsorbent: The effectiveness of isothermal models.

    PubMed

    Liang, Juan; Fieg, Georg; Shi, Qing-Hong; Sun, Yan

    2012-09-01

    Simultaneous and sequential adsorption equilibria of single and binary adsorption of bovine serum albumin and bovine hemoglobin on Q Sepharose FF were investigated in different buffer constituents and initial conditions. The results in simultaneous adsorption showed that both proteins underwent competitive adsorption onto the adsorbent following greatly by protein-surface interaction. Preferentially adsorbed albumin complied with the universal rule of ion-exchange adsorption whereas buffer had no marked influence on hemoglobin adsorption. Moreover, an increase in initial ratios of proteins was benefit to a growth of adsorption density. In sequential adsorption, hemoglobin had the same adsorption densities as single-component adsorption. It was attributed to the displacement of preadsorbed albumin and multiple layer adsorption of hemoglobin. Three isothermal models (i.e. extended Langmuir, steric mass-action, and statistical thermodynamic (ST) models) were introduced to describe the ion-exchange adsorption of albumin and hemoglobin mixtures. The results suggested that extended Langmuir model gave the lowest deviation in describing preferential adsorption of albumin at a given salt concentration while steric mass-action model could very well describe the salt effect in albumin adsorption. For weaker adsorbed hemoglobin, ST model was the preferred choice. In concert with breakthrough data, the research further revealed the complexity in ion-exchange adsorption of proteins.

  6. Predicting heavy metals' adsorption edges and adsorption isotherms on MnO2 with the parameters determined from Langmuir kinetics.

    PubMed

    Hu, Qinghai; Xiao, Zhongjin; Xiong, Xinmei; Zhou, Gongming; Guan, Xiaohong

    2015-01-01

    Although surface complexation models have been widely used to describe the adsorption of heavy metals, few studies have verified the feasibility of modeling the adsorption kinetics, edge, and isotherm data with one pH-independent parameter. A close inspection of the derivation process of Langmuir isotherm revealed that the equilibrium constant derived from the Langmuir kinetic model, KS-kinetic, is theoretically equivalent to the adsorption constant in Langmuir isotherm, KS-Langmuir. The modified Langmuir kinetic model (MLK model) and modified Langmuir isotherm model (MLI model) incorporating pH factor were developed. The MLK model was employed to simulate the adsorption kinetics of Cu(II), Co(II), Cd(II), Zn(II) and Ni(II) on MnO2 at pH3.2 or 3.3 to get the values of KS-kinetic. The adsorption edges of heavy metals could be modeled with the modified metal partitioning model (MMP model), and the values of KS-Langmuir were obtained. The values of KS-kinetic and KS-Langmuir are very close to each other, validating that the constants obtained by these two methods are basically the same. The MMP model with KS-kinetic constants could predict the adsorption edges of heavy metals on MnO2 very well at different adsorbent/adsorbate concentrations. Moreover, the adsorption isotherms of heavy metals on MnO2 at various pH levels could be predicted reasonably well by the MLI model with the KS-kinetic constants.

  7. Linear isotherm determination from linear gradient elution experiments.

    PubMed

    Pfister, David; Steinebach, Fabian; Morbidelli, Massimo

    2015-01-02

    A procedure to estimate equilibrium adsorption parameters as a function of the modifier concentration in linear gradient elution chromatography is proposed and its reliability is investigated by comparison with experimental data. Over the past decades, analytical solutions of the so-called equilibrium model under linear gradient elution conditions were derived assuming that proteins and modifier molecules access the same fraction of the pore size distribution of the porous particles. The present approach developed in this work accounts for the size exclusion effect resulting in different exclusions for proteins and modifier. A new analytical solution was derived by applying perturbation theory for differential equations, and the 1st-order approximated solution is presented in this work. Eventually, a turnkey and reliable procedure to efficiently estimate isotherm parameters as a function of modifier concentration from linear gradient elution experiments is proposed.

  8. Adsorption of arsenite and arsenate onto ferrihydrite under competitive conditions : kinetics, isotherm, and pH effect

    NASA Astrophysics Data System (ADS)

    Qi, P.; Pichler, T.

    2014-12-01

    Competitive adsorption of As(III) and As(V) onto ferrihydrite was investigated in both single and bi-component systems using batch experiments. The adsorption of As(III) was inhibited by the presence of As(V) over the whole pH range when compared to As(III) only conditions. As(V) was adsorbed to a similar extent with As(III) at low pH under competitive conditions. Isotherm studies also showed that As(V) significantly decreased the adsorption of As(III) at pH 5, while the presence of As(III) had a small effect on As(V) adsorption. The Freundlich isotherm equation was successfully fitted to both single and bi-component adsorption scenarios of As(III) and As(V). At the same time intervals in the first 2 h under competitive conditions, kinetics studies suggested that the amount of As(III) adsorbed in the presence of As(V) was reduced compared to the single component system at low pH. The effect of As(III) on the adsorption rate of As(V) was negligible. A pseudo-second-order model could be fitted perfectly to each species under both single and competitive conditions. The spectra of ferrihydrite with adsorbed As(III), As(V) or both As species have a similar shape by ATR-FTIR, indicating that competition may be at play.

  9. Equilibrium isotherms, kinetics, and thermodynamics studies for congo red adsorption using calcium alginate beads impregnated with nano-goethite.

    PubMed

    Munagapati, Venkata Subbaiah; Kim, Dong-Su

    2017-03-24

    The present study is concerned with the batch adsorption of congo red (CR) from an aqueous solution using calcium alginate beads impregnated with nano-goethite (CABI nano-goethite) as an adsorbent. The optimum conditions for CR removal were determined by studying operational variables viz. pH, adsorbent dose, contact time, initial dye ion concentration and temperature. The CABI nano-goethite was characterized by Fourier transform infrared spectroscopy (FTIR), X- ray diffraction (XRD) and Scanning electron microscopy/energy dispersive spectroscopy (SEM/EDS) analysis. The CR sorption data onto CABI nano-goethite were described using Langmuir, Freundlich, Dubinin-Radushkevich and Temkin isotherm models. The results show that the best fit was achieved with the Langmuir isotherm model. The maximum adsorption capacity (181.1mg/g) of CR was occurred at pH 3.0. Kinetic studies showed that the adsorption followed a pseudo-second-order model. Desorption experiments were carried out to explore the feasibility of regenerating the adsorbent and the adsorbed CR from CABI nano-goethite. The best desorbing agent was 0.1M NaOH with an efficiency of 94% recovery. The thermodynamic parameters ΔG°, ΔH°, and ΔS° for the CR adsorption were determined by using adsorption capacities at five different temperatures (293, 303, 313, 323 and 303K). Results show that the adsorption process was endothermic and favoured at high temperature.

  10. Verification of selected relationships for fractally porous solids by using adsorption isotherms calculated from density functional theory

    NASA Astrophysics Data System (ADS)

    Jaroniec, Mietek; Kruk, Michal; Olivier, James

    1995-11-01

    Methods of calculating the fractal dimension (D) on the basis of single adsorption isotherms were critically tested by using argon composite adsorption isotherms for fractally porous solids. These isotherms were obtained from adsorption data for homogeneous slit-like pores calculated by employing the density functional theory (DFT). The composite adsorption isotherms were used to test the validity of the method based on the Frenkel-Halsey-Hill equation and so called "thermodynamic method" proposed by Neimark. The applicability of these methods was confirmed. However, our studies reveal new aspects of practical usage of both approaches, which need to be taken into consideration in analysis of experimental data.

  11. Adsorption isotherm studies of Cu (II) and Co (II) in high concentration aqueous solutions on photocatalytically modified diatomaceous ceramic adsorbents

    NASA Astrophysics Data System (ADS)

    Ajenifuja, E.; Ajao, J. A.; Ajayi, E. O. B.

    2017-01-01

    Photocatalytically modified ceramic adsorbents were synthesized for the removal of high concentration Cu (II) and Co (II) ions from their aqueous solutions. The raw material, diatomaceous aluminosilicate mineral was modified using silver and anatase titanium oxide nanoparticles. Batch adsorption experiment was carried out on the targeted metal ions and the results were analyzed by the Langmuir and Freundlich equation at different concentrations (100-1000 mg/l) and the characteristic parameters for each adsorption isotherm were determined. As-received raw materials do not exhibit any sorption capacity for high concentration Cu2+ and Co2+ adsorbates. However, the adsorption isotherms for modified diatomaceous ceramic adsorbents could be fitted well by the Langmuir model for both Cu2+ and Co2+ with correlation coefficient (R) of up to 0.99953. The highest and lowest monolayer coverage (q max) were 121.803 and 31.289 mg/g for Cu2+ and Co2+, respectively. The separation factor (R L) in the experiment was less than one (<1), indicating that the adsorption of metal ions on the Ag-TiO2-modified ceramic adsorbent is favorable. The highest adsorption capacity (K f) and intensity (n) constants obtained from Freundlich model are 38.832 (Cu2+ on ZEO-T) and 5.801 (Co2+ on STOX-Z).

  12. Adsorption kinetics, isotherms and thermodynamics of atrazine on surface oxidized multiwalled carbon nanotubes.

    PubMed

    Chen, Guang-Cai; Shan, Xiao-Quan; Zhou, Yi-Quan; Shen, Xiu-e; Huang, Hong-Lin; Khan, Shahamat U

    2009-09-30

    The adsorption kinetics, isotherms and thermodynamic of atrazine on multiwalled carbon nanotubes (MWCNTs) containing 0.85%, 2.16%, and 7.07% oxygen was studied. Kinetic analyses were performed using pseudo-first-order, pseudo-second-order and intraparticle diffusion models. The regression results showed that the pseudo-second-order law fit the adsorption kinetics. The calculated thermodynamic parameters indicated that adsorption of atrazine on MWCNTs was spontaneous and exothermic. Standard free energy (DeltaG(0)) became less negative when the oxygen content of MWCNTs increased from 0.85% to 7.07% which is consistent with the low adsorption affinity of MWCNTs for atrazine.

  13. Adsorption of CO{sub 2} on activated carbon: Simultaneous determination of integral heat and isotherm of adsorption

    SciTech Connect

    Berlier, K.; Frere, M.

    1996-09-01

    Simultaneous measurements of isotherms and integral heats of adsorption of carbon dioxide (CO{sub 2}) at temperatures ranging from 278 K to 327 K (seven temperatures) and at pressures up to 110 kPa on activated carbon are presented.

  14. Characterization of CaF2 surfaces using Adsorption-Desorption Isotherms and Atomic Force Microscopy

    NASA Astrophysics Data System (ADS)

    Wadleigh, L. R.; Luhman, D. R.; Bumcrot, P. G.

    2012-02-01

    We are interested in using rough CaF2 films to study the superfluid transition in two-dimensional helium systems. These experiments require quantitative information regarding the topography of the CaF2 surfaces. The surface roughness of CaF2 films is known to increase with film thickness as has been shown with previous atomic force microscopy (AFM) measurements [1]. We have fabricated a series of CaF2 samples of different film thicknesses and thus different surface roughnesses. These surfaces were studied using AFM and adsorption-desorption isotherm measurements with liquid nitrogen at T=77 K. The isotherm measurements allow us to determine the pore size distribution of each CaF2 film thickness. We find the emergence of hysteretic capillary condensation due to deep pores in the CaF2 as the film thickness increases. The development of these deep pores is also seen in our AFM measurements. Our combined results provide a detailed description of CaF2 surface roughness which can be utilized in the planned superfluid experiment. [1] D.R. Luhman and R.B. Hallock, Phys Rev. E 70, 051606 (2004).

  15. Isothermal Dendritic Growth Experiment - PVA Dendrites

    NASA Technical Reports Server (NTRS)

    1997-01-01

    The Isothermal Dendritic Growth Experiment (IDGE), flown on three Space Shuttle missions, is yielding new insights into virtually all industrially relevant metal and alloy forming operations. IDGE used transparent organic liquids that form dendrites (treelike structures) similar to those inside metal alloys. Comparing Earth-based and space-based dendrite growth velocity, tip size and shape provides a better understanding of the fundamentals of dentritic growth, including gravity's effects. Shalowgraphic images of pivalic acid (PVA) dendrites forming from the melt show the subtle but distinct effects of gravity-driven heat convection on dentritic growth. In orbit, the dendrite grows as its latent heat is liberated by heat conduction. This yields a blunt dendrite tip. On Earth, heat is carried away by both conduction and gravity-driven convection. This yields a sharper dendrite tip. In addition, under terrestrial conditions, the sidebranches growing in the direction of gravity are augmented as gravity helps carry heat out of the way of the growing sidebranches as opposed to microgravity conditions where no augmentation takes place. IDGE was developed by Rensselaer Polytechnic Institute and NASA/Glenn Research Center. Advanced follow-on experiments are being developed for flight on the International Space Station. Photo Credit: NASA/Glenn Research Center

  16. New theoretical expressions for the five adsorption type isotherms classified by BET based on statistical physics treatment.

    PubMed

    Khalfaoui, M; Knani, S; Hachicha, M A; Lamine, A Ben

    2003-07-15

    New theoretical expressions to model the five adsorption isotherm types have been established. Using the grand canonical ensemble in statistical physics, we give an analytical expression to each of five physical adsorption isotherm types classified by Brunauer, Emett, and Teller, often called BET isotherms. The establishment of these expressions is based on statistical physics and theoretical considerations. This method allowed estimation of all the mathematical parameters in the models. The physicochemical parameters intervening in the adsorption process that the models present could be deduced directly from the experimental adsorption isotherms by numerical simulation. We determine the adequate model for each type of isotherm, which fixes by direct numerical simulation the monolayer, multilayer, or condensation character. New equations are discussed and results obtained are verified for experimental data from the literature. The new theoretical expressions that we have proposed, based on statistical physics treatment, are rather powerful to better understand and interpret the various five physical adsorption type isotherms at a microscopic level.

  17. 40 CFR 796.2750 - Sediment and soil adsorption isotherm.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... colloid interfaces can be incorporated into this test. The ease of performing the isotherm test and mass... section served as the basis for this section. The soil and colloid chemistry literature and the analytical... using a chemical and/or physical treatment that does not alter or minimally alters the colloid...

  18. 40 CFR 796.2750 - Sediment and soil adsorption isotherm.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... colloid interfaces can be incorporated into this test. The ease of performing the isotherm test and mass... section served as the basis for this section. The soil and colloid chemistry literature and the analytical... using a chemical and/or physical treatment that does not alter or minimally alters the colloid...

  19. 40 CFR 796.2750 - Sediment and soil adsorption isotherm.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... colloid interfaces can be incorporated into this test. The ease of performing the isotherm test and mass... section served as the basis for this section. The soil and colloid chemistry literature and the analytical... using a chemical and/or physical treatment that does not alter or minimally alters the colloid...

  20. 40 CFR 796.2750 - Sediment and soil adsorption isotherm.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... colloid interfaces can be incorporated into this test. The ease of performing the isotherm test and mass... section served as the basis for this section. The soil and colloid chemistry literature and the analytical... using a chemical and/or physical treatment that does not alter or minimally alters the colloid...

  1. 40 CFR 796.2750 - Sediment and soil adsorption isotherm.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... colloid interfaces can be incorporated into this test. The ease of performing the isotherm test and mass... section served as the basis for this section. The soil and colloid chemistry literature and the analytical... using a chemical and/or physical treatment that does not alter or minimally alters the colloid...

  2. Novel Silica-Based Hybrid Adsorbents: Lead(II) Adsorption Isotherms

    PubMed Central

    Wang, Xin

    2013-01-01

    Water pollution caused by the lead(II) from the spent liquor has caught much attention. The research from the theoretical model to application fundaments is of vital importance. In this study, lead(II) adsorption isotherms are investigated using a series of hybrid membranes containing mercapto groups (–SH groups) as the hybrid adsorbents. To determine the best fitting equation, the experimental data were analyzed using six two-parameter isotherm equations (i.e., Langmuir, Freundlich, Dubinin-Radushkevich (D-R), Temkin, Harkins-Jura, and Halsey isotherm models). It was found that the lead(II) adsorption on these samples followed the Freundlich, Dubinin-Radushkevich (D-R), and Halsey isotherm models. Moreover, the mean free energy of adsorption was calculated using Dubinin-Radushkevich (D-R) isotherm model and it was confirmed that the adsorption process was physical in nature. These findings are very meaningful in the removal of lead(II) ions from water using the hybrid membranes as adsorbents. PMID:24302877

  3. Novel silica-based hybrid adsorbents: lead(II) adsorption isotherms.

    PubMed

    Liu, Junsheng; Wang, Xin

    2013-01-01

    Water pollution caused by the lead(II) from the spent liquor has caught much attention. The research from the theoretical model to application fundaments is of vital importance. In this study, lead(II) adsorption isotherms are investigated using a series of hybrid membranes containing mercapto groups (-SH groups) as the hybrid adsorbents. To determine the best fitting equation, the experimental data were analyzed using six two-parameter isotherm equations (i.e., Langmuir, Freundlich, Dubinin-Radushkevich (D-R), Temkin, Harkins-Jura, and Halsey isotherm models). It was found that the lead(II) adsorption on these samples followed the Freundlich, Dubinin-Radushkevich (D-R), and Halsey isotherm models. Moreover, the mean free energy of adsorption was calculated using Dubinin-Radushkevich (D-R) isotherm model and it was confirmed that the adsorption process was physical in nature. These findings are very meaningful in the removal of lead(II) ions from water using the hybrid membranes as adsorbents.

  4. Rapid adsorption of copper(II) and lead(II) by rice straw/Fe₃O₄ nanocomposite: optimization, equilibrium isotherms, and adsorption kinetics study.

    PubMed

    Khandanlou, Roshanak; Ahmad, Mansor B; Fard Masoumi, Hamid Reza; Shameli, Kamyar; Basri, Mahiran; Kalantari, Katayoon

    2015-01-01

    Rice straw/magnetic nanocomposites (RS/Fe3O4-NCs) were prepared via co-precipitation method for removal of Pb(II) and Cu(II) from aqueous solutions. Response surface methodology (RSM) was utilized to find the optimum conditions for removal of ions. The effects of three independent variables including initial ion concentration, removal time, and adsorbent dosage were investigated on the maximum adsorption of Pb (II) and Cu (II). The optimum conditions for the adsorption of Pb(II) and Cu(II) were obtained (100 and 60 mg/L) of initial ion concentration, (41.96 and 59.35 s) of removal time and 0.13 g of adsorbent for both ions, respectively. The maximum removal efficiencies of Pb(II) and Cu(II) were obtained 96.25% and 75.54%, respectively. In the equilibrium isotherm study, the adsorption data fitted well with the Langmuir isotherm model. The adsorption kinetics was best depicted by the pseudo-second order model. Desorption experiments showed adsorbent can be reused successfully for three adsorption-desorption cycles.

  5. Rapid Adsorption of Copper(II) and Lead(II) by Rice Straw/Fe3O4 Nanocomposite: Optimization, Equilibrium Isotherms, and Adsorption Kinetics Study

    PubMed Central

    Khandanlou, Roshanak; Ahmad, Mansor B.; Fard Masoumi, Hamid Reza; Shameli, Kamyar; Basri, Mahiran; Kalantari, Katayoon

    2015-01-01

    Rice straw/magnetic nanocomposites (RS/Fe3O4-NCs) were prepared via co-precipitation method for removal of Pb(II) and Cu(II) from aqueous solutions. Response surface methodology (RSM) was utilized to find the optimum conditions for removal of ions. The effects of three independent variables including initial ion concentration, removal time, and adsorbent dosage were investigated on the maximum adsorption of Pb (II) and Cu (II). The optimum conditions for the adsorption of Pb(II) and Cu(II) were obtained (100 and 60 mg/L) of initial ion concentration, (41.96 and 59.35 s) of removal time and 0.13 g of adsorbent for both ions, respectively. The maximum removal efficiencies of Pb(II) and Cu(II) were obtained 96.25% and 75.54%, respectively. In the equilibrium isotherm study, the adsorption data fitted well with the Langmuir isotherm model. The adsorption kinetics was best depicted by the pseudo-second order model. Desorption experiments showed adsorbent can be reused successfully for three adsorption-desorption cycles. PMID:25815470

  6. Eriobotrya japonica seed biocomposite efficiency for copper adsorption: Isotherms, kinetics, thermodynamic and desorption studies.

    PubMed

    Mushtaq, Mehwish; Bhatti, Haq Nawaz; Iqbal, Munawar; Noreen, Saima

    2016-07-01

    Adsorption techniques are widely used to remove pollutants from wastewater; however, composites are gaining more importance due to their excellent adsorption properties. Bentonite composite with Eriobotrya japonica seed was prepared and used for the adsorption of copper (Cu) metal from aqueous media. The process variables such as pH, Cu(II) ions initial concentration, adsorbent dose, contact time and temperature were optimized for maximum Cu(II) adsorption. At pH 5, adsorbent dose 0.1 g, contact time 45 min, Cu(II) ions initial concentration 75 mg/L and temperature 45 °C, maximum Cu(II) adsorption was achieved. Desorption studies revealed that biocomposite is recyclable. Langmuir, Freundlich and Harkins-Jura isotherms as well as pseudo-first and pseudo-second-order kinetics models were applied to understand the adsorption mechanism. Thermodynamic parameters (ΔG(0), ΔH(0) and ΔS(0)) suggest that the adsorption process was spontaneous and endothermic in nature. The pseudo-second-order kinetic model and Langmuir isotherm fitted well to the adsorption data. Results showed that biocomposite was more efficient for Cu(II) adsorption in comparison to individuals native Eriobotrya japonica seed biomass and Na-bentonite.

  7. Adsorption Isotherms for Xenon and Krypton using INL HZ-PAN and AgZ-PAN Sorbents

    SciTech Connect

    Garn, Troy G.; Greenhalgh, Mitchell; Rutledge, Veronica J.; Law, Jack D.

    2014-08-01

    The generation of adsorption isotherms compliments the scale-up of off-gas processes used to control the emission of encapsulated radioactive volatile fission and activation products released during Used Nuclear Fuel (UNF) reprocessing activities. A series of experiments were conducted to obtain capacity results for varying Kr and Xe gas concentrations using HZ-PAN and AgZ-PAN engineered form sorbents. Gas compositions for Kr ranged from 150-40,000 ppmv and 250-5020 ppmv for Xe in a helium balance. The experiments were all performed at 220 K at a flowrate of 50 sccm. Acquired capacities were then respectively fit to the Langmuir equation using the Langmuir linear regression method to obtain the equilibrium parameters Qmax and Keq. Generated experimental adsorption isotherms were then plotted with the Langmuir predicted isotherms to illustrate agreement between the two. The Langmuir parameters were provided for input into the OSPREY model to predict breakthrough of single component adsorption of Kr and Xe on HZ-PAN and AgZ-PAN sorbents at the experimental conditions tested. Kr and Xe capacities resulting from model breakthrough predictions were then compared to experimental capacities for model validation.

  8. Adsorption kinetics and isotherm of anionic dyes onto organo-bentonite from single and multisolute systems.

    PubMed

    Shen, Dazhong; Fan, Jianxin; Zhou, Weizhi; Gao, Baoyu; Yue, Qinyan; Kang, Qi

    2009-12-15

    The performances of polydiallydimethylammonium modified bentonite (PDADMA-bentonite) as an adsorbent to remove anionic dyes, namely Acid Scarlet GR (AS-GR), Acid Turquoise Blue 2G (ATB-2G) and Indigo Carmine (IC), were investigated in single, binary and ternary dye systems. In adsorption from single dye solutions with initial concentration of 100 micromol/L, the dosage of PDADMA-bentonite needed to remove 95% dye was 0.42, 0.68 and 0.75 g/L for AS-GR, ATB-2G and IC, respectively. The adsorption isotherms of the three dyes obeyed the Langmuir isotherm model with the equilibrium constants of 0.372, 0.629 and 4.31 L/micromol, the saturation adsorption amount of 176.3, 149.2 and 228.7 micromol/g for ATB-2G, IC and AS-GR, respectively. In adsorption from mixed dye solutions, the isotherm of each individual dye followed an expanded Langmuir isotherm model and the relationship between the total amount of dyes adsorbed and the total equilibrium dye concentration was interpreted well by Langmuir isotherm model. In the region of insufficient dosage of PDADMA-bentonite, the dye with a larger affinity was preferentially removed by adsorption. Desorption was observed in the kinetic curve of the dye with lower affinity on PDADMA-bentonite surface by the competitive adsorption. The kinetics in single dye solution and the total adsorption of dyes in binary and ternary dye systems nicely followed pseudo-second-order kinetic model.

  9. The Isothermal Dendritic Growth Experiment (IDGE)

    NASA Technical Reports Server (NTRS)

    Glicksman, Martin E.; Koss, M. B.; Lupulescu, A. O.; LaCombe, J. C.; Frei, J. E.; Malarik, D. C.

    1999-01-01

    The Isothermal Dendritic Growth Experiment (IDGE) constituted a series of three NASA-supported microgravity experiments, all of which flew aboard the space shuttle, Columbia. This experimental space flight series was designed and operated to grow and record dendrite solidification in the absence of gravity-induced convective heat transfer, and thereby produce a wealth of benchmark-quality data for testing solidification scaling laws. The data and analysis performed on the dendritic growth speed and tip size in Succinontrie (SCN) demonstrates that although the theory yields predictions that are reasonably in agreement with experiment, there are significant discrepancies. However, some of these discrepancies can be explained by accurately describing the diffusion of heat. The key finding involves recognition that the actual three-dimensional shape of dendrites includes time-dependent side-branching and a tip region that is not a paraboloid of revolution. Thus, the role of heat transfer in dendritic growth is validated, with the caveat that a more realistic model of the dendrite then a paraboloid is needed to account for heat flow in an experimentally observed dendrite. We are currently conducting additional analysis to further confirm and demonstrate these conclusions. The data and analyses for the growth selection physics remain much less definitive. From the first flight, the data indicated that the selection parameter, sigma*, is not exactly a constant, but exhibits a slight dependence on the supercooling. Additional data from the second flight are being examined to investigate the selection of a unique dendrite speed, tip size and shape. The IDGE flight series is now complete. We are currently completing analyses and moving towards final data archiving. It is gratifying to see that the IDGE published results and archived data sets are being used actively by other scientists and engineers. In addition, we are also pleased to report that the techniques and IDGE

  10. Adsorption of pharmaceuticals onto activated carbon fiber cloths - Modeling and extrapolation of adsorption isotherms at very low concentrations.

    PubMed

    Fallou, Hélène; Cimetière, Nicolas; Giraudet, Sylvain; Wolbert, Dominique; Le Cloirec, Pierre

    2016-01-15

    Activated carbon fiber cloths (ACFC) have shown promising results when applied to water treatment, especially for removing organic micropollutants such as pharmaceutical compounds. Nevertheless, further investigations are required, especially considering trace concentrations, which are found in current water treatment. Until now, most studies have been carried out at relatively high concentrations (mg L(-1)), since the experimental and analytical methodologies are more difficult and more expensive when dealing with lower concentrations (ng L(-1)). Therefore, the objective of this study was to validate an extrapolation procedure from high to low concentrations, for four compounds (Carbamazepine, Diclofenac, Caffeine and Acetaminophen). For this purpose, the reliability of the usual adsorption isotherm models, when extrapolated from high (mg L(-1)) to low concentrations (ng L(-1)), was assessed as well as the influence of numerous error functions. Some isotherm models (Freundlich, Toth) and error functions (RSS, ARE) show weaknesses to be used as an adsorption isotherms at low concentrations. However, from these results, the pairing of the Langmuir-Freundlich isotherm model with Marquardt's percent standard of deviation was evidenced as the best combination model, enabling the extrapolation of adsorption capacities by orders of magnitude.

  11. Chromatographic and traditional albumin isotherms on cellulose: a model for wound protein adsorption on modified cotton.

    PubMed

    Edwards, J Vincent; Castro, Nathan J; Condon, Brian; Costable, Carmen; Goheen, Steven C

    2012-05-01

    Albumin is the most abundant protein found in healing wounds. Traditional and chromatographic protein isotherms of albumin binding on modified cotton fibers are useful in understanding albumin binding to cellulose wound dressings. An important consideration in the design of cellulosic wound dressings is adsorption and accumulation of proteins like albumin at the solid-liquid interface of the biological fluid and wound dressing fiber. To better understand the effect of fiber charge and molecular modifications in cellulose-containing fibers on the binding of serum albumin as observed in protease sequestrant dressings, albumin binding to modified cotton fibers was compared with traditional and chromatographic isotherms. Modified cotton including carboxymethylated, citrate-crosslinked, dialdehyde and phosphorylated cotton, which sequester elastase and collagenase, were compared for their albumin binding isotherms. Albumin isotherms on citrate-cellulose, cross-linked cotton demonstrated a two-fold increased binding affinity over untreated cotton. A comparison of albumin binding between traditional, solution isotherms and chromatographic isotherms on modified cellulose yielded similar equilibrium constants. Application of the binding affinity of albumin obtained in the in vitro protein isotherm to the in vivo wound dressing uptake of the protein is discussed. The chromatographic approach to assessment of albumin isotherms on modified cellulose offers a more rapid approach to evaluating protein binding on modified cellulose over traditional solution approaches.

  12. Evaluation of lead(II) immobilization by a vermicompost using adsorption isotherms and IR spectroscopy.

    PubMed

    Carrasquero-Durán, Armando; Flores, Iraima

    2009-02-01

    The immobilization of lead ions by a vermicompost with calcite added was evaluated by adsorption isotherms and the results were explained on basis of the pH dependent surface charge and by IR spectroscopy. The results showed maximum adsorption values between 113.6 mg g(-1) (33 degrees C) and 123.5mg g(-1) (50 degrees C). The point of zero net charge (PZC) was 7.5+/-0.1, indicating the presence of a positive surface charge at the pH of batch experiments. The differences in the IR spectra at pH 3.8 and 7.0 in the region from 1800 to 1300 cm(-1), were interpreted on the basis of the carboxyl acid ionization, that reduced the band intensity around 1725 cm(-1), producing signals at 1550 cm(-1) and 1390 cm(-1) of carboxylate groups. Similar changes were detected at pH 3.8 when Pb2+ was present suggesting that the ion complexation takes place by a cationic exchange equilibrium, between the protons and Pb2+ ions.

  13. Modeling of adsorption isotherms of phenol and chlorophenols onto granular activated carbon. Part II. Models with more than two parameters.

    PubMed

    Hamdaoui, Oualid; Naffrechoux, Emmanuel

    2007-08-17

    The adsorption equilibrium isotherms of five phenolic compounds, phenol, 2-chlorophenol, 4-chlorophenol, 2,4-dichlorophenol, and 2,4,6-trichlorophenol, from aqueous solutions onto granular activated carbon were studied and modeled. In order to determine the best-fit isotherm, the experimental equilibrium data were analyzed using thirteen adsorption isotherm models with more than two-parameter; nine three-parameter equations - the Redlich-Peterson, Sips, Langmuir-Freundlich, Fritz-Schlunder, Radke-Prasnitz (three models), Tóth, and Jossens isotherms - three four-parameter equation - the Weber-van Vliet, Fritz-Schlunder, and Baudu isotherms - and one five-parameter equation - the Fritz-Schlunder isotherm. The results reveal that the adsorption isotherm models fitted the experimental data in the order: Baudu (four-parameter)>Langmuir-Freundlich (three-parameter)>Sips (three-parameter)>Fritz-Schlunder (five-parameter)>Tóth (three-parameter)>Fritz-Schlunder (four-parameter)>Redlich-Peterson (three-parameter). The influence of solution pH on the adsorption isotherms of 4-CP was investigated. It was shown that the solution pH has not an effect on the adsorption isotherms for pHadsorptive pKa and the pH(PZC).

  14. The adsorption of phloretin to lipid monolayers and bilayers cannot be explained by langmuir adsorption isotherms alone.

    PubMed Central

    Cseh, R; Benz, R

    1998-01-01

    Phloretin and its analogs adsorb to the surfaces of lipid monolayers and bilayers and decrease the dipole potential. This reduces the conductance for anions and increases that for cations on artificial and biological membranes. The relationship between the change in the dipole potential and the aqueous concentration of phloretin has been explained previously by a Langmuir adsorption isotherm and a weak and therefore negligible contribution of the dipole-dipole interactions in the lipid surface. We demonstrate here that the Langmuir adsorption isotherm alone is not able to properly describe the effects of dipole molecule binding to lipid surfaces--we found significant deviations between experimental data and the fit with the Langmuir adsorption isotherm. We present here an alternative theoretical treatment that takes into account the strong interaction between membrane (monolayer) dipole field and the dipole moment of the adsorbed molecule. This treatment provides a much better fit of the experimental results derived from the measurements of surface potentials of lipid monolayers in the presence of phloretin. Similarly, the theory provides a much better fit of the phloretin-induced changes in the dipole potential of lipid bilayers, as assessed by the transport kinetics of the lipophilic ion dipicrylamine. PMID:9512036

  15. Mean field lattice model for adsorption isotherms in zeolite NaA

    NASA Astrophysics Data System (ADS)

    Ayappa, K. G.; Kamala, C. R.; Abinandanan, T. A.

    1999-05-01

    Using a lattice model for adsorption in microporous materials, pure component adsorption isotherms are obtained within a mean field approximation for methane at 300 K and xenon at 300 and 360 K in zeolite NaA. It is argued that the increased repulsive adsorbate-adsorbate interactions at high coverages must play an important role in determining the adsorption behavior. Therefore, this feature is incorporated through a "coverage-dependent interaction" model, which introduces a free, adjustable parameter. Another important feature, the site volume reduction, has been treated in two ways: a van der Waal model and a 1D hard-rod theory [van Tassel et al., AIChE J. 40, 925 (1994)]; we have also generalized the latter to include all possible adsorbate overlap scenarios. In particular, the 1D hard-rod model, with our coverage-dependent interaction model, is shown to be in best quantitative agreement with the previous grand canonical Monte Carlo isotherms. The expressions for the isosteric heats of adsorption indicate that attractive and repulsive adsorbate-adsorbate interactions increase and decrease the heats of adsorption, respectively. It is concluded that within the mean field approximation, our simple model for repulsive interactions and the 1D hard-rod model for site volume reduction are able to capture most of the important features of adsorption in confined regions.

  16. Competitive ion-exchange adsorption of proteins: competitive isotherms with controlled competitor concentration.

    PubMed

    Cano, Tony; Offringa, Natalie D; Willson, Richard C

    2005-06-24

    The competitive adsorption processes inevitably present in chromatographic separations of complex mixtures have not been extensively studied. This is partly due to the difficulty of measuring true competitive isotherms, in which all system parameters (including competitor concentrations) are held constant. We report a novel approach to determining competitive protein adsorption isotherms in which the competitor concentration is held constant across the entire isotherm. By using the heme prosthetic group in cytochrome b5 as a quantitative spectrophotometric label, competitive isotherms between cytochrome b5 and alpha-lactalbumin can be constructed. Similarly, manganese-substituted protoporphyrin IX heme replacement allows the non-perturbing labeling of individual cytochrome b5 conservative surface charge mutants by replacement of a single atom in the interior of the protein. This labeling allows the study of competition between cytochrome b5 charge mutants of identical size and shape, which differ only in charge arrangement. Using these techniques, the effect of competing species on equilibrium behavior and the apparent heterogeneity of anion-exchange adsorbents in the presence of competitors can be quantitatively studied by fitting the data to two popular single-component binding models, the Temkin and the Langmuir-Freundlich (L-F) isotherms.

  17. Determination of competitive adsorption isotherms applying the nonlinear frequency response method. Part II. Experimental demonstration.

    PubMed

    Ilić, Milica; Petkovska, Menka; Seidel-Morgenstern, Andreas

    2009-08-14

    This paper demonstrates an experimental application of the nonlinear frequency response (FR) method extension to determine adsorption isotherms of binary mixtures. This method, based on the analysis of the response of a chromatographic column subjected to the sinusoidal inlet concentration changes, is shown to be an alternative for isotherm determination. The critical issue related to the successful application of the method is to reach experimentally the low frequency asymptotic behaviour of the corresponding frequency response functions (FRFs). Although, there are different possibilities to perform periodical inlet concentration changes, in this paper only simultaneous changes for both components were considered. The adsorption of phenol and 2-phenylethanol on octadecyl silica was analyzed experimentally using a mixture of methanol and water as a solvent. Parameters of competitive isotherms were also estimated for comparison using the classical perturbation method. Despite certain differences between competitive isotherms estimated with the two methods that were found, the obtained results show the potential of the nonlinear FR method for measuring competitive isotherms.

  18. Equilibrium isotherms, kinetics and thermodynamics studies of phenolic compounds adsorption on palm-tree fruit stones.

    PubMed

    Ahmed, Muthanna J; Theydan, Samar K

    2012-10-01

    Adsorption capacity of an agricultural waste, palm-tree fruit stones (date stones), for phenolic compounds such as phenol (Ph) and p-nitro phenol (PNPh) at different temperatures was investigated. The characteristics of such waste biomass were determined and found to have a surface area and iodine number of 495.71 m2/g and 475.88 mg/g, respectively. The effects of pH (2-12), adsorbent dose (0.6-0.8 g/L) and contact time (0-150 min) on the adsorptive removal process were studied. Maximum removal percentages of 89.95% and 92.11% were achieved for Ph and PNPh, respectively. Experimental equilibrium data for adsorption of both components were analyzed by the Langmuir, Freundlich and Tempkin isotherm models. The results show that the best fit was achieved with the Langmuir isotherm equation with maximum adsorption capacities of 132.37 and 161.44 mg/g for Ph and PNPh, respectively. The kinetic data were fitted to pseudo-first order, pseudo-second order and intraparticle diffusion models, and was found to follow closely the pseudo-second order model for both components. The calculated thermodynamic parameters, namely ΔG, ΔH, and ΔS showed that adsorption of Ph and PNPh was spontaneous and endothermic under examined conditions.

  19. Sb/Si(111) adsorption: hidden phase transitions behind Langmuir-like isotherms.

    PubMed

    Guesmi, H; Lapena, L; Ranguis, A; Müller, P; Tréglia, G

    2005-02-25

    The experimental study of the thermodynamic and kinetic properties of the Sb/Si(111) interface reveals a surprising behavior: a 2D phase condensates when the Sb coverage increases, indicating strong attractive Sb-Sb interactions, whereas the isotherms present a quasi-Langmuir shape, suggesting that these interactions should be negligible. Ab initio calculations raise this contradiction: while the adsorption site evolves from ternary towards the on-top position with increasing coverage, the character of the Sb-Sb effective interactions changes from repulsive towards attractive, resulting in an almost constant average adsorption energy. A simple (Langmuir) thermodynamic behavior can then be the consequence of a surface phase transition.

  20. Predicting adsorption isotherms using a two-dimensional statistical associating fluid theory

    NASA Astrophysics Data System (ADS)

    Martinez, Alejandro; Castro, Martin; McCabe, Clare; Gil-Villegas, Alejandro

    2007-02-01

    A molecular thermodynamics approach is developed in order to describe the adsorption of fluids on solid surfaces. The new theory is based on the statistical associating fluid theory for potentials of variable range [A. Gil-Villegas et al., J. Chem. Phys. 106, 4168 (1997)] and uses a quasi-two-dimensional approximation to describe the properties of adsorbed fluids. The theory is tested against Gibbs ensemble Monte Carlo simulations and excellent agreement with the theoretical predictions is achieved. Additionally the authors use the new approach to describe the adsorption isotherms for nitrogen and methane on dry activated carbon.

  1. Predicting adsorption isotherms using a two-dimensional statistical associating fluid theory.

    PubMed

    Martinez, Alejandro; Castro, Martin; McCabe, Clare; Gil-Villegas, Alejandro

    2007-02-21

    A molecular thermodynamics approach is developed in order to describe the adsorption of fluids on solid surfaces. The new theory is based on the statistical associating fluid theory for potentials of variable range [A. Gil-Villegas et al., J. Chem. Phys. 106, 4168 (1997)] and uses a quasi-two-dimensional approximation to describe the properties of adsorbed fluids. The theory is tested against Gibbs ensemble Monte Carlo simulations and excellent agreement with the theoretical predictions is achieved. Additionally the authors use the new approach to describe the adsorption isotherms for nitrogen and methane on dry activated carbon.

  2. Adsorption isotherms of cellulose-based polymers onto cotton fibers determined by means of a direct method of fluorescence spectroscopy.

    PubMed

    Hoffmann, Ingo; Oppel, Claudia; Gernert, Ulrich; Barreleiro, Paula; von Rybinski, Wolfgang; Gradzielski, Michael

    2012-05-22

    We present a novel method for the measurement of polymer adsorption on fibers by employing fluorescently labeled polymers. The method itself can be used for any compound that either shows fluorescence or can be labeled with a fluorescent dye, which renders it ubiquitously applicable for adsorption studies. The main advantage of the method is that the choice of adsorbent is not limited to flat surfaces, thereby allowing the investigation of fibrous and porous systems. As an example of high interest for application we determined the adsorption isotherms of various polysaccharide-based polymers with different charges and different substituents on cotton fibers. These experiments show that the extent of adsorption depends not only on the charge conditions but also very much on the specific interactions between the polymer and fiber. For instance, the cationic hydroxyethyl cellulose can become bound to an extent similar to that of the anionic alginate, while the anionic carboxymethyl cellulose of similar charge density adsorbs much less under these conditions. This shows that the adsorption of polymers depends subtly on the details of the interaction between the polymer and fiber but can be determined with good precision with our direct fluorescence method.

  3. Adsorption of Toluene and Paraxylene from Aqueous Solution Using Pure and Iron Oxide Impregnated Carbon Nanotubes: Kinetics and Isotherms Study

    PubMed Central

    Abbas, Aamir; Ihsanullah; Al-Baghli, Nadhir A. H.

    2017-01-01

    Multiwall carbon nanotubes (CNTs) and iron oxide impregnated carbon nanotubes (CNTs-iron oxide) were investigated for the adsorption of hazardous toluene and paraxylene (p-xylene) from aqueous solution. Pure CNTs were impregnated with iron oxides nanoparticles using wet impregnation technique. Various characterization techniques including thermogravimetric analysis, scanning electron microscopy, elemental dispersion spectroscopy, X-ray diffraction, and nitrogen adsorption analysis were used to study the thermal degradation, surface morphology, purity, and surface area of the materials. Batch adsorption experiments show that iron oxide impregnated CNTs have higher degree of removal of p-xylene (i.e., 90%) compared with toluene (i.e., 70%), for soaking time 2 h, with pollutant initial concentration 100 ppm, at pH 6 and shaking speed of 200 rpm at 25°C. Pseudo-second-order model provides better fitting for the toluene and p-xylene adsorption. Langmuir and Freundlich isotherm models demonstrate good fitting for the adsorption data of toluene and p-xylene. PMID:28386208

  4. Oxygen chemisorption on V/sub 2/O/sub 5/: isotherms and isobars of adsorption

    SciTech Connect

    Rey, L.; Gambaro, L.A.; Thomas, H.J.

    1984-06-01

    Experimental results of oxygen adsorption on V/sub 2/O/sub 5/ (isotherms and isobars) are reported. In its normal state V/sub 2/O/sub 5/ is a nonstoichiometric oxide that shows oxygen vacancies with the subsequent formation of V/sup 4 +/ ions. A model is developed for the interaction between oxygen (gaseous, adsorbed, and bulk) and the solid phase (V/sub 2/O/sub 5/). 12 references, 4 figures, 1 table.

  5. Chromatography Models with Langmuir and Steric Mass Action Adsorption Isotherms are of Differential Index One

    NASA Astrophysics Data System (ADS)

    von Lieres, Eric

    2010-09-01

    Chromatography is commonly applied for the separation of bio-molecules in pharmaceutical industry, and chromatography models are increasingly applied for rational process analysis and optimization. A rapid equilibrium assumption is often applied for the adsorption equation, which results in a non-linear system of partial differential-algebraic equations (PDAEs). In this contribution a proof is given, that these PDAEs are of differential index one for the two most prominent isotherm models, Langmuir and steric mass action (SMA).

  6. Comparison of monometal and multimetal adsorption in Mississippi River alluvial wetland sediment: batch and column experiments.

    PubMed

    Seo, Dong Cheol; Yu, Kewei; DeLaune, Ronald D

    2008-12-01

    Monometal and multimetal adsorption of selected heavy metals in a sediment from a coastal Louisiana forested swamp used for wastewater treatment was studied. Results from the batch experiments show that the maximum adsorption capacities of the metals by the sediment were in the order of Pb>Hg>Cr>CdCuZn>As based on monometal adsorption isotherm, and Hg>Cr>CuCd approximately Pb>As approximately Zn based on multimetal adsorption isotherm, respectively. Batch experimental data best fit the Langmuir model rather than the Freundlich isotherms. In the column experiments, the maximum adsorption capacities of the metals were in the order of Pb>Hg>Cr>Cd>Cu>Zn>As in monometal conditions, and Hg>Cr>Pb>CuZn approximately Cd>As in multimetal conditions. The metals became more mobile in multimetal than in monometal conditions. Results from both the batch and column experiments show that competitive adsorption among metals increases the mobility of these metals. Particularly, in this study, Pb in multimetal conditions lost it adsorption capacity most significantly. In both monometal and multimetal conditions, the maximum adsorption capacity of the metals in the column experiments was higher than that in the batch experiment indicating other metal retention mechanisms rather than adsorption may be involved. Therefore, both column and batch experiments are needed for estimating retention capacities and removal efficiencies of metals in sediments.

  7. The investigation of kinetic and isotherm of fluoride adsorption onto functionalize pumice stone.

    PubMed

    Asgari, Ghorban; Roshani, Babak; Ghanizadeh, Ghader

    2012-05-30

    In this research work, pumice that is functionalized by the cationic surfactant, hexadecyltrimethyl ammonium (HDTMA), is used as an adsorbent for the removal of fluoride from drinking water. This work was carried out in two parts. The effects of HDTMA loading, pH (3-10), reaction time (5-60 min) and the adsorbent dosage (0.15-2.5 g L(-1)) were investigated on the removal of fluoride as a target contaminate from water through the design of different experimental sets in the first part. The results from this first part revealed that surfactant-modified pumice (SMP) exhibited the best performance at dose 0.5 g L(-1), pH 6, and it adsorbs over 96% of fluoride from a solution containing 10 mg L(-1) fluoride after 30 min of mixing time. The four linear forms of the Langmuir, Freundlich, Temkin and Dubinin-Radushkevich isotherms model were applied to determine the best fit of equilibrium expressions. Apart from the regression coefficient (R(2)), four error functions were used to validate the isotherm and kinetics data. The experimental adsorption isotherm complies with Langmuir equation model type 1. The maximum amount of adsorption (Q(max)) was 41 mg g(-1). The kinetic studies indicated that the adsorption of fluoride best fitted with the pseudo-second-order kinetic type 1. Thermodynamic parameters evaluation of fluoride adsorption on SMP showed that the adsorption process under the selected conditions was spontaneous and endothermic. The suitability of SMP in defluoridation at field condition was investigated with natural groundwater samples collected from a nearby fluoride endemic area in the second part of this study. Based on this study's results, SMP was shown to be an affordable and a promising option for the removal of fluoride in drinking water.

  8. Molecular simulation of excess isotherm and excess enthalpy change in gas-phase adsorption.

    PubMed

    Do, D D; Do, H D; Nicholson, D

    2009-01-29

    We present a new approach to calculating excess isotherm and differential enthalpy of adsorption on surfaces or in confined spaces by the Monte Carlo molecular simulation method. The approach is very general and, most importantly, is unambiguous in its application to any configuration of solid structure (crystalline, graphite layer or disordered porous glass), to any type of fluid (simple or complex molecule), and to any operating conditions (subcritical or supercritical). The behavior of the adsorbed phase is studied using the partial molar energy of the simulation box. However, to characterize adsorption for comparison with experimental data, the isotherm is best described by the excess amount, and the enthalpy of adsorption is defined as the change in the total enthalpy of the simulation box with the change in the excess amount, keeping the total number (gas + adsorbed phases) constant. The excess quantities (capacity and energy) require a choice of a reference gaseous phase, which is defined as the adsorptive gas phase occupying the accessible volume and having a density equal to the bulk gas density. The accessible volume is defined as the mean volume space accessible to the center of mass of the adsorbate under consideration. With this choice, the excess isotherm passes through a maximum but always remains positive. This is in stark contrast to the literature where helium void volume is used (which is always greater than the accessible volume) and the resulting excess can be negative. Our definition of enthalpy change is equivalent to the difference between the partial molar enthalpy of the gas phase and the partial molar enthalpy of the adsorbed phase. There is no need to assume ideal gas or negligible molar volume of the adsorbed phase as is traditionally done in the literature. We illustrate this new approach with adsorption of argon, nitrogen, and carbon dioxide under subcritical and supercritical conditions.

  9. A simple method for measuring excess adsorption isotherms of organic eluent components on reversed-phase packing materials.

    PubMed

    Ohashi, Junji; Harada, Makoto; Okada, Tetsuo

    2017-02-01

    A simple frontal analysis method has been developed for the reliable measurement of excess adsorption isotherms of an organic component on reversed-phase adsorbents in a series of programmed concentration steps. In the present method, a peak, which is produced by refractive index change in column eluate, is detected at 589 nm; it represents the elution volume of the boundary. The method is applied to the measurement of the excess adsorption isotherms of organic eluent components from water on commercially available reversed-phase stationary phases. The results are in good agreement with the previously reported isotherms. We also measure the excess adsorption isotherms of organic eluent components from solutions containing electrolytes. There are not any interference peaks on the elution traces. The method is thus reliably applicable to the evaluation of the excess adsorption of organic eluent components in practical systems.

  10. Removal of water and iodine by solid sorbents: adsorption isotherms and kinetics

    SciTech Connect

    Lin, R.; Tavlarides, L.L.

    2013-07-01

    Tritium and iodine-129 are two major radioactive elements that are present in off-gases from spent fuel reprocessing plants. Adsorption by solid sorbents is the state-of-the-art technique for removal of these species from off-gases. Modeling and simulating adsorption processes require accurate adsorption equilibrium and kinetic data to permit reasonable estimates of process parameters. We have developed a continuous flow single-pellet adsorption system to gather accurate adsorption equilibrium and kinetic data for adsorption of water by molecular sieve 3A and for adsorption of iodine by silver exchanged mordenite. In this paper, the design of the water and iodine adsorption experimental systems are briefly described and results of water adsorption experiments are presented and discussed. Water uptake curves are fitted with the linear-driving force (LDF) model and the shrinking-core model to determine kinetic parameters. It is shown that the kinetics of water adsorption on zeolite 3A under current experimental conditions is controlled by both the external film resistance and the macro-pore diffusion and can be predicted by both the LDF model and the shrinking-core model with the former one performing slightly better. Preliminary results from iodine adsorption experiments will be presented in the conference.

  11. Adsorption of methyl orange from aqueous solution by aminated pumpkin seed powder: Kinetics, isotherms, and thermodynamic studies.

    PubMed

    Subbaiah, Munagapati Venkata; Kim, Dong-Su

    2016-06-01

    Present research discussed the utilization of aminated pumpkin seed powder (APSP) as an adsorbent for methyl orange (MO) removal from aqueous solution. Batch sorption experiments were carried to evaluate the influence of pH, initial dye concentration, contact time, and temperature. The APSP was characterized by using Fourier Transform Infrared Spectroscopy (FTIR) and Scanning Electron Microscopy (SEM). The experimental equilibrium adsorption data were fitted using two two-parameter models (Langmuir and Freundlich) and two three-parameter models (Sips and Toth). Langmuir and Sips isotherms provided the best model for MO adsorption data. The maximum monolayer sorption capacity was found to be 200.3mg/g based on the Langmuir isotherm model. The pseudo-first-order and pseudo-second-order model equations were used to analyze the kinetic data of the adsorption process and the data was fitted well with the pseudo-second-order kinetic model (R(2)>0.97). The calculated thermodynamic parameters such as ΔG(0), ΔH(0) and ΔS(0) from experimental data showed that the sorption of MO onto APSP was feasible, spontaneous and endothermic in the temperature range 298-318 K. The FTIR results revealed that amine and carboxyl functional groups present on the surface of APSP. The SEM results show that APSP has an irregular and porous surface which is adequate morphology for dye adsorption. Desorption experiments were carried to explore the feasibility of adsorbent regeneration and the adsorbed MO from APSP was desorbed using 0.1M NaOH with an efficiency of 93.5%. Findings of the present study indicated that APSP can be successfully used for removal of MO from aqueous solution.

  12. Adsorptive removal of chlorophenols from aqueous solution by low cost adsorbent--Kinetics and isotherm analysis.

    PubMed

    Radhika, M; Palanivelu, K

    2006-11-02

    Adsorptive removal of parachlorophenol (PCP) and 2,4,6-trichlorophenol (TCP) from aqueous solutions by activated carbon prepared from coconut shell was studied and compared with activated carbon of commercial grade (CAC). Various chemical agents in different concentrations were used (KOH, NaOH, CaCO(3), H(3)PO(4) and ZnCl(2)) for the preparation of coconut shell activated carbon. The coconut shell activated carbon (CSAC) prepared using KOH as chemical agent showed high surface area and best adsorption capacity and was chosen for further studies. Batch adsorption studies were conducted to evaluate the effect of various parameters such as pH, adsorbent dose, contact time and initial PCP and TCP concentration. Adsorption equilibrium reached earlier for CSAC than CAC for both PCP and TCP concentrations. Under optimized conditions the prepared activated carbon showed 99.9% and 99.8% removal efficiency for PCP and TCP, respectively, where as the commercially activated carbon had 97.7% and 95.5% removal for PCP and TCP, respectively, for a solution concentration of 50mg/L. Adsorption followed pseudo-second-order kinetics. The equilibrium adsorption data were analysed by Langmuir, Freundlich, Redlich-Peterson and Sips model using non-linear regression technique. Freundlich isotherms best fitted the data for adsorption equilibrium for both the compounds (PCP and TCP). Similarly, acidic pH was favorable for the adsorption of both PCP and TCP. Studies on pH effect and desorption revealed that chemisorption was involved in the adsorption process. The efficiency of the activated carbon prepared was also tested with real pulp and paper mill effluent. The removal efficiency using both the carbons were found highly satisfactory and was about 98.7% and 96.9% as phenol removal and 97.9% and 93.5% as AOX using CSAC and CAC, respectively.

  13. Adsorption kinetics and isotherms of arsenite and arsenate on hematite nanoparticles and aggregates.

    PubMed

    Dickson, Dionne; Liu, Guangliang; Cai, Yong

    2017-01-15

    Iron (Fe) nanoparticles, e.g., zerovalent iron (ZVI) and iron oxide nanoparticles (IONP), have been used for remediation and environmental management of arsenic (As) contamination. These Fe nanoparticles, although originally nanosized, tend to form aggregates, in particular in the environment. The interactions of As with both nanoparticles and micron-sized aggregates should be considered when these Fe nanomaterials are used for mitigation of As issue. The objective of this study was to compare the adsorption kinetics and isotherm of arsenite (As(III)) and arsenate (As(V)) on bare hematite nanoparticles and aggregates and how this affects the fate of arsenic in the environment. The adsorption kinetic process was investigated with regards to the aggregation of the nanoparticles and the type of sorbed species. Kinetic data were best described by a pseudo second-order model. Both As species had similar rate constants, ranging from 3.82 to 6.45 × 10(-4) g/(μg·h), as rapid adsorption occurred within the first 8 h regardless of particle size. However, hematite nanoparticles and aggregates showed a higher affinity to adsorb larger amounts of As(V) (4122 ± 62.79 μg/g) than As(III) (2899 ± 71.09 μg/g) at equilibrium. We were able to show that aggregation and sedimentation of hematite nanoparticles occurs during the adsorption process and this might cause the immobilization and reduced bioavailability of arsenic. Isotherm studies were described by the Freundlich model and it confirmed that hematite nanoparticles have a significantly higher adsorption capacity for both As(V) and As(III) than hematite aggregates. This information is useful and can assist in predicting arsenic adsorption behavior and assessing the role of iron oxide nanoparticles in the biogeochemical cycling of arsenic.

  14. Water adsorption isotherms of carboxymethyl cellulose, guar, locust bean, tragacanth and xanthan gums.

    PubMed

    Torres, María D; Moreira, Ramón; Chenlo, Francisco; Vázquez, María J

    2012-06-20

    Water adsorption isotherms of carboxymethyl cellulose (CMC), guar gum (GG), locust bean gum (LBG), tragacanth gum (TG) and xanthan gum (XG) were determined at different temperatures (20, 35, 50, and 65°C) using a gravimetric method. Several saturated salt solutions were selected to obtain different water activities in the range from 0.09 to 0.91. Water adsorption isotherms of tested hydrocolloids were classified like type II isotherms. In all cases, equilibrium moisture content decreased with increasing temperature at each water activity value. Three-parameter Guggenheim-Anderson-de Boer (GAB) model was employed to fit the experimental data in the water activity range and statistical analysis indicated that this model gave satisfactory results. CMC and GG were the most and the least hygroscopic gums, respectively. Sorption heats decreased with increasing moisture content. Monolayer moisture content evaluated with GAB model was consistent with equilibrium conditions of maximum stability calculated from thermodynamic analysis of net integral entropy. Values of equilibrium relative humidity at 20°C are proposed to storage adequately the tested gums.

  15. Kinetic, equilibrium isotherm and thermodynamic studies of Cr(VI) adsorption onto low-cost adsorbent developed from peanut shell activated with phosphoric acid.

    PubMed

    ALOthman, Zeid A; Naushad, Mu; Ali, Rahmat

    2013-05-01

    A particular agricultural waste, peanut shell, has been used as precursor for activated carbon production by chemical activation with H₃PO₄. Unoxidized activated carbon was prepared in nitrogen atmosphere which was then heated in air at a desired temperature to get oxidized activated carbon. The prepared carbons were characterized for surface area, surface morphology, and pore volume and utilized for the removal of Cr(VI) from aqueous solution. Batch mode experiments were conducted to study the effects of pH, contact time, particle size, adsorbent dose, initial concentration of adsorbate, and temperature on the adsorption of Cr(VI). Cr(VI) adsorption was significantly dependent on solution pH, and the optimum adsorption was observed at pH 2. Pseudo-first-order, pseudo-second-order, and intraparticle diffusion models were used to analyze the kinetic data obtained at different initial Cr(VI) concentrations. The adsorption kinetic data were described very well by the pseudo-second-order model. Equilibrium isotherm data were analyzed by the Langmuir, Freundlich, and Temkin models. The results showed that the Langmuir adsorption isotherm model fitted the data better in the temperature range studied. The adsorption capacity which was found to increase with temperature showed the endothermic nature of Cr(VI) adsorption. The thermodynamic parameters, such as Gibb's Free energy change (ΔG°), standard enthalpy change (ΔH°), and standard entropy change (ΔS°) were evaluated.

  16. Adsorption of Phenol from Aqueous Solution Using Lantana camara, Forest Waste: Kinetics, Isotherm, and Thermodynamic Studies

    PubMed Central

    Girish, C. R.; Ramachandra Murty, V.

    2014-01-01

    The present work investigates the potential of Lantana camara, a forest waste, as an adsorbent for the phenol reduction in wastewater. Batch studies were conducted with adsorbent treated with HCl and KOH to determine the influence of various experimental parameters such as pH, contact time, adsorbent dosage, and phenol concentration. The experimental conditions were optimized for the removal of phenol from wastewater. Equilibrium isotherms for the adsorption of phenol were analyzed by Freundlich, Langmuir, Temkin, and Dubinin-Radushkevich isotherm models. Thermodynamic parameters like the Gibbs free energy (ΔG°), enthalpy (ΔH°), and entropy (ΔS°) were also determined and they showed that the adsorption process was feasible, spontaneous, and exothermic in the temperature range of 298–328 K. The kinetic data were fitted with pseudo-second-order model. The equilibrium data that followed Langmuir model with the monolayer adsorption capacity was found to be 112.5 mg/g and 91.07 mg/g for adsorbent treated with HCl and KOH, respectively, for the concentration of phenol ranging from 25 to 250 mg/L. This indicates that the Lantana camara was a promising adsorbent for the removal of phenol from aqueous solutions. PMID:27350997

  17. Adsorption of Phenol from Aqueous Solution Using Lantana camara, Forest Waste: Kinetics, Isotherm, and Thermodynamic Studies.

    PubMed

    Girish, C R; Ramachandra Murty, V

    2014-01-01

    The present work investigates the potential of Lantana camara, a forest waste, as an adsorbent for the phenol reduction in wastewater. Batch studies were conducted with adsorbent treated with HCl and KOH to determine the influence of various experimental parameters such as pH, contact time, adsorbent dosage, and phenol concentration. The experimental conditions were optimized for the removal of phenol from wastewater. Equilibrium isotherms for the adsorption of phenol were analyzed by Freundlich, Langmuir, Temkin, and Dubinin-Radushkevich isotherm models. Thermodynamic parameters like the Gibbs free energy (ΔG°), enthalpy (ΔH°), and entropy (ΔS°) were also determined and they showed that the adsorption process was feasible, spontaneous, and exothermic in the temperature range of 298-328 K. The kinetic data were fitted with pseudo-second-order model. The equilibrium data that followed Langmuir model with the monolayer adsorption capacity was found to be 112.5 mg/g and 91.07 mg/g for adsorbent treated with HCl and KOH, respectively, for the concentration of phenol ranging from 25 to 250 mg/L. This indicates that the Lantana camara was a promising adsorbent for the removal of phenol from aqueous solutions.

  18. Adsorptive removal of α-endosulfan from water by hydrophobic zeolites. An isothermal study.

    PubMed

    Yonli, Arsène H; Batonneau-Gener, Isabelle; Koulidiati, Jean

    2012-02-15

    This paper deals with the removal of α-endosulfan from water over HY and steamed HBEA zeolites. Experiments were performed to understand the adsorption mechanisms of α-endosulfan on zeolites and to determine the most efficient adsorbent for the purification of water contaminated by this pesticide. The experiments exhibit that α-endosulfan was adsorbed in the micropores. In the case of HY zeolites an adsorption of α-endosulfan molecules on BrØnsted sites was pointed out, due to a preferential water adsorption in mesopores. Moreover a physisorption of α-endosulfan occurred in micropores. For steamed HBEA zeolites physisorption in micropores was pointed out as the adsorption mode. For both types of zeolites a decrease of the adsorption capacities was noticed when the acidity of zeolites increased. There was also a linear relation between the adsorption capacities of α-endosulfan and the hydrophobicity (HI) of the samples and by determining the values of HI for a type of zeolite it was possible to deduce the uptake of α-endosulfan. The HY(40) sample was the most efficient for the removal of α-endosulfan from water because of preferential adsorption of water molecules in mesopores and lower acidity. For this sample the adsorption capacity for α-endosulfan was about 833.33 mg/g where for the most effective HBEA sample (St700(3)) the adsorption capacity was about 793.65 mg/g.

  19. A comparative examination of the adsorption mechanism of an anionic textile dye (RBY 3GL) onto the powdered activated carbon (PAC) using various the isotherm models and kinetics equations with linear and non-linear methods

    NASA Astrophysics Data System (ADS)

    Açıkyıldız, Metin; Gürses, Ahmet; Güneş, Kübra; Yalvaç, Duygu

    2015-11-01

    The present study was designed to compare the linear and non-linear methods used to check the compliance of the experimental data corresponding to the isotherm models (Langmuir, Freundlich, and Redlich-Peterson) and kinetics equations (pseudo-first order and pseudo-second order). In this context, adsorption experiments were carried out to remove an anionic dye, Remazol Brillant Yellow 3GL (RBY), from its aqueous solutions using a commercial activated carbon as a sorbent. The effects of contact time, initial RBY concentration, and temperature onto adsorbed amount were investigated. The amount of dye adsorbed increased with increased adsorption time and the adsorption equilibrium was attained after 240 min. The amount of dye adsorbed enhanced with increased temperature, suggesting that the adsorption process is endothermic. The experimental data was analyzed using the Langmuir, Freundlich, and Redlich-Peterson isotherm equations in order to predict adsorption isotherm. It was determined that the isotherm data were fitted to the Langmuir and Redlich-Peterson isotherms. The adsorption process was also found to follow a pseudo second-order kinetic model. According to the kinetic and isotherm data, it was found that the determination coefficients obtained from linear method were higher than those obtained from non-linear method.

  20. The Isothermal Dendritic Growth Experiment (IDGE)

    NASA Technical Reports Server (NTRS)

    Glicksman, M. E.; Koss, M. B.; LaCombe, J. C.; Lupulescu, A. O.; Frei, J. E.; Guimarra, C.; Malarik, D. C.

    2001-01-01

    Dendritic solidification is one of the simplest examples of pattern formation where a structureless melt evolves into a ramified crystalline microstructure; it is a common mode of solidification in many materials, but especially so in metals and alloys. There is considerable engineering interest in dendrites because of the role dendrites play in the determination of microstructure, and thereby in influencing the physical properties of cast metals and alloys. Dendritic solidification provides important examples of non-equilibrium physics, pattern formation dynamics, and models for computational condensed matter and material physics. Current theories of dendritic growth generally couple diffusion effects in the melt with the physics introduced by the interface. Unfortunately, in terrestrial based experiments, convective effects in the melt alter the growth process in such a manner as to prevent definitive analysis of convective, diffusive or interfacial effects. Thus, the effective elimination of convection in the melt by operating experiments on orbit were required to produce high-fidelity data needed for achieving further progress. This simple fact comprised the scientific justification for the IDGE.

  1. Batch removal of malachite green from aqueous solutions by adsorption on oil palm trunk fibre: equilibrium isotherms and kinetic studies.

    PubMed

    Hameed, B H; El-Khaiary, M I

    2008-06-15

    Oil palm trunk fibre (OPTF)--an agricultural solid waste--was used as low-cost adsorbent to remove malachite green (MG) from aqueous solutions. The operating variables studied were contact time, initial dye concentration, and solution pH. Equilibrium adsorption data were analyzed by three isotherms, namely the Freundlich isotherm, the Langmuir isotherm, and the multilayer adsorption isotherm. The best fit to the data was obtained with the multilayer adsorption. The monolayer adsorption capacity of OPTF was found to be 149.35 mg/g at 30 degrees C. Adsorption kinetic data were modeled using the Lagergren pseudo-first-order, Ho's pseudo-second-order and Elovich models. It was found that the Lagergren's model could be used for the prediction of the system's kinetics. The overall rate of dye uptake was found to be controlled by external mass transfer at the beginning of adsorption, then for initial MG concentrations of 25, 50, 100, 150, and 300 mg/L the rate-control changed to intraparticle diffusion at a later stage, but for initial MG concentrations 200 and 250 mg/L no evidence was found of intraparticle diffusion at any period of adsorption. It was found that with increasing the initial concentration of MG, the pore-diffusion coefficient increased while the film-diffusion coefficient decreased.

  2. The Isothermal Dendritic Growth Experiment Archive

    NASA Astrophysics Data System (ADS)

    Koss, Matthew

    2009-03-01

    The growth of dendrites is governed by the interplay between two simple and familiar processes---the irreversible diffusion of energy, and the reversible work done in the formation of new surface area. To advance our understanding of these processes, NASA sponsored a project that flew on the Space Shuttle Columbia is 1994, 1996, and 1997 to record and analyze benchmark data in an apparent-microgravity ``laboratory.'' In this laboratory, energy transfer by gravity driven convection was essentially eliminated and one could test independently, for the first time, both components of dendritic growth theory. The analysis of this data shows that although the diffusion of energy can be properly accounted for, the results from interfacial physics appear to be in disagreement and alternate models should receive increased attention. Unfortunately, currently and for the foreseeable future, there is no access or financial support to develop and conduct additional experiments of this type. However, the benchmark data of 35mm photonegatives, video, and all supporting instrument data are now available at the IDGE Archive at the College of the Holy Cross. This data may still have considerable relevance to researchers working specifically with dendritic growth, and more generally those working in the synthesis, growth & processing of materials, multiscale computational modeling, pattern formation, and systems far from equilibrium.

  3. Adsorption on molecularly imprinted polymers of structural analogues of a template. Single-component adsorption isotherm data

    SciTech Connect

    Kim, Hyunjung; Guiochon, Georges A

    2005-10-01

    The equilibrium adsorption isotherms on two otherwise identical polymers, one imprinted with Fmoc-L-tryptophan (Fmoc-L-Trp) (MIP), the other nonimprinted (NIP), of compounds that are structural analogues of the template were acquired by frontal analysis (FA) in an acetonitrile/acetic acid (99/1 v/v) mobile phase, over a wide concentration range (from 0.005 to 50 mM). These analogues were Fmoc-L-tyrosine, Fmoc-L-serine, Fmoc-L-phenyalanine, Fmoc-glycine (Fmoc-Gly), Fmoc-L-tryptophan pentafluorophenyl ester (Fmoc-L-Trp(OPfp)), and their antipodes. These substrates have different numbers of functional groups able to interact with the 4-vinylpyridine groups of the polymer. For a given number of the functional groups, these substrates have different hydrophobicities of their side groups (as indicated by their partition coefficients (log P{sub ow}) in the octanol-water system (e.g., from 4.74 for Fmoc-Trp to 2.53 for Fmoc-Gly)). Statistical results from the fitting of the FA data to Langmuirian isotherm models, the calculation of the affinity energy distribution, and the comparison of calculated and experimental band profiles show that all these sets of FA data are best accounted for by a tri-Langmuir isotherm model, except for the data of Fmoc-L-Trp(OPfp) that are best modeled by a simple Langmuir isotherm. So, all compounds but Fmoc-L-Trp(OPfp) find three different types of adsorption sites on both the MIP and the NIP. The properties of these different types of sites were studied systematically. The results show that the affinity of the structural analogues for the NIP is controlled mostly by the number of the functional groups on the substrates and somewhat by the hydrophobicity of their side groups. These two factors control also the MIP affinity toward the enantiomers of the structural analogues that have a stereochemistry different from that of the template. In contrast, the affinity of the highest affinity sites of the MIP toward the enantiomers of these

  4. Adsorption of malachite green by polyaniline-nickel ferrite magnetic nanocomposite: an isotherm and kinetic study

    NASA Astrophysics Data System (ADS)

    Patil, Manohar R.; Shrivastava, V. S.

    2014-11-01

    This work deals with the development of an efficient method for the removal of a MG (malachite green) dye from aqueous solution using polyaniline (PANI)-Nickel ferrite (NiFe2O4) magnetic nanocomposite. It is successfully synthesised in situ through self polymerisation of monomer aniline. Adsorptive removal studies are carried out for water soluble MG dye using PANI-Nickel ferrite magnetic nanocomposite in aqueous solution. Different parameters like dose of adsorbent, contact time, different initial conc., and pH have been studied to optimise reaction condition. It is concluded that adsorptive removal by PANI-Nickel ferrite magnetic nanocomposite is an efficient method for removing a MG dye from aqueous solution than work done before. The optimum conditions for the removal of the dye are initial concentration 30 mg l-1, adsorbent dose 5gm l-1 and pH 7. The adsorption capacity is found 4.09 mg g-1 at optimum condition 30 mg l-1. The adsorption followed pseudo-second-order kinetics. The experimental isotherm is found to fit with Langmuir equation. The prepared adsorbent is characterised by techniques SEM, EDS, XRD and VSM.

  5. Phenol adsorption on surface-functionalized iron oxide nanoparticles: modeling of the kinetics, isotherm, and mechanism

    NASA Astrophysics Data System (ADS)

    Yoon, Soon Uk; Mahanty, Biswanath; Ha, Hun Moon; Kim, Chang Gyun

    2016-06-01

    Phenol adsorption from aqueous solution was carried out using uncoated and methyl acrylic acid (MAA)-coated iron oxide nanoparticles (NPs), having size <10 nm, as adsorbents. Batch adsorption studies revealed that the phenol removal efficiency of MAA-coated NPs (950 mg g-1) is significantly higher than that of uncoated NPs (550 mg g-1) under neutral to acidic conditions. However, this improvement disappears above pH 9. The adsorption data under optimized conditions (pH 7) were modeled with pseudo-first- and pseudo-second-order kinetics and subjected to Freundlich and Langmuir isotherms. The analysis determined that pseudo-second-order kinetics and the Freundlich model are appropriate for both uncoated and MAA-coated NPs (all R 2 > 0.98). X-ray photoelectron spectroscopy analysis of pristine and phenol-adsorbed NPs revealed core-level binding energy and charge for Fe(2 s) and O(1 s) on the NP surfaces. The calculations suggest that phenol adsorption onto MAA-coated NPs is a charge transfer process, where the adsorbate (phenol) acts as an electron donor and the NP surface (Fe, O) as an electron acceptor. However, a physisorption process appears to be the relevant mechanism for uncoated NPs.

  6. How soil organic matter composition controls hexachlorobenzene-soil-interactions: adsorption isotherms and quantum chemical modeling.

    PubMed

    Ahmed, Ashour A; Kühn, Oliver; Aziz, Saadullah G; Hilal, Rifaat H; Leinweber, Peter

    2014-04-01

    Hazardous persistent organic pollutants (POPs) interact in soil with the soil organic matter (SOM) but this interaction is insufficiently understood at the molecular level. We investigated the adsorption of hexachlorobenzene (HCB) on soil samples with systematically modified SOM. These samples included the original soil, the soil modified by adding a hot water extract (HWE) fraction (soil+3 HWE and soil+6 HWE), and the pyrolyzed soil. The SOM contents increased in the order pyrolyzed soiladsorption. The pyrolyzed soil adsorbed more HCB than the other samples at low initial concentrations, but at higher concentrations the HCB adsorption became weaker than in the samples with HWE addition. This adsorption combined with the differences in the chemical composition between the soil samples suggested that alkylated aromatic, phenol, and lignin monomer compounds contributed most to the HCB adsorption. To obtain a molecular level understanding, a test set has been developed on the basis of elemental analysis which comprises 32 representative soil constituents. The calculated binding energy for HCB with each representative system shows that HCB binds to SOM stronger than to soil minerals. For SOM, HCB binds to alkylated aromatic, phenols, lignin monomers, and hydrophobic aliphatic compounds stronger than to polar aliphatic compounds confirming the above adsorption isotherms. Moreover, quantitative structure-activity relationship (QSAR) of the binding energy with independent physical properties of the test set systems for the first time indicated that the polarizability, the partial charge on the carbon atoms, and the molar volume are the most important properties controlling HCB-SOM interactions.

  7. Statistical physics studies of multilayer adsorption isotherm in food materials and pore size distribution

    NASA Astrophysics Data System (ADS)

    Aouaini, F.; Knani, S.; Ben Yahia, M.; Ben Lamine, A.

    2015-08-01

    Water sorption isotherms of foodstuffs are very important in different areas of food science engineering such as for design, modeling and optimization of many processes. The equilibrium moisture content is an important parameter in models used to predict changes in the moisture content of a product during storage. A formulation of multilayer model with two energy levels was based on statistical physics and theoretical considerations. Thanks to the grand canonical ensemble in statistical physics. Some physicochemical parameters related to the adsorption process were introduced in the analytical model expression. The data tabulated in literature of water adsorption at different temperatures on: chickpea seeds, lentil seeds, potato and on green peppers were described applying the most popular models applied in food science. We also extend the study to the newest proposed model. It is concluded that among studied models the proposed model seems to be the best for description of data in the whole range of relative humidity. By using our model, we were able to determine the thermodynamic functions. The measurement of desorption isotherms, in particular a gas over a solid porous, allows access to the distribution of pore size PSD.

  8. Modeling and CFD prediction for diffusion and adsorption within room with various adsorption isotherms.

    PubMed

    Murakami, S; Kato, S; Ito, K; Zhu, Q

    2003-01-01

    This paper presents physical models that are used for analyzing numerically the transportation of volatile organic compounds (VOCs) from building materials in a room. The models are based on fundamental physicochemical principles of their diffusion and adsorption/desorption (hereafter simply sorption) both in building materials and in room air. The performance of the proposed physical models is examined numerically in a test room with a technique supported by computational fluid dynamics (CFD). Two building materials are used in this study. One is a VOC emitting material for which the emission rate is mainly controlled by the internal diffusion of the material. The other is an adsorptive material that has no VOC source. It affects the room air concentration of VOCs with its sorption process. The floor is covered with an emission material made of polypropylene styrene-butadiene rubber (SBR). An adsorbent material made of coal-based activated carbon is spread over the sidewalls. The results of numerical prediction show that the physical models and their numerical simulations explain well the mechanism of the transportation of VOCs in a room.

  9. Adsorption kinetics, thermodynamics and isotherm of Hg(II) from aqueous solutions using buckwheat hulls from Jiaodong of China.

    PubMed

    Wang, Zengdi; Yin, Ping; Qu, Rongjun; Chen, Hou; Wang, Chunhua; Ren, Shuhua

    2013-02-15

    The adsorption kinetics and adsorption isotherms of buckwheat hulls in the region of Jiaodong, China (BHJC) for Hg(II) were investigated. Results revealed that the adsorption kinetics of BHJC for Hg(II) were well described by a pseudo second-order reaction model, and the adsorption thermodynamic parameters ΔG, ΔH and ΔS were -5.83 kJ mol(-1)(35°C), 73.1, and 256 JK(-1) mol(-1), respectively. Moreover, Langmuir, Freundlich and Redlich-Peterson isotherm models were applied to analyse the experimental data and to predict the relevant isotherm parameters. The best interpretation for the experimental data was given by the Langmuir isotherm equation, and the maximum adsorption capacity for Hg(II) is 243.90 mg/g at 35°C. Furthermore, investigation of the adsorption selectivity showed that BHJC displayed strong affinity for mercury in the aqueous solutions and exhibited 100% selectivity for mercury in the presence of Zn(II) and Cd(II).

  10. Adsorption of selected emerging contaminants onto PAC and GAC: Equilibrium isotherms, kinetics, and effect of the water matrix.

    PubMed

    Real, Francisco J; Benitez, F Javier; Acero, Juan L; Casas, Francisco

    2017-03-30

    The removal of three emerging contaminants (ECs) (amitriptyline hydrochloride (AH), methyl salicylate (MS) and 2-phenoxyethanol (PE)) dissolved in several water matrices by means of their adsorption onto powdered activated carbon (PAC) and granular activated carbon (GAC) has been investigated. When dissolved in ultrapure water, adsorption of the ECs followed the trend of AH > MS > PE, with a positive effect of the adsorbent dose. According to the analysis of the adsorption isotherms and adsorption kinetics, PAC showed strongly higher adsorption efficiency in both capacity and velocity of the adsorption, in agreement with its higher mesoporosity. Equilibrium isotherm data were fitted by Langmuir and Freundlich models. Pseudo-second order kinetics modeled very successfully the adsorption process. Finally, the effect of the presence of dissolved organic matter (DOM) in the water matrices (ultrapure water, surface water and two effluents from wastewater treatment plants) on the adsorption of the selected ECs onto PAC was established, as well as its performance on the removal of water quality parameters. Results show a negative effect of the DOM content on the adsorption efficiency. Over 50% of organic matter was removed with high PAC doses, revealing that adsorption onto PAC is an effective technology to remove both micro-pollutants and DOM from water matrices.

  11. Study of the kinetics and the adsorption isotherm of cadmium(II) from aqueous solution using green algae (Ulva lactuca) biomass.

    PubMed

    Asnaoui, H; Laaziri, A; Khalis, M

    2015-01-01

    Batch experiments were conducted to study the adsorption of hazardous cadmium onto low-cost algae biomass in aqueous solution with respect to concentration of adsorbate, adsorbent dosage, contact time, solution pH and temperature. Langmuir and Freundlich adsorption models were applied to describe the equilibrium isotherms and the isotherm constants were determined. The activation energy of adsorption was also evaluated for the adsorption of cadmium onto Ulva lactuca biomass. Experimental data were tested in terms of biosorption kinetics using pseudo-first-order and pseudo-second-order kinetic models. The results showed that the biosorption processes of Cd(II) followed well pseudo-second-order kinetics. Langmuir and Freundlich models were applied to describe the biosorption isotherm of the metal ions by Ulva lactuca biomass. Langmuir model fitted the equilibrium data better than the Freundlich isotherm. The biosorption capacity of Ulva lactuca biomass for cadmium was found to be 3.02 mg/g at pH 5.60 min equilibrium time and 20 °C. The mean free energy which was calculated was 6.24 kJ/mol for Cd(II) biosorption, which shows that the adsorption is physical. The calculated thermodynamic parameters (ΔG0, ΔH0 and ΔS0) showed that the biosorption of Cd(II) onto Ulva lactuca biomass was feasible, spontaneous and exothermic under examined conditions. The results indicate that algae Ulva lactuca could be employed as a low-cost material for the removal of metal ions from aqueous solution.

  12. Nonlinear isotherm and kinetics of adsorption of copper from aqueous solutions on bentonite

    NASA Astrophysics Data System (ADS)

    Sadeghalvad, Bahareh; Khosravi, Sara; Azadmehr, Amir Reza

    2016-11-01

    Bentonite is one of the most significant of clay minerals that has been studied extensively due to its potential applications in removal of various environmental pollutants. This ability is related to its high ionic exchange capacity and high specific surface area. Copper is one of the important elements of non-ferrous metals found in industrial waste waters. In the present work, the removal of copper from aqueous solutions with Iranian bentonite (from Birjand area, southeastern Iran) used without any chemical pretreatment, was studied. The experimental results were fitted by adsorption isotherms equations with two or three parameters, which include Langmuir, Freundlich, Dubinin-Radushkevich (D-R), Redlich-Peterson, Khan, and Toth models. The best correlation coefficient ( r 2) is 0.9879 observed for Langmuir model, maximum adsorption capacity of bentonite was 55.71 mg/g. The first-order and pseudo-second-order kinetic equations were used to describe the kinetics of adsorption. The experimental data were well fitted by the pseudo-second-order kinetics.

  13. Adsorption of methylene blue onto poly(cyclotriphosphazene-co-4,4'-sulfonyldiphenol) nanotubes: kinetics, isotherm and thermodynamics analysis.

    PubMed

    Chen, Zhonghui; Zhang, Jianan; Fu, Jianwei; Wang, Minghuan; Wang, Xuzhe; Han, Runping; Xu, Qun

    2014-05-30

    Poly(cyclotriphosphazene-co-4,4'-sulfonyldiphenol) (PZS) nanotubes, an excellent adsorbent, were successfully synthesized by an in situ template method and used for the removal of methylene blue (MB) from aqueous solution. The morphology and structures of as-synthesized PZS nanotubes were characterized by scanning electron microscopy, transmission electron microscope, Fourier transform infrared spectroscopy and N2 adsorption/desorption isotherms. The effects of temperature, concentration, pH and contact time on MB adsorption were studied. It was favorable for adsorption under the condition of basic and high temperature. The pseudo-first-order, pseudo-second-order and intraparticle diffusion models were used to fit adsorption data in the kinetic studies. And results showed that the adsorption kinetics were more accurately described by the pseudo-second-order model. The equilibrium isotherms were conducted using Freundlich and Langmuir models. It has been demonstrated that the better agreement was Langmuir isotherm with correlation coefficient of 0.9933, equilibrium absorption capacity of 69.16mg/g and the corresponding contact time of 15min. Thermodynamic analyses showed that MB adsorption onto the PZS nanotubes was endothermic and spontaneous and it was also a physisorption process.

  14. Numerical determination of non-Langmuirian adsorption isotherms of ibuprofen enantiomers on Chiralcel OD column using ultraviolet-circular dichroism dual detector.

    PubMed

    Li, Hui; Jiang, Xiaoxiao; Xu, Wei; Chen, Yongtao; Yu, Weifang; Xu, Jin

    2016-02-26

    Competitive adsorption isotherm of ibuprofen enantiomers on Chiralcel OD stationary phase at 298K was determined by the application of inverse method. Transport dispersive (TD) chromatography model was used to describe mass balances of the enatiomers. Axial dispersion and mass transfer coefficients were estimated from a series of linear pulse experiments. It was found that the overloaded elution profile of total concentration of racemic ibuprofen cannot be satisfactorily fitted by substituting bi-Langmuir model, the most widely used isotherm model for enantiomers, into TD model and tuning the isotherm parameters. UV-CD dual detector setup was then applied to obtain the individual overloaded elution profiles of both enantiomers. The more informative experimental data revealed non-Langmuirian adsorption behavior of ibuprofen enantiomers on chiralcel OD stationary phase. Two analytical binary isotherm models, both accounting for adsorbate-adsorbate interactions and having the feature of inflection points, were then evaluated. A comparison between quadratic model and Moreau model showed that the former gives better fitting results. The six parameters involved in quadratic model were determined stepwisely. Three of them were first obtained by fitting overloaded elution profiles of S-ibuprofen. The other three were then acquired by fitting overloaded elution profiles of both enantiomers recorded by UV-CD dual detector for racemic ibuprofen. A further attempt was also made at reducing the number of quadratic model parameters.

  15. Characterizing size and porosity of hollow nanoparticles: SAXS, SANS, TEM, DLS, and adsorption isotherms compared.

    PubMed

    Chen, Zhi Hong; Kim, Chanhoi; Zeng, Xiang-bing; Hwang, Sun Hye; Jang, Jyongsik; Ungar, Goran

    2012-10-30

    A combination of experimental methods, including transmission and grazing incidence small-angle X-ray scattering (SAXS and GISAXS), small-angle neutron scattering (SANS), transmission electron microscopy (TEM), dynamic light scattering (DLS), and N(2) adsorption-desorption isotherms, was used to characterize SiO(2)/TiO(2) hollow nanoparticles (HNPs) of sizes between 25 and 100 nm. In the analysis of SAXS, SANS, and GISAXS data, the decoupling approximation and the Percus-Yevick structure factor approximation were used. Brunauer-Emmett-Teller, t-plot, and a spherical pore model based on Kelvin equation were applied in the treatment of N(2) isotherms. Extracted parameters from the scattering and TEM methods are the average outer and inner diameters and polydispersity. Good agreement was achieved between different methods for these extracted parameters. Merits, advantages, and disadvantages of the different methods are discussed. Furthermore, the combination of these methods provided us with information on the porosity of the shells of HNPs and the size of intrawall pores, which are critical to the applications of HNPs as drug delivery vehicles and catalyst supports.

  16. Adsorption isotherm studies of chromium (VI) from aqueous solutions using sol-gel hydrotalcite-like compounds.

    PubMed

    Ramos-Ramírez, Esthela; Ortega, Norma L Gutiérrez; Soto, Cesar A Contreras; Gutiérrez, Maria T Olguín

    2009-12-30

    In under-developed countries, industries such as paint and pigment manufacturing, leather tanning, chrome plating and textile processing, usually discharge effluents containing Cr(VI) and Cr(III) into municipal sanitary sewers. It has been reported that Cr(VI) acts as a powerful epithelial irritant and as a human carcinogen. In the present work, hydrotalcite-like compounds with a Mg/Al ratio=2 were synthesized by the sol-gel method. The hydrotalcite-like compounds and their corresponding thermally treated products were characterized by powder X-ray diffraction, infrared spectroscopy and N(2) adsorption. The hydrotalcite-like compounds and the heated solids were used as adsorbents for Cr(VI) in aqueous solutions. Adsorption isotherm studies of Cr(VI) from aqueous solution are described. The adsorbent capacity was determined using the Langmuir, Freundlich and Dubinin-Radushkevich adsorption isotherm models. The Cr(VI) adsorption isotherm data fit best to the Langmuir isotherm model. The maximum Cr(VI) uptake by hydrotalcite and the heated solids was determined using the Langmuir equation and was found to range between 26 and 29 mg Cr(VI)/g adsorbent.

  17. Predicting CH4 adsorption capacity of microporous carbon using N2 isotherm and a new analytical model

    USGS Publications Warehouse

    Sun, Jielun; Chen, S.; Rostam-Abadi, M.; Rood, M.J.

    1998-01-01

    A new analytical pore size distribution (PSD) model was developed to predict CH4 adsorption (storage) capacity of microporous adsorbent carbon. The model is based on a 3-D adsorption isotherm equation, derived from statistical mechanical principles. Least squares error minimization is used to solve the PSD without any pre-assumed distribution function. In comparison with several well-accepted analytical methods from the literature, this 3-D model offers relatively realistic PSD description for select reference materials, including activated carbon fibers. N2 and CH4 adsorption data were correlated using the 3-D model for commercial carbons BPL and AX-21. Predicted CH4 adsorption isotherms, based on N2 adsorption at 77 K, were in reasonable agreement with the experimental CH4 isotherms. Modeling results indicate that not all the pores contribute the same percentage Vm/Vs for CH4 storage due to different adsorbed CH4 densities. Pores near 8-9 A?? shows higher Vm/Vs on the equivalent volume basis than does larger pores.

  18. Heterogeneity of activated carbons in adsorption of phenols from aqueous solutions—Comparison of experimental isotherm data and simulation predictions

    NASA Astrophysics Data System (ADS)

    Podkościelny, P.; Nieszporek, K.

    2007-01-01

    Surface heterogeneity of activated carbons is usually characterized by adsorption energy distribution (AED) functions which can be estimated from the experimental adsorption isotherms by inverting integral equation. The experimental data of phenol adsorption from aqueous solution on activated carbons prepared from polyacrylonitrile (PAN) and polyethylene terephthalate (PET) have been taken from literature. AED functions for phenol adsorption, generated by application of regularization method have been verified. The Grand Canonical Monte Carlo (GCMC) simulation technique has been used as verification tool. The definitive stage of verification was comparison of experimental adsorption data and those obtained by utilization GCMC simulations. Necessary information for performing of simulations has been provided by parameters of AED functions calculated by regularization method.

  19. Optimizing available phosphorus in calcareous soils fertilized with diammonium phosphate and phosphoric acid using Freundlich adsorption isotherm.

    PubMed

    Naeem, Asif; Akhtar, Muhammad; Ahmad, Waqar

    2013-01-01

    In calcareous soils, phosphorus (P) retention and immobilization take place due to precipitation and adsorption. Since soil pH is considered a major soil variable affecting the P sorption, an acidic P fertilizer could result in low P adsorption compared to alkaline one. Therefore, P adsorption from DAP and phosphoric acid (PA) required to produce desired soil solution P concentration was estimated using Freundlich sorption isotherms. Two soils from Faisalabad and T. T. Singh districts were spiked with 0, 10, and 20 % CaCO3 for 15 days. Freundlich adsorption isotherms (P = aC(b/a)) were constructed, and theoretical doses of PA and DAP to develop a desired soil solution P level (i.e., 0.20 mg L(-1)) were calculated. It was observed that P adsorption in soil increased with CaCO3. Moreover, at all the levels of CaCO3, P adsorption from PA was lower compared to that from DAP in both the soils. Consequently, lesser quantity of PA was required to produce desired solution P, 0.2 mg L(-1), compared to DAP. However, extrapolating the developed relationship between soil CaCO3 contents and quantity of fertilizer to other similar textured soils needs confirmation.

  20. The Republic of the Philippines coalbed methane assessment: based on seventeen high pressure methane adsorption isotherms

    USGS Publications Warehouse

    Flores, Romeo M.; Stricker, Gary D.; Papasin, Ramon F.; Pendon, Ronaldo R.; del Rosario, Rogelio A.; Malapitan, Ruel T.; Pastor, Michael S.; Altomea, Elmer A.; Cuaresma, Federico; Malapitan, Armando S.; Mortos, Benjamin R.; Tilos, Elizabeth N.

    2006-01-01

    Introduction: The Republic of the Philippines has some 19 coal districts that contain coal deposits ranging from Eocene to Pleistocene in age. These coal districts include: (1) Catanduanes (Eocene); (2) Cebu, Zamboanga Sibuguey, Bukidnon, Maguindanao, Sarangani, and Surigao (Oligocene to Miocene); (3) Batan Island, Masbate, Semirara (including Mindoro), and Quezon-Polilio (lower-upper Miocene); (4) Davao, Negros, and Sorsogon (middle-upper Miocene); (5) Cotabato (lower Miocene-lower Pliocene), Cagayan-Isabella, and Quirino (upper Miocene-Pliocene); (6) Sultan Kudarat (upper Miocene-Pleistocene); and (7) Samar-Leyte (lower Pliocene-Pleistocene). In general, coal rank is directly related to the age of the deposits - for example, the Eocene coal is semi-anthracite and the Pliocene-Pleistocene coal is lignite. Total coal resources in these 19 coal districts, which are compiled by the Geothermal and Coal Resources Development Division (GCRDD) of the Department of Energy of the Philippines, are estimated at a minimum of 2,268.4 million metric tonnes (MMT) (approximately 2.3 billion metric tones). The largest resource (550 MMT) is the subbituminous coal in the Semirara (including Mindoro) coal district, and the smallest (0.7 MMT) is the lignite-subbituminous coal in the Quirino coal district. The combined lignite and subbituminous coal resources, using the classification by GCRDD and including Semirara and Surigao coal districts, are about 1,899.2 MMT, which make up about 84 percent of the total coal resources of the Philippines. The remaining resources are composed of bituminous and semi-anthracite coal. The subbituminous coal of Semirara Island in the Mindoro- Semirara coal district (fig. 2) is known to contain coalbed methane (CBM), with the coal being comparable in gas content and adsorption isotherms to the coal of the Paleocene Fort Union Formation in the Powder River Basin in Wyoming, USA (Flores and others, 2005). As a consequence, the presence of CBM in the

  1. Characterization of micro-mesoporous materials from nitrogen and toluene adsorption: experiment and modeling.

    PubMed

    Ravikovitch, Peter I; Vishnyakov, Aleksey; Neimark, Alexander V; Ribeiro Carrott, Manuela M L; Russo, Patrícia A; Carrott, Peter J

    2006-01-17

    Universal mechanisms of adsorption and capillary condensation of toluene and nitrogen on ordered MCM-41 and PHTS materials are studied by means of high-resolution experiments and Monte Carlo molecular simulations. A molecular simulation model of toluene adsorption in silica nanopores, which accounts for surface heterogeneity, and a hybrid molecular-macsroscopic method for pore size distribution (PSD) calculations have been developed. For a range of reference materials, the PSD results obtained from toluene isotherms are consistent with the results of nitrogen adsorption using the nonlocal density functional theory method.

  2. Theoretical study of the accuracy of the pulse method, frontal analysis, and frontal analysis by characteristic points for the determination of single component adsorption isotherms

    SciTech Connect

    Kaczmarski, Krzysztof; Guiochon, Georges A

    2009-01-01

    The adsorption isotherms of selected compounds are our main source of information on the mechanisms of adsorption processes. Thus, the selection of the methods used to determine adsorption isotherm data and to evaluate the errors made is critical. Three chromatographic methods were evaluated, frontal analysis (FA), frontal analysis by characteristic point (FACP), and the pulse or perturbation method (PM), and their accuracies were compared. Using the equilibrium-dispersive (ED) model of chromatography, breakthrough curves of single components were generated corresponding to three different adsorption isotherm models: the Langmuir, the bi-Langmuir, and the Moreau isotherms. For each breakthrough curve, the best conventional procedures of each method (FA, FACP, PM) were used to calculate the corresponding data point, using typical values of the parameters of each isotherm model, for four different values of the column efficiency (N = 500, 1000, 2000, and 10,000). Then, the data points were fitted to each isotherm model and the corresponding isotherm parameters were compared to those of the initial isotherm model. When isotherm data are derived with a chromatographic method, they may suffer from two types of errors: (1) the errors made in deriving the experimental data points from the chromatographic records; (2) the errors made in selecting an incorrect isotherm model and fitting to it the experimental data. Both errors decrease significantly with increasing column efficiency with FA and FACP, but not with PM.

  3. Adsorption kinetics, isotherms and thermodynamics of atrazine removal using a banana peel based sorbent.

    PubMed

    Chaparadza, Allen; Hossenlopp, Jeanne M

    2012-01-01

    Atrazine removal from water by treated banana peels was studied. The effect of pH, contact time, initial atrazine concentration, and temperature were investigated. Batch experiments demonstrated that 15 g L(-1) adsorbent dosage removed 90-99% of atrazine from 1-150 ppm aqueous solutions. The removal was both pH and temperature dependent with the most atrazine removed between pH 7 and 8.2 and increased with increasing temperature. Equilibrium data fitted well to the Langmuir and Redlich-Peterson models in the concentration and temperature ranges investigated, with a maximum adsorption capacity of 14 mg g(-1). Simple mass transfer models were applied to the experimental data to examine the adsorption mechanism and it was found that both external mass transfer and intraparticle diffusion played important roles in the adsorption mechanisms. The enthalpy of atrazine adsorption was evaluated to be 67.8 ± 6.3 kJ mol(-l) with a Gibbs free energy of -5.7 ± 1.2 kJ mol(-1).

  4. Preparation of Ag/TiO2-zeolite adsorbents, their desulfurization performance, and benzothiophene adsorption isotherms

    NASA Astrophysics Data System (ADS)

    Song, Hua; Yang, Gang; Song, Hua-Lin; Wang, Deng; Wang, Xue-Qin

    2017-02-01

    A series of Ag/TiO2-NaY (TY) composite adsorbents were successfully prepared and characterized by X-ray diffraction (XRD), Fourier transform infrared (FTIR) spectroscopy, BET, scanning electron microscopy (SEM) and X-ray photoelectron spectroscopy (XPS) techniques. The effects of TiO2 and Ag contents on the structure and desulfurization performance of NaY zeolite were studied. The results show that anatase phase is the main form of TiO2 in AgTY adsorbent, and the Y-zeolite framework remained unchanged. AgTY with 6 wt % of Ag and 50 wt % of TiO2 exhibited the best desulfurization performance with the effluent volume of 63.2 mL/g at 10 mg/L sulfur breakthrough level (desulfurization rate of 95%). The benzothiophene (BT) removal performance of the various adsorbents follows the order: NaY < TiO2 < TY-50 < AgTY-50-6. The equilibrium data were modeled by Langmuir and Freundlich equations. The Langmuir model can describe well the adsorption isotherms of BT over AgTY.

  5. Adsorption isotherms for hydrogen chloride (HCl) on ice surfaces between 190 and 220 K.

    PubMed

    Zimmermann, S; Kippenberger, M; Schuster, G; Crowley, J N

    2016-05-18

    The interaction of hydrogen chloride (HCl) with ice surfaces at temperatures between 190 and 220 K was investigated using a coated-wall flow-tube connected to a chemical ionization mass spectrometer. Equilibrium surface coverages of HCl were determined at gas phase concentrations as low as 2 × 10(9) molecules cm(-3) (∼4 × 10(-8) Torr at 200 K) to derive Langmuir adsorption isotherms. The data are described by a temperature independent partition coefficient: KLang = (3.7 ± 0.2) × 10(-11) cm(3) molecule(-1) with a saturation surface coverage Nmax = (2.0 ± 0.2) × 10(14) molecules cm(-2). The lack of a systematic dependence of KLang on temperature contrasts the behaviour of numerous trace gases which adsorb onto ice via hydrogen bonding and is most likely related to the ionization of HCl at the surface. The results are compared to previous laboratory studies, and the equilibrium partitioning of HCl to ice surfaces under conditions relevant to the atmosphere is evaluated.

  6. Development of an isothermal titration microcalorimetric system with digital control and dynamic power peltier compensation. II. Characterization and operation mode. Myoglobin adsorption onto polymeric latex particles

    NASA Astrophysics Data System (ADS)

    Velázquez-Campoy, A.; López-Mayorga, O.; Cabrerizo-Vílchez, M. A.

    2000-04-01

    In a previous article a comprehensive description of an isothermal titration microcalorimeter with Peltier compensation was reported. This work deals with the characterization procedure and the operation mode. The transfer function parameters (time constants, calibration constants, and thermal properties of the system components) have been determined using a rigorous physical model for the microcalorimeter. To check the good performance of the instrument, titration experiments of cytidine and adenosine protonation have been carried out. Finally, as an example of the instrument applicability, differential heat measurements of myoglobin adsorption onto polymeric (polystyrene) latex particles are presented.

  7. Ab initio prediction of adsorption isotherms for small molecules in metal-organic frameworks: the effect of lateral interactions for methane/CPO-27-Mg.

    PubMed

    Sillar, Kaido; Sauer, Joachim

    2012-11-07

    A hybrid method that combines density functional theory for periodic structures with wave function-based electron correlation methods for finite-size models of adsorption sites is employed to calculate energies for adsorption of CH(4) onto different sites in the metal-organic framework (MOF) CPO-27-Mg (Mg-MOF-74) with chemical accuracy. The adsorption energies for the Mg(2+), linker, second layer sites are -27.8, -18.3, and -15.1 kJ/mol. Adsorbate-adsorbate interactions increase the average CH(4) adsorption energy by about 10% (2.4 kJ/mol). The free rotor-harmonic oscillator-ideal gas model is applied to calculate free energies/equilibrium constants for adsorption on the individual sites. This information is used in a multisite Langmuir model, augmented with a Bragg-Williams model for lateral interactions, to calculate adsorption isotherms. This ab initio approach yields the contributions of the individual sites to the final isotherms and also of the lateral interactions that contribute about 15% to the maximum excess adsorption capacity. Isotherms are calculated for both absolute amounts, for calculation of isosteric heats of adsorption as function of coverage, and excess amounts, for comparison with measured isotherms. Agreement with observed excess isotherms is reached if the experimentally determined limited accessibility of adsorption sites (78%) is taken into account.

  8. Competitive adsorption and selectivity sequence of heavy metals by chicken bone-derived biochar: Batch and column experiment.

    PubMed

    Park, Jong-Hwan; Cho, Ju-Sik; Ok, Yong Sik; Kim, Seong-Heon; Kang, Se-Won; Choi, Ik-Won; Heo, Jong-Soo; DeLaune, Ronald D; Seo, Dong-Cheol

    2015-01-01

    The objective of this research was to evaluate adsorption of heavy metals in single- and ternary-metal forms onto chicken bone biochar (CBB). Competitive sorption of heavy metals by CBB has never been reported previously. The maximum adsorption capacities of metals by CBB were in the order of Cu (130 mg g(-1)) > Cd (109 mg g(-1)) > Zn (93 mg g(-1)) in the single-metal adsorption isotherm and Cu (108 mg g(-1)) > Cd (54 mg g(-1)) ≥ Zn (44 mg g(-1)) in the ternary-metal adsorption isotherm. Cu was the most retained cation, whereas Zn could be easily exchanged and substituted by Cu. Batch experimental data best fit the Langmuir model rather than the Freundlich isotherms. In the column experiments, the total adsorbed amounts of the metals were in the following order of Cu (210 mg g(-1)) > Cd (192 mg g(-1)) > Zn (178) in single-metal conditions, and Cu (156) > Cd (123) > Zn (92) in ternary-metal conditions. Results from both the batch and column experiments indicate that competitive adsorption among metals increases the mobility of these metals. Especially, Zn in single-metal conditions lost it adsorption capacity most significantly. Based on the 3D simulation graphs of heavy metals, adsorption patterns under single adsorption condition were different than under competitive adsorption condition. Results from both the batch and column experiments show that competitive adsorption among metals increases the mobility of these metals. The maximum metal adsorption capacity of the metals in the column experiments was higher than that in the batch experiment indicating other metal retention mechanisms rather than adsorption may be involved. Therefore, both column and batch experiments are needed for estimating retention capacities and removal efficiencies of metals in CBB.

  9. Effect of humic acid on the adsorption/desorption behavior of glyphosate on goethite. Isotherms and kinetics.

    PubMed

    Arroyave, Jeison Manuel; Waiman, Carolina C; Zanini, Graciela P; Avena, Marcelo J

    2016-02-01

    The effects of humic acid (HA) on the adsorption/desorption of glyphosate (Gly) on goethite were investigated under pseudo equilibrium conditions by adsorption isotherms and under kinetic conditions by ATR-FTIR spectroscopy. Isotherms reveal that the attachment of Gly is almost completely inhibited by HA molecules. The opposite effect is not observed: HA adsorption is not affected by the presence of Gly. ATR-FTIR allowed the simultaneous detection of adsorbed HA and Gly during kinetic runs, revealing that HA at the surface decreases markedly the adsorption rate of Gly likely as a result of a decreased availability of sites for Gly adsorption and because of electrostatic repulsion. In addition, HA in solution increases the desorption rate of Gly. The rate law for Gly desorption could be determined giving important insights on the desorption mechanism. The herbicide is desorbed by two parallel processes: i) a direct detachment from the surface, which is first order in adsorbed Gly; and ii) a ligand exchange with HA molecules, which is first order in adsorbed Gly and first order in dissolved HA. Rate constants for both processes were quantified, leading to half-lives of 3.7 h for the first process, and 1.4 h for the second process in a 400 mg L(-1) HA solution. These data are important for modeling the dynamics of glyphosate in environmentally relevant systems, such as soils and surface waters.

  10. Freundlich and Langmuir adsorption isotherms and kinetics for the removal of Tartrazine from aqueous solutions using hen feathers.

    PubMed

    Mittal, Alok; Kurup, Lisha; Mittal, Jyoti

    2007-07-19

    Tartrazine, a yellow menace, is widely being used in cosmetics, foodstuffs, medicines and textile. It is carcinogenic and also catalyzes allergic problems. In the present work the ability to remove Tartrazine from aqueous solutions has been studied using waste material-hen feathers, as adsorbent. Effects of pH, concentration of the dye, temperature and adsorbent dosage have been studied. Equilibrium isotherms for the adsorption of the dye were measured experimentally. Results were analyzed by the Freundlich and Langmuir equation at different temperatures and determined the characteristic parameters for each adsorption isotherm. The adsorption process has been found endothermic in nature and thermodynamic parameters, Gibb's free energy (DeltaG degrees), change in enthalpy (DeltaH degrees) and change in entropy (DeltaS degrees) have been calculated. The paper also includes results on the kinetic measurements of adsorption of the dye on hen feathers at different temperatures. By rate expression and treatment of data it has been established that the adsorption of Tartrazine over hen feathers follows a first-order kinetics and a film diffusion mechanism operates at all the temperatures.

  11. Effect of the endcapping of reversed-phase high-performance liquid chromatography adsorbents on the adsorption isotherm

    SciTech Connect

    Gritti, Fabrice; Guiochon, Georges A

    2005-09-01

    The retention mechanisms of n-propylbenzoate, 4-t ert-butylphenol, and caffeine on the endcapped Symmetry-C{sub 18} and the non-endcapped Resolve-C{sub 18} are compared. The adsorption isotherms were measured by frontal analysis (FA), using as the mobile phase mixtures of methanol or acetonitrile and water of various compositions. The isotherm data were modeled and the adsorption energy distributions calculated. The surface heterogeneity increases faster with decreasing methanol concentration on the non-endcapped than on the endcapped adsorbent. For instance, for methanol concentrations exceeding 30% (v/v), the adsorption of caffeine is accounted for by assuming three and two different types of adsorption sites on Resolve-C{sub 18} and Symmetry-C{sub 18}, respectively. This is explained by the effect of the mobile phase composition on the structure of the C{sub 18}-bonded layer. The bare surface of bonded silica appears more accessible to solute molecules at high water contents in the mobile phase. On the other hand, replacing methanol by a stronger organic modifier like acetonitrile dampens the differences between non-endcapped and endcapped stationary phase and decreases the degree of surface heterogeneity of the adsorbent. For instance, at acetonitrile concentrations exceeding 20%, the surface appears nearly homogeneous for the adsorption of caffeine.

  12. Kinetics and isothermal modeling of liquid phase adsorption of rhodamine B onto urea modified Raphia hookerie epicarp

    NASA Astrophysics Data System (ADS)

    Inyinbor, A. A.; Adekola, F. A.; Olatunji, G. A.

    2016-09-01

    Epicarp of Raphia hookerie, a bioresource material, was modified with urea (UMRH) to adsorb Rhodamine B (RhB) from aqueous solution. Adsorbent morphology and surface chemistry were established by Brunauer-Emmett-Teller (BET) surface area determination, Fourier transform infrared spectroscopic (FTIR) analysis, scanning electron microscopy (SEM), as well as the pH point of zero charge (pHpzc) determination. Prepared material was subsequently utilized for the uptake of Rhodamine B (RhB). Operational parameters, such as adsorbent dosage, concentration, time, and temperature, were investigated. Evidence of effective urea modification was confirmed by vivid absorption bands at 1670 and 1472 cm-1 corresponding to C=O and C-N stretching vibrations, respectively. Optimum adsorption was obtained at pH 3. Freundlich adsorption isotherm best fits the equilibrium adsorption data, while evidence of adsorbate-adsorbate interaction was revealed by Temkin isotherm model. The maximum monolayer adsorption capacity (q max) was 434.78 mg/g. Kinetics of the adsorption process was best described by the pseudo-second-order kinetics model. Desorption efficiency was less than or equal to 25 % for all the eluents, and it follows the order HCl > H2O > CH3COOH.

  13. Equilibrium adsorption isotherm studies of Cu (II) and Co (II) in high concentration aqueous solutions on Ag-TiO2-modified kaolinite ceramic adsorbents

    NASA Astrophysics Data System (ADS)

    Ajenifuja, E.; Ajao, J. A.; Ajayi, E. O. B.

    2016-03-01

    Photocatalytic ceramic adsorbents were prepared from locally sourced kaolinite clay minerals for the removal of copper and cobalt ions from high concentration aqueous solutions. The minerals were treated with mild acid before modification using silver nanoparticles sources and titanium-oxide nanoparticles. Batch adsorption experiment was carried out on the targeted ions and the results were analyzed by Langmuir and Freundlich equation at different concentrations (100-1000 mg/l). As-received raw materials do not exhibit any adsorption capacity. However, the adsorption isotherms for modified kaolinite clay ceramic adsorbents could be fitted well by the Langmuir model for Cu2+ and Co2+ with correlation coefficient (R) of up to 0.99705. The highest and lowest monolayer coverage (q max) were 93.023 and 30.497 mg/g for Cu2+ and Co2+, respectively. The separation factor (R L ) was less than one (<1), indicating that the adsorption of metal ions on modified ceramic adsorbent is favorable. The highest adsorbent adsorption capacity (K f ) and intensity (n) constants obtained from Freundlich model are 14.401 (Cu2+ on KLN-T) and 6.057 (Co2+ on KLN-T).

  14. Flight software development for the isothermal dendritic growth experiment

    NASA Technical Reports Server (NTRS)

    Levinson, Laurie H.; Winsa, Edward A.; Glicksman, Martin E.

    1989-01-01

    The Isothermal Dendritic Growth Experiment (IDGE) is a microgravity materials science experiment scheduled to fly in the cargo bay of the shuttle on the United States Microgravity Payload (USMP) carrier. The experiment will be operated by real-time control software which will not only monitor and control onboard experiment hardware, but will also communicate, via downlink data and uplink commands, with the Payload Operations Control Center (POCC) at NASA George C. Marshall Space Flight Center (MSFC). The software development approach being used to implement this system began with software functional requirements specification. This was accomplished using the Yourdon/DeMarco methodology as supplemented by the Ward/Mellor real-time extensions. The requirements specification in combination with software prototyping was then used to generate a detailed design consisting of structure charts, module prologues, and Program Design Language (PDL) specifications. This detailed design will next be used to code the software, followed finally by testing against the functional requirements. The result will be a modular real-time control software system with traceability through every phase of the development process.

  15. Adsorption of Cd(II) and Pb(II) by a novel EGTA-modified chitosan material: kinetics and isotherms.

    PubMed

    Zhao, Feiping; Repo, Eveliina; Yin, Dulin; Sillanpää, Mika E T

    2013-11-01

    In this study, a novel adsorbent was synthesized by functionalizing chitosan with ethylene glycol-bis(2-aminoethylether)-N,N,N',N'-tetraacetic acid (EGTA) ligands. The adsorption capability of EGTA-modified chitosan was investigated by the removal of Cd(II) and Pb(II) from aqueous solutions. The adsorption and regeneration studies were performed by batch techniques. The effects of pH, contact time, and initial metal concentration were studied. Metal uptake by EGTA-chitosan was 0.74 mmol g(-1) for Cd(II) and 0.50 mmol g(-1) for Pb(II). The adsorption mechanism, that the adsorbent formed octahedral chelate structures with bivalent metal ions, was proposed tentatively based on the experimental results of FTIR and the theoretically calculated data of point charges. The kinetics of Cd(II) and Pb(II) on EGTA-chitosan complied with the pseudo-second-order model and the adsorption rate was also influenced by intra-particle diffusion. BiLangmuir isotherm model was well fitted to the experimental data of one-component adsorption suggesting the surface heterogeneity of the novel adsorbent. The extended form of the BiLangmuir model was tested for the modeling of two-component adsorption equilibrium of Cd(II) and Pb(II) on EGTA-chitosan. In the two-component solution, both competitive adsorption and positive synergy of chelation between metal ions occurred and the novel adsorbent showed higher affinity toward Cd(II).

  16. Kinetic and isotherm error optimization studies for adsorption of atrazine and imidacloprid on bark of Eucalyptus tereticornis L.

    PubMed

    Mandal, Abhishek; Singh, Neera

    2016-01-01

    The aim of this study was to establish the bark of Eucalyptus tereticornis L. (EB) as a low cost bio-adsorbent for the removal of imidacloprid and atrazine from aqueous medium. The pseudo-first-order (PFO), pseudo-second-order (PSO), Elovich and intra-particle diffusion (IPD) models were used to describe the kinetic data and rate constants were evaluated. Adsorption data was analysed using ten 2-, 3- and 4-parameter models viz. Freundlich, Jovanovic, Langmuir, Temkin, Koble-Corrigan, Redlich-Peterson, Sips, Toth, Radke-Prausnitz, and Fritz-Schluender isotherms. Six error functions were used to compute the best fit single component isotherm parameters by nonlinear regression analysis. The results showed that the sorption of atrazine was better explained by PSO model, whereas the sorption of imidacloprid followed the PFO kinetic model. Isotherm model optimization analysis suggested that the Freundlich along with Koble-Corrigan, Toth and Fritz-Schluender were the best models to predict atrazine and imidacloprid adsorption onto EB. Error analysis suggested that minimization of chi-square (χ(2)) error function provided the best determination of optimum parameter sets for all the isotherms.

  17. Temperature dependence of adsorption of PEGylated lysozyme and pure polyethylene glycol on a hydrophobic resin: comparison of isothermal titration calorimetry and van't Hoff data.

    PubMed

    Werner, Albert; Hackemann, Eva; Hasse, Hans

    2014-08-22

    The influence of temperature on the adsorption of PEGylated lysozyme and pure PEG on Toyopearl PPG-600M, a hydrophobic resin, is studied by batch equilibrium measurements and pulse response experiments. Differently PEGylated lysozymes are used for the studies, enabling a systematic variation of the solute properties. Either ammonium sulfate or sodium chloride are added. The enthalpy of adsorption is calculated from a van't Hoff analysis based on these data. It is also directly measured by Isothermal Titration Calorimetry. In the investigated temperature range from 5 °C to 35 °C adsorption is favored by higher temperatures and hence endothermic. The results of the van't Hoff analysis of the equilibrium and the pulse response data agree well. Discrepancies between enthalpies of adsorption obtained by calorimetry and van't Hoff analysis are found and discussed. We conclude that the most likely explanation is that thermodynamic equilibrium is not reached in the experiments even though they were carried out carefully and in the generally accepted way.

  18. Surface heterogeneity of passively oxidized silicon carbide particles: vapor adsorption isotherms.

    PubMed

    Médout-Marère, V; Partyka, S; Dutartre, R; Chauveteau, G; Douillard, J M

    2003-06-15

    The surfaces of silicon carbide particles subjected to two different passive oxidation treatments have been characterized by immersion calorimetry and vapor adsorption techniques. Surface enthalpies and surface free energies have been computed using semiempirical models and are compared to theoretical estimations. The surface entropy term appears higher than in the case of other solids studied with the same analysis. The definition of the surface entropy term is discussed in order to explain the discrepancy between calculation and experiment. An explanation of results is proposed, which is related to the constitution of silicon oxide layers at the surface of silicon carbide, a fact demonstrated by previous XPS measurements.

  19. Differential heat of adsorption of water vapor on silicified microcrystalline cellulose (SMCC): an investigation using isothermal microcalorimetry.

    PubMed

    Qian, Ken K; Bogner, Robin H

    2011-01-01

    A novel dual-shaft configuration in isothermal microcalorimetry was developed to study the interaction of water vapor with pharmaceutical excipients. An instrument performance test is suggested to validate the experimental data. Reliable experimental results can be collected using a single perfusion shaft; however, there was limitation of the dual-shaft configuration, which resulted deviation in the experimental results. A periodic performance test is recommended. Silicified microcrystalline cellulose (SMCC) was used as a model system to study the interaction using the dual-shaft method. Enthalpy of water vapor adsorption on SMCC was determined and compared to literature data. The data collected using the dual-shaft configuration did not reflect the actual physical system. The deviation was most likely due to the lack of flow control caused by viscous resistance. The enthalpy of adsorption was then calculated using isothermal microcalorimetry coupled with a dynamic vapor sorption apparatus. The results, -55 kJ/mol at low relative humidity (RH) to -22 kJ/mol at high RH, were consistent with the physical phenomenon of water vapor adsorption. Enthalpy of adsorption showed surface heterogeneity of SMCC and suggested multilayer condensation of water at approximately 60% RH. However, at high RH, the results showed the moisture-excipient interaction can be more complex than the proposed mechanism.

  20. Experiences of fitting isotherms to data from batch sorption experiments for radionuclides on tuffs

    SciTech Connect

    Polzer, W.L.; Fuentes, H.R.

    1989-11-01

    Laboratory experiments have been performed on the sorption of radionuclides on tuff as site characterization information for the Yucca Mountain Project. This paper presents general observations on the results of curve-fitting of sorption data by isotherm equations and the effects of experimental variables on their regressional analysis. Observations are specific to the effectiveness and problems associated with fitting isotherms, the calculation and value of isotherm parameters, and the significance of experimental variables such as replication, particle size, mode of sorption, and mineralogy. These observations are important in the design of laboratory experiments to ensure that collected data are adequate for effectively characterizing sorption of radionuclides on tuffs or other materials. 13 refs., 2 figs., 4 tabs.

  1. Kinetics and isotherm analysis of Tropaeoline 000 adsorption onto unsaturated polyester resin (UPR): a non-carbon adsorbent.

    PubMed

    Jain, Rajeev; Sharma, Pooja; Sikarwar, Shalini

    2013-03-01

    The presence of dyes in water is undesirable due to the toxicological impact of their entrance into the food chain. Owing to the recalcitrant nature of dyes to biological oxidation, a tertiary treatment like adsorption is required. In the present study, unsaturated polyester resin (UPR) has been used as a sorbent in the treatment of dye-contaminated water. Different concentrations of Tropaeoline 000 containing water were treated with UPR. The preliminary investigations were carried out by batch adsorption to examine the effects of pH, adsorbate concentration, adsorbent dosage, contact time, and temperature. A plausible mechanism for the ongoing adsorption process and thermodynamic parameters have also been obtained from Langmuir and Freundlich adsorption isotherm models. Thermodynamic parameter showed that the sorption process of Tropaeoline 000 onto activated carbon (AC) and UPR were feasible, spontaneous, and endothermic under studied conditions. The estimated values for (ΔG) are -10.48 × 10(3) and -6.098 × 10(3) kJ mol(-1) over AC and UPR at 303 K (30 °C), indicating towards a spontaneous process. The adsorption process followed pseudo-first-order model. The mass transfer property of the sorption process was studied using Lagergren pseudo-first-order kinetic models. The values of % removal and k (ad) for dye systems were calculated at different temperatures (303-323 K). The mechanism of the adsorption process was determined from the intraparticle diffusion model.

  2. Activated carbon derived from carbon residue from biomass gasification and its application for dye adsorption: Kinetics, isotherms and thermodynamic studies.

    PubMed

    Maneerung, Thawatchai; Liew, Johan; Dai, Yanjun; Kawi, Sibudjing; Chong, Clive; Wang, Chi-Hwa

    2016-01-01

    In this work, activated carbon (AC) as an effective and low-cost adsorbent was successfully prepared from carbon residue (or char, one of the by-products from woody biomass gasification) via physical activation. The surface area of char was significantly increased from 172.24 to 776.46m(2)/g after steam activation at 900°C. The obtained activated carbons were then employed for the adsorption of dye (Rhodamine B) and it was found that activated carbon obtained from steam activation exhibited the highest adsorption capability, which is mainly attributed to the higher surface area and the abundance of hydroxyl (-OH) and carboxyl (-COOH) groups on the activated carbon surface. Moreover, it was also found that the adsorption capability significantly increased under the basic condition, which can be attributed to the increased electrostatic interaction between the deprotonated (negatively charged) activated carbon and dye molecules. Furthermore, the equilibrium data were fitted into different adsorption isotherms and found to fit well with Langmuir model (indicating that dye molecules form monolayer coverage on activated carbon) with a maximum monolayer adsorption capability of 189.83mg/g, whereas the adsorption kinetics followed the pseudo-second-order kinetics.

  3. Isotherm and thermodynamic studies of Zn (II) adsorption on lignite and coconut shell-based activated carbon fiber.

    PubMed

    Shrestha, Sohan; Son, Guntae; Lee, Seung Hwan; Lee, Tae Gwan

    2013-08-01

    The Zn (II) adsorption capacity of lignite and coconut shell-based activated carbon fiber (ACF) was evaluated as a function of initial Zn (II) concentration, temperature and contact time in batch adsorption process in this study. Adsorption uptake increased with initial Zn (II) concentration and temperature. Optimal contact time for the adsorption of Zn (II) ions onto lignite and coconut shell-based ACF was found to be 50 min. Removal percentage decreased from 88.0% to 78.54% with the increment in initial Zn (II) concentration from 5 to 50 mg L(-1). Equilibrium data fit well with Langmuir-I isotherm indicating homogeneous monolayer coverage of Zn (II) ions on the adsorbent surface. Maximum monolayer adsorption capacity of Zn (II) ions on ACF was found to be 9.43 mg g(-1). Surface morphology and functionality of ACF prior to and after adsorption were characterized by electron microscopy and infrared spectroscopy. Various thermodynamic parameters such as standard Gibbs free energy (ΔG°), standard enthalpy (ΔH°), and standard entropy (ΔS°) were evaluated.

  4. Kinetic and isotherm modeling of Cd (II) adsorption by L-cysteine functionalized multi-walled carbon nanotubes as adsorbent.

    PubMed

    Taghavi, Mahmoud; Zazouli, Mohammad Ali; Yousefi, Zabihollah; Akbari-adergani, Behrouz

    2015-11-01

    In this study, multi-walled carbon nanotubes were functionalized by L-cysteine to show the kinetic and isotherm modeling of Cd (II) ions onto L-cysteine functionalized multi-walled carbon nanotubes. The adsorption behavior of Cd (II) ion was studied by varying parameters including dose of L-MWCNTs, contact time, and cadmium concentration. Equilibrium adsorption isotherms and kinetics were also investigated based on Cd (II) adsorption tests. The results showed that an increase in contact time and adsorbent dosage resulted in increase of the adsorption rate. The optimum condition of the Cd (II) removal process was found at pH=7.0, 15 mg/L L-MWCNTs dosage, 6 mg/L cadmium concentration, and contact time of 60 min. The removal percent was equal to 89.56 at optimum condition. Langmuir and Freundlich models were employed to analyze the experimental data. The data showed well fitting with the Langmuir model (R2=0.994) with q max of 43.47 mg/g. Analyzing the kinetic data by the pseudo-first-order and pseudo-second-order equations revealed that the adsorption of cadmium using L-MWSNTs following the pseudo-second-order kinetic model with correlation coefficients (R2) equals to 0.998, 0.992, and 0.998 for 3, 6, and 9 mg/L Cd (II) concentrations, respectively. The experimental data fitted very well with the pseudo-second-order. Overall, treatment of polluted solution to Cd (II) by adsorption process using L-MWCNT can be considered as an effective technology.

  5. Adsorption of probe molecules in pillared interlayered clays: Experiment and computer simulation

    SciTech Connect

    Gallardo, A. Guil, J. M.; Lomba, E.; Almarza, N. G.; Khatib, S. J.; Cabrillo, C.; Sanz, A.; Pires, J.

    2014-06-14

    In this paper we investigate the adsorption of various probe molecules in order to characterize the porous structure of a series of pillared interlayered clays (PILC). To that aim, volumetric and microcalorimetric adsorption experiments were performed on various Zr PILC samples using nitrogen, toluene, and mesitylene as probe molecules. For one of the samples, neutron scattering experiments were also performed using toluene as adsorbate. Various structural models are proposed and tested by means of a comprehensive computer simulation study, using both geometric and percolation analysis in combination with Grand Canonical Monte Carlo simulations in order to model the volumetric and microcalorimetric isotherms. On the basis of this analysis, we propose a series of structural models that aim at accounting for the adsorption experimental behavior, and make possible a microscopic interpretation of the role played by the different interactions and steric effects in the adsorption processes in these rather complex disordered microporous systems.

  6. Investigation of adsorption kinetics and isotherm of cellulase and B-Glucosidase on lignocellulosic substrates

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Clear understanding of enzyme adsorption during enzymatic hydrolysis of lignocellulosic biomass is essential to enhance the cost-efficiency of hydrolysis. However, conclusions from literatures often contradicted each other because enzyme adsorption is enzyme, biomass/pretreatment and experimental co...

  7. Adsorption laboratory experiment for undergraduate chemical engineering: Introducing kinetic, equilibrium and thermodynamic concepts

    NASA Astrophysics Data System (ADS)

    Muryanto, S.; Djatmiko Hadi, S.

    2016-11-01

    Adsorption laboratory experiment for undergraduate chemical engineering program is discussed. The experiment demonstrated adsorption of copper ions commonly found in wastewater using bio-sorbent, i.e. agricultural wastes. The adsorption was performed in a batch mode under various parameters: adsorption time (up to 120 min), initial pH (2 to 6), adsorbent dose (2.0 to 12.0 g L-1), adsorbent size (50 to 170 mesh), initial Cu2+ concentration (25 to 100 ppm) and temperatures (room temp to 40°C). The equilibrium and kinetic data of the experiments were calculated using the two commonly used isotherms: Langmuir and Lagergren pseudo-first-order kinetics. The maximum adsorption capacity for Cu2+ was found as 94.34 mg g-1. Thermodynamically, the adsorption process was spontaneous and endothermic. The calculated activation energy for the adsorption was observed as high as 127.94 kJ mol-1. Pedagogically, the experiment was assumed to be important in increasing student understanding of kinetic, equilibrium and thermodynamic concepts.

  8. Freundlich adsorption isotherms of agricultural by-product-based powdered activated carbons in a geosmin-water system.

    PubMed

    Ng, Chilton; Losso, Jack N; Marshall, Wayne E; Rao, Ramu M

    2002-11-01

    The present study was designed to model the adsorption of geosmin from water under laboratory conditions using the Freundlich isotherm model. This model was used to compare the efficiency of sugarcane bagasse and pecan shell-based powdered activated carbon to the efficiency of a coal-based commercial activated carbon (Calgon Filtrasorb 400). When data were generated from Freundlich isotherms, Calgon Filtrasorb 400 had greater geosmin adsorption at all geosmin concentrations studied than the laboratory produced steam-activated pecan shell carbon, steam-activated bagasse carbon, and the CO2-activated pecan shell carbon. At geosmin concentrations < 0.07 microg/l for the phosphoric acid-activated pecan shell carbon and below 0.08 microg/l for a commercially produced steam-activated pecan shell carbon obtained from Scientific Carbons, these two carbons had a higher calculated geosmin adsorption than Filtrasorb 400. While the commercial carbon was more efficient than some laboratory prepared carbons at most geosmin concentrations, the results indicate that when the amount of geosmin was below the threshold level of human taste (about 0.10 microg/l), the phosphoric acid-activated pecan shell carbon and the Scientific Carbons sample were more efficient than Filtrasorb 400 at geosmin removal.

  9. Kinetics and isotherm studies of Cd(II) adsorption from aqueous solution utilizing seeds of bottlebrush plant ( Callistemon chisholmii)

    NASA Astrophysics Data System (ADS)

    Rao, Rifaqat Ali Khan; Kashifuddin, Mohammad

    2014-12-01

    Seeds of bottlebrush, a novel plant material, were found to exhibit excellent adsorption capacity over a wide range of Cd(II) concentration. It was characterized by Fourier transform infrared spectroscopy and Scanning Electron Microscopy to support the adsorption of Cd(II) ions. Effect of various parameters like pH, contact time, initial concentration and different electrolytes was investigated using batch process to optimize conditions for maximum adsorption. The adsorbent data were analyzed using Langmuir, Freundlich, Temkin and Dubinin-Redushkeuich isotherm equations at 30°, 40° and 50 °C. Thermodynamic parameters such as standard enthalpy change (Δ H°), free energy change (Δ G°) and entropy change (Δ S°) were also evaluated and the results indicated that adsorption of Cd(II) are spontaneous and endothermic. Various kinetics models including the Pseudo-first-order kinetics, Pseudo-second-order kinetics and Intraparticle diffusion models have been applied to the experimental data to predict the adsorption kinetics. Kinetic study was carried out by varying initial concentration of Cd(II) at constant temperature and it was found that pseudo-second-order rate equation was better obeyed than pseudo-first-order equation supporting that chemisorption process was involved.

  10. Liquid phase adsorptions of Rhodamine B dye onto raw and chitosan supported mesoporous adsorbents: isotherms and kinetics studies

    NASA Astrophysics Data System (ADS)

    Inyinbor, A. A.; Adekola, F. A.; Olatunji, G. A.

    2016-04-01

    Irvingia gabonensis endocarp waste was charred (DNc) and subsequently coated with chitosan (CCDNc). Physicochemical characteristics of the two adsorbents were established, while Fourier transform infrared (FTIR), Scanning electron microscopy (SEM) and Brunauer-Emmett-Teller (BET) surface area methods were further employed for characterization. Efficiencies of the prepared adsorbents in the uptake of Rhodamine B (RhB) from aqueous effluent were investigated and adsorption data were tested using four isotherms and four kinetics models. The BET surface areas of the prepared adsorbent were 0.0092 and 4.99 m2/g for DNc and CCDNc, respectively, and maximum adsorption was recorded at pH between 3 and 4, respectively. While monolayer adsorption dominates the uptake of RhB onto DNc, uptake of RhB onto CCDNc was onto heterogeneous surface. The maximum monolayer adsorption capacities (q max) obtained from the Langmuir equation are 52.90 and 217.39 mg/g for DNc and CCDNc, respectively. Pseudo second order and Elovich kinetic models well described the kinetics of the two adsorption processes. The mean sorption energy (E) calculated from the D-R model and desorption efficiencies suggests that while the uptake of RhB onto DNc was physical in nature, for RhB-CCDNc system chemisorption dominates.

  11. Water adsorption isotherms and hydration forces for lysolipids and diacyl phospholipids.

    PubMed Central

    Marsh, D.

    1989-01-01

    The repulsive forces in a wide range of diacyl and monoacyl phospholipid systems have been obtained from the adsorption isotherms for water. From the exponential dependence of the repulsive pressure on the water content, information has been deduced regarding the hydration force. For diacyl phosphatidylcholines the strength of the hydration force and its characteristic decay length are in good agreement with values previously obtained by x-ray diffraction methods. For natural and synthetic diacyl phosphatidylcholines in the fluid lamellar phase, the hydration force extrapolated to zero layer separation (Po) is in the range 4-5.10(8) N.m-2 and the decay length is approximately 0.3 nm. The results for dimyristoyl, dipalmitoyl, and distearoyl phosphatidylcholines in the gel phase are very similar with Po approximately 2.5.10(8) N.m-2 and decay length of approximately 0.2 nm. Egg monomethyl phosphatidylethanolamine is less strongly hydrated: Po = 2.3.10(9) N.m-2, with a decay length of 0.3 nm. Egg phosphatidylethanolamine and bovine phosphatidylserine hydrate even more weakly with Po approximately 1.3.10(8) N.m-2 and decay length of approximately 0.15 nm. Mixtures with cholesterol or phosphatidylcholine increase both Po and the decay length for phosphatidylethanolamine to values closer to those for phosphatidylcholine. The repulsive forces deduced for egg lysophosphatidylcholine at 40 degrees C display a biphasic water dependence, with the low water phase being similar to lamellar egg phosphatidylcholine, and the phase at higher water content having a smaller value of Po = 2.10(8) N.m-2 but a longer decay length of approximately 0.45 nm, corresponding to a nonlamellar configuration. Bovine lysophosphatidylserine similarly yields values of PO = 1.2.108 N.m-2 and an effective decay length of 0.64 nm. The hydration behavior of the various diacyl phospholipids has been interpreted in terms of the mean-field molecular force theory of lipid hydration, and values deduced for

  12. Adsorption Isotherms: North Caroline Apatite Induced Precipitation of Lead, Zinc, Manganese, and Cadmium from the Bunker Hill 4000 Soil

    DTIC Science & Technology

    1995-05-01

    Using the MINTEQ -A2 geochemical model, thermodynamic predictions for ^f0™«0™0? pyromorphytes (Pb5(POJ3 (OH, Cl)), hopeite (Zn3(POJ2 4H20...VERIFICATION OF PRECIPITATED METALS USING MINTEQ -A2 13 2.3.1 Experimental 2.3.2 Results ... 19 3.0 CONCLUSIONS 20 4.0...precipitated Pb-P04 complexes will be illustrated as sharp downward deviations from linearity of the adsorption isotherms, as predicted by MINTEQ -A2

  13. Determination of adsorption isotherm parameters for minor whey proteins by gradient elution preparative liquid chromatography.

    PubMed

    Faraji, Naeimeh; Zhang, Yan; Ray, Ajay K

    2015-09-18

    Ion-Exchange Chromatography (IEC) techniques have been extensively investigated in protein purification processes, due to the more selective and milder separation steps. To date, existing studies of minor whey proteins fractionation in IEC have primarily been conducted as batch uptake studies, which require more experimental search space, time and materials. In this work, the selected resin's (SP Sepharose FF) equilibrium and dynamic binding capacity were first investigated. Next, adsorption of the pure binary mixture of lactoperoxidase and lactoferrin was studied to calibrate steric mass action (SMA) model using a simplified approach with data from single column experiments. The calibrated model was then verified by performing factorial-design based experiments for various process operating conditions assessing process performance on a larger bed height column. The model predicted results demonstrated a realistic agreement with the experiments providing reproducible column elution profile and reduced experimental work. Finally, whey protein isolate was used to evaluate model parameters in real conditions. Results obtained herein are suitable for future large scale applications.

  14. Using Compression Isotherms of Phospholipid Monolayers to Explore Critical Phenomena: A Biophysical Chemistry Experiment

    ERIC Educational Resources Information Center

    Gragson, Derek E.; Beaman, Dan; Porter, Rhiannon

    2008-01-01

    Two experiments are described in which students explore phase transitions and critical phenomena by obtaining compression isotherms of phospholipid monolayers using a Langmuir trough. Through relatively simple analysis of their data students gain a better understanding of compression isotherms, the application of the Clapeyron equation, the…

  15. Adsorption of HMF from water/DMSO solutions onto hydrophobic zeolites: experiment and simulation.

    PubMed

    Xiong, Ruichang; León, Marta; Nikolakis, Vladimiros; Sandler, Stanley I; Vlachos, Dionisios G

    2014-01-01

    The adsorption of 5-hydroxymethylfurfural (HMF), DMSO, and water from binary and ternary mixtures in hydrophobic silicalite-1 and dealuminated Y (DAY) zeolites at ambient conditions was studied by experiments and molecular modeling. HMF and DMSO adsorption isotherms were measured and compared to those calculated using a combination of grand canonical Monte Carlo and expanded ensemble (GCMC-EE) simulations. A method based on GCMC-EE simulations for dilute solutions combined with the Redlich-Kister (RK) expansion (GCMC-EE-RK) is introduced to calculate the isotherms over a wide range of concentrations. The simulations, using literature force fields, are in reasonable agreement with experimental data. In HMF/water binary mixtures, large-pore hydrophobic zeolites are much more effective for HMF adsorption but less selective because large pores allow water adsorption because of H2 O-HMF attraction. In ternary HMF/DMSO/water mixtures, HMF loading decreases with increasing DMSO fraction, rendering the separation of HMF from water/DMSO mixtures by adsorption difficult. The ratio of the energetic interaction in the zeolite to the solvation free energy is a key factor in controlling separation from liquid mixtures. Overall, our findings could have an impact on the separation and catalytic conversion of HMF and the rational design of nanoporous adsorbents for liquid-phase separations in biomass processing.

  16. Testing isotherm models and recovering empirical relationships for adsorption in microporous carbons using virtual carbon models and grand canonical Monte Carlo simulations

    NASA Astrophysics Data System (ADS)

    Terzyk, Artur P.; Furmaniak, Sylwester; Gauden, Piotr A.; Harris, Peter J. F.; Włoch, Jerzy

    2008-09-01

    Using the plausible model of activated carbon proposed by Harris and co-workers and grand canonical Monte Carlo simulations, we study the applicability of standard methods for describing adsorption data on microporous carbons widely used in adsorption science. Two carbon structures are studied, one with a small distribution of micropores in the range up to 1 nm, and the other with micropores covering a wide range of porosity. For both structures, adsorption isotherms of noble gases (from Ne to Xe), carbon tetrachloride and benzene are simulated. The data obtained are considered in terms of Dubinin-Radushkevich plots. Moreover, for benzene and carbon tetrachloride the temperature invariance of the characteristic curve is also studied. We show that using simulated data some empirical relationships obtained from experiment can be successfully recovered. Next we test the applicability of Dubinin's related models including the Dubinin-Izotova, Dubinin-Radushkevich-Stoeckli, and Jaroniec-Choma equations. The results obtained demonstrate the limits and applications of the models studied in the field of carbon porosity characterization.

  17. Description of Chemically and Thermally Treated Multi-Walled Carbon Nanotubes Using Sequential Decomposition of Adsorption Isotherms

    NASA Astrophysics Data System (ADS)

    Albesa, Alberto G.; Rafti, Matías; Vicente, José Luis

    2016-03-01

    The effect of wet acid oxidation by means of sulfuric/nitric acid mixtures, and high-temperature treatment of commercial arc-discharge synthesized multi-walled carbon nanotubes (MWCNTs) was studied. In order to analyze the adsorption capacities of differently treated MWCNTs, we employed a multistep method that considers separately different pressure ranges (zones) on the experimentally obtained isotherms. The method is based on simple gas isotherm measurements (N2, CO2, CH4, etc.). Low pressure ranges can be described using Dubinin’s model, while high pressure regimes can be fitted using different models such as BET multilayer and Freundlich equations. This analysis allows to elucidate how different substrate treatments (chemical and thermal) can affect the adsorbate-adsorbent interactions; moreover, theoretical description of adsorbate-adsorbate interactions can be improved if a combination of adsorption mechanisms are used instead of a unique model. The results hereby presented also show that, while MWCNTs are a promising material for storage applications, gas separation applications should carefully consider the effect of wide nanotube size distribution present on samples after activation procedures.

  18. Adsorption isotherms of some alkyl aromatic hydrocarbons and surface energies on partially dealuminated Y faujasite zeolite by inverse gas chromatography.

    PubMed

    Kondor, Anett; Dallos, András

    2014-10-03

    Adsorption isotherm data of some alkyl aromatic hydrocarbons (benzene, toluene, ethylbenzene, o-xylene, m-xylene and p-xylene) measured in the temperature range of 423-523K on a partially dealuminated faujasite type DAY F20 zeolite by inverse gas chromatography are presented in this work. The temperature dependent form of Tóth's equation has been fitted to the multiple temperature adsorption isotherms of benzene, toluene, ethylbenzene, o-xylene, m-xylene and p-xylene with standard deviations of 4.6, 5.0, 5.9, 4.3, 5.1 and 6.3mmolkg(-1) and coefficients of determinations (r(2)) of 0.977, 0.971, 0.974, 0.975, 0.991 and 0.991, respectively. The gas-solid equilibria and modeling were interpreted on the basis of the interfacial properties of the zeolite, by dispersive, specific and total surface energy heterogeneity profiles and distributions of the adsorbent measured by surface energy analysis.

  19. Adsorption isotherms, kinetics and thermodynamic studies towards understanding the interaction between cross-linked alginate-guar gum matrix and chymotrypsin.

    PubMed

    Woitovich Valetti, Nadia; Picó, Guillermo

    2016-02-15

    The adsorption kinetics of chymotrypsin, a pancreatic serine protease, onto an alginate-gum guar matrix cross-linked with epichlorohydrin has been performed using a batch-adsorption technique. The effect of various experimental parameters such as pH, salt presence, contact time and temperature were investigated. The pseudo-first-order and pseudo-second-order kinetic models were used to describe the kinetic data which shows that the adsorption of the enzyme followed the pseudo-second-order rate expression. The Langmuir, Freundlich and Hill adsorption isotherm models were applied to describe the equilibrium isotherms, and the isotherm constants were determined. It was found that Hill model was more suitable for our data because the isotherm data showed a sigmoidal behavior with the free enzyme concentration increasing in equilibrium. At 8°C and at pH 5.0, 1g hydrate matrix adsorbed about 7mg of chymotrypsin. In the desorption process 80% of the biological activity of chymotrypsin was recovered under the condition of 50mM phosphate buffer, pH 7.00-500mM NaCl. When successive cycles of adsorption/washing/desorption were performed, it was observed that the matrix remained functional until the fourth cycle of repeated batch enzyme adsorption. These results are important in terms of diminishing of cost and waste generation.

  20. Self-assembly in Nafion membranes upon hydration: water mobility and adsorption isotherms.

    PubMed

    Vishnyakov, Aleksey; Neimark, Alexander V

    2014-09-25

    By means of dissipative particle dynamics (DPD) and Monte Carlo (MC) simulations, we explored geometrical, transport, and sorption properties of hydrated Nafion-type polyelectrolyte membranes. Composed of a perfluorinated backbone with sulfonate side chains, Nafion self-assembles upon hydration and segregates into interpenetrating hydrophilic and hydrophobic subphases. This segregated morphology determines the transport properties of Nafion membranes that are widely used as compartment separators in fuel cells and other electrochemical devices, as well as permselective diffusion barriers in protective fabrics. We introduced a coarse-grained model of Nafion, which accounts explicitly for polymer rigidity and electrostatic interactions between anionic side chains and hydrated metal cations. In a series of DPD simulations with increasing content of water, a classical percolation transition from a system of isolated water clusters to a 3D network of hydrophilic channels was observed. The hydrophilic subphase connectivity and water diffusion were studied by constructing digitized replicas of self-assembled morphologies and performing random walk simulations. A non-monotonic dependence of the tracer diffusivity on the water content was found. This unexpected behavior was explained by the formation of large and mostly isolated water domains detected at high water content and high equivalent polymer weight. Using MC simulations, we calculated the chemical potential of water in the hydrated polymer and constructed the water sorption isotherms, which extended to the oversaturated conditions. We determined that the maximum diffusivity and the onset of formation of large water domains corresponded to the saturation conditions at 100% humidity. The oversaturated membrane morphologies generated in the canonical ensemble DPD simulations correspond to the metastable and unstable states of Nafion membrane that are not realized in the experiments.

  1. Bi-level optimizing control of a simulated moving bed process with nonlinear adsorption isotherms.

    PubMed

    Kim, Kiwoong; Kim, Jin-Il; Park, Hyukmin; Koo, Yoon-Mo; Lee, Kwang Soon

    2011-09-23

    A bi-level optimizing control scheme originally proposed for a simulated moving bed (SMB) with linear isotherms has been extended to an SMB with nonlinear isotherms. Cyclic steady state optimization is performed in the upper level to determine the optimum switching period and time-varying feed/desorbent flow rates, and repetitive model predictive control is run in the lower level for purity regulation, taking the decision variables from the upper level as feed-forward information. Experimental as well as numerical study for an SMB process separating a high-concentration mixture of aqueous L-ribose and L-arabinose solutions showed that the proposed scheme performs satisfactorily against various disturbances. In contrast, an alternative scheme based on an SMB model with linear isotherms showed a limitation in the control performance; this scheme was apt to fail in purity regulation.

  2. On the irreversibility of the adsorption isotherm in a closed-end pore.

    PubMed

    Nguyen, Phuong T M; Do, D D; Nicholson, D

    2013-03-05

    We present a simulation study of argon adsorption in a closed-end mesopore of uniform diameter in order to investigate the occurrence of hysteresis and propose two principal reasons for its existence: the variation in the shape and radius of curvature of the meniscus and the change in the packing of adsorbate during adsorption and desorption. This interpretation differs from classical theories that neglect both of these factors, and therefore find that adsorption-desorption in a closed-end pore is reversible. A detailed simulation study of the effects of temperature on the microscopic behavior of the adsorbate supports the interpretation proposed here.

  3. Kinetics and isotherm of fibronectin adsorption to three-dimensional porous chitosan scaffolds explored by 125I-radiolabelling

    PubMed Central

    Amaral, Isabel F.; Sousa, Susana R.; Neiva, Ismael; Marcos-Silva, Lara; Kirkpatrick, Charles J.; Barbosa, Mário A.; Pêgo, Ana P.

    2013-01-01

    In this study, 125I-radiolabelling was explored to follow the kinetics and isotherm of fibronectin (FN) adsorption to porous polymeric scaffolds, as well as to assess the elution and exchangeability of pre-adsorbed FN following incubation in serum-containing culture medium. Chitosan (CH) porous scaffolds with two different degrees of acetylation (DA 4% and 15%) were incubated in FN solutions with concentrations ranging from 5 to 50 µg/mL. The kinetic and isotherm of FN adsorption to CH were successfully followed using 125I-FN as a tracer molecule. While on DA 4% the levels of adsorbed FN increased linearly with FN solution concentration, on DA 15% a saturation plateau was attained, and FN adsorbed amounts were significantly lower. These findings were supported by immunofluorescent studies that revealed, for the same FN solution concentration, higher levels of exposed cell-binding domains on DA 4% as compared with DA 15%. Following incubation in serum containing medium, DA 4% also revealed higher ability to exchange pre-adsorbed FN by new FN molecules from serum than DA 15%. In accordance, when assessing the efficacy of passively adsorbed FN to promote endothelial cell (EC) adhesion to CH, ECs were found to adhere at higher levels to DA 4% as compared with DA 15%, 5 µg/mL of FN being already efficient in promoting cell adhesion and cytoskeletal organization on CH with DA 4%. Taken together the results show that protein radiolabelling can be used as an effective tool to study protein adsorption to porous polymeric scaffolds, both from single and complex protein solutions. PMID:23635535

  4. Adsorption of heavy metal ions using hierarchical CaCO3-maltose meso/macroporous hybrid materials: adsorption isotherms and kinetic studies.

    PubMed

    Ma, Xiaoming; Li, Liping; Yang, Lin; Su, Caiyun; Wang, Kui; Yuan, Shibao; Zhou, Jianguo

    2012-03-30

    Highly ordered hierarchical calcium carbonate is an important phase and has technological interest in the development of functional materials. The work describes hierarchical CaCO(3)-maltose meso/macroporous hybrid materials were synthesized using a simple gas-diffusion method. The uniform hexagonal-shaped CaCO(3)-maltose hybrid materials are formed by the hierarchical assembly of nanoparticles. The pore structure analysis indicates that the sample possesses the macroporous structure of mesoporous framework. The distinguishing features of the hierarchical CaCO(3)-maltose materials in water treatment involve not only high removal capacities, but also decontamination of trace metal ions. Langmuir model fitted the equilibrium data better than the Freundlich isotherm. The maximum removal capacity of the CaCO(3)-maltose hybrid materials for Pb(2+), Cd(2+), Cu(2+), Co(2+), Mn(2+) and Ni(2+) ions was 3242.48, 487.80, 628.93, 393.70, 558.66 and 769.23 mg/g, respectively. Adsorption data were modeled using the pseudo-first-order, pseudo-second-order and intra-particle diffusion kinetics equations. The results indicate that pseudo-second-order kinetic equation and intra-particle diffusion model can better describe the adsorption kinetics. The adsorption and precipitation transformation mechanism can be considered due to hierarchical meso/macroporous structure, rich organic ligands of the CaCO(3)-maltose hybrid materials and the larger solubility product of CaCO(3).

  5. Chromatographic and traditional albumin isotherms on cellulose: a model for wound protein adsorption on modified cotton

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Albumin is the most abundant protein found in healing wounds. Traditional and chromatogrpahic protein isotherms of albumin binding on modified cotton fibers are useful in understanding albumin binding to cellulose wound dressings. An important consideration in the design of cellulosic wound dressin...

  6. Bayesian and Frequentist Methods for Estimating Joint Uncertainty of Freundlich Adsorption Isotherm Fitting Parameters

    EPA Science Inventory

    In this paper, we present methods for estimating Freundlich isotherm fitting parameters (K and N) and their joint uncertainty, which have been implemented into the freeware software platforms R and WinBUGS. These estimates were determined by both Frequentist and Bayesian analyse...

  7. Dye adsorption of cotton fabric grafted with PPI dendrimers: Isotherm and kinetic studies.

    PubMed

    Salimpour Abkenar, Samera; Malek, Reza Mohammad Ali; Mazaheri, Firouzmehr

    2015-11-01

    In this research, the cotton fabrics grafted with two generations of the poly(propylene imine) dendrimers were applied to adsorb textile dyes from aqueous solutions. Direct Red 80 (anionic dye), Disperse Yellow 42 (nonionic dye) and Basic Blue 9 (cationic dye) were selected as model dyes. The effect of various experimental parameters such as initial concentration of dyes, charge of dyes molecule, salt and pH was investigated on the adsorption process. Furthermore, kinetics and equilibrium of the adsorption process on the grafted samples were studied. It was found that maximum adsorption of anionic and disperse dyes took place at around pH 3, while cationic dye could be adsorbed at around pH 11. The Langmuir equation was able to describe the mechanism of dyes adsorption. In addition, the second-order equation was found to be fit with the kinetics data. Interestingly, it seems that the dye adsorption of the grafted fabrics is strongly pH dependent.

  8. Effect of cation type, alkyl chain length, adsorbate size on adsorption kinetics and isotherms of bromide ionic liquids from aqueous solutions onto microporous fabric and granulated activated carbons.

    PubMed

    Hassan, Safia; Duclaux, Laurent; Lévêque, Jean-Marc; Reinert, Laurence; Farooq, Amjad; Yasin, Tariq

    2014-11-01

    The adsorption from aqueous solution of imidazolium, pyrrolidinium and pyridinium based bromide ionic liquids (ILs) having different alkyl chain lengths was investigated on two types of microporous activated carbons: a fabric and a granulated one, well characterized in terms of surface chemistry by "Boehm" titrations and pH of point of zero charge measurements and of porosity by N2 adsorption at 77 K and CO2 adsorption at 273 K. The influence of cation type, alkyl chain length and adsorbate size on the adsorption properties was analyzed by studying kinetics and isotherms of eight different ILs using conductivity measurements. Equilibrium studies were carried out at different temperatures in the range [25-55 °C]. The incorporation of ILs on the AC porosity was studied by N2 adsorption-desorption measurements at 77 K. The experimental adsorption isotherms data showed a good correlation with the Langmuir model. Thermodynamic studies indicated that the adsorption of ILs onto activated carbons was an exothermic process, and that the removal efficiency increased with increase in alkyl chain length, due to the increase in hydrophobicity of long chain ILs cations determined with the evolution of the calculated octanol-water constant (Kow). The negative values of free energies indicated that adsorption of ILs with long chain lengths having hydrophobic cations was more spontaneous at the investigated temperatures.

  9. Kinetic and Isotherm Modelling of the Adsorption of
Phenolic Compounds from Olive Mill Wastewater onto Activated Carbon

    PubMed Central

    Casazza, Alessandro A.; Perego, Patrizia

    2015-01-01

    Summary The adsorption of phenolic compounds from olive oil wastewater by commercial activated carbon was studied as a function of adsorbent quantity and temperature. The sorption kinetics and the equilibrium isotherms were evaluated. Under optimum conditions (8 g of activated carbon per 100 mL), the maximum sorption capacity of activated carbon expressed as mg of caffeic acid equivalent per g of activated carbon was 35.8 at 10 °C, 35.4 at 25 °C and 36.1 at 40 °C. The pseudo-second-order model was considered as the most suitable for kinetic results, and Langmuir isotherm was chosen to better describe the sorption system. The results confirmed the efficiency of activated carbon to remove almost all phenolic compound fractions from olive mill effluent. The preliminary results obtained will be used in future studies. The carbohydrate fraction of this upgraded residue could be employed to produce bioethanol, and adsorbed phenolic compounds can be recovered and used in different industries. PMID:27904350

  10. Adsorption of oxygen molecule in NaA zeolite: Isotherms and infrared measurements

    NASA Astrophysics Data System (ADS)

    Soussen-Jacob, Janine; Tsakiris, Jean; Cohen De Lara, Evelyne

    1989-08-01

    Isotherm and infrared induced band of O2 have been studied in the temperature range 93-193 K. At low temperature and low coverage, two components of the fundamental vibrational band appear on both sides of the gas frequency. Their intensities with respect to T and to the number of adsorbed molecules have been measured in order to understand the interaction of O2 with NaA zeolite. The frequency shift of each component has been related to the orientation of the molecule, from considerations about the interaction potential.

  11. Adsorption isotherms and kinetics of methylene blue on a low-cost adsorbent recovered from a spent catalyst of vinyl acetate synthesis

    NASA Astrophysics Data System (ADS)

    Zhang, Zhengyong; Zhang, Zebiao; Fernández, Y.; Menéndez, J. A.; Niu, Hao; Peng, Jinhui; Zhang, Libo; Guo, Shenghui

    2010-02-01

    A regenerated activated carbon used as catalyst support in the synthesis of vinyl acetate has been tested as a low-cost adsorbent for the removal of dyes. After a thorough textural characterization of the regenerated activated carbon, its adsorption isotherms and kinetics were determined using methylene blue as model compound at different initial concentrations. Both Langmuir and Freundlich isotherm models were developed and then compared. It was found that the equilibrium data were best represented by the Langmuir isotherm model. The kinetic data were fitted to pseudo-first-order, pseudo-second-order and intraparticle diffusion models, and it was found that the best fitting corresponded to the pseudo-second-order kinetic model. The results showed that this novel adsorbent had a high adsorption capacity, making it suitable for use in the treatment of methylene blue enriched wastewater.

  12. Adsorption of Pb(II) on mesoporous activated carbons fabricated from water hyacinth using H3PO4 activation: Adsorption capacity, kinetic and isotherm studies

    NASA Astrophysics Data System (ADS)

    Huang, Yang; Li, Shunxing; Chen, Jianhua; Zhang, Xueliang; Chen, Yiping

    2014-02-01

    Activated carbons with high mesoporosity and abundant oxygen-containing functional groups were prepared from water hyacinth using H3PO4 activation (WHAC) to eliminate Pb(II) in water. Characterizations of the WHAC were performed using Brunauer-Emmett-Teller (BET), scanning electron microscopy (SEM) and Fourier transform infrared spectroscopy (FTIR). The BET analysis showed that WHAC possesses a high mesoporosity (93.9%) with a BET surface area of 423.6 m2/g. The presence of oxygen-containing functional groups including hydroxyl, carbonyl, carboxyl and phosphate groups renders the WHAC a favorable adsorbent for Pb(II) with the maximum monolayer capacity (qm) 118.8 mg/g. The adsorption behavior follows pseudo-first order kinetic and Langmuir isotherm. The desorption study demonstrated that the WHAC could be readily regenerated using 0.1 M HCl (pH = 1.0). The desorbed WHAC could be reused at least six times without significant adsorption capacity reduction. The adsorption process was spontaneous and endothermic with ΔG (-0.27, -1.13, -3.02, -3.62, -5.54, and -9.31 kJ/mol) and ΔH (38.72 kJ/mol). Under the optimized conditions, a small amount of the adsorbent (1.0 g/L) could remove as much as 90.1% of Pb(II) (50 mg/L) in 20 min at pH 6.0 and temperature of 298 K. Therefore, the WHAC has a great potential to be an economical and efficient adsorbent in the treatment of lead-contaminated water.

  13. Kinetic and isotherm studies of adsorption and biosorption processes in the removal of phenolic compounds from aqueous solutions: comparative study

    PubMed Central

    2013-01-01

    The phenolic compounds are known by their carcinogenicity and high toxicity as well as creating unpleasant taste and odor in water resources. The present study develops a cost-effective technology for the treatment of water contaminated with phenolic compounds, including Phenol (Ph), 2-chlorophenol (2-CP), and 4-chlorophenol (4-CP). So, two sorbents, rice bran ash (RBA) and biomass of brown algae, Cystoseiraindica, were used and results were compared with the commercially granular activated carbon (GAC). The phenolic compounds were determined using a high performance liquid chromatography (HPLC) under batch equilibrium conditions. The effects of contact time, pH, initial adsorbate concentration, and adsorbent dosages on the removal efficiency were studied. The adsorption data were simulated by isotherm and kinetic models. Results indicated that RBA and GAC had the lowest efficiency for the removal of 2-CP, while the order of removal efficiency for C. indica biomass was as follows: 2-CP > 4-CP > phenol. The efficiency of GAC was higher than those of other adsorbents for all of the phenolic compounds. Furthermore, the adsorption capacity of RBA was found to be higher than that of C. indica biomass. The optimal initial pH for the removal of phenol, 2-CP and 4-CP was determined to be 5, 7, and 7 for RBA, GAC, and algal biomass, respectively. Kinetic studies suggested that the pseudo-second order best fitted the kinetic data. PMID:24355013

  14. Isotherm, kinetic, and thermodynamic studies on Hg(II) adsorption from aqueous solution by silica- multiwall carbon nanotubes.

    PubMed

    Saleh, Tawfik A

    2015-11-01

    Silica combined with 2% multiwall carbon nanotubes (SiO2-CNT) was synthesized and characterized. Its sorption efficacy was investigated for the Hg(II) removal from an aqueous solution. The effect of pH on the percentage removal by the prepared material was examined in the range from 3 to 7. The adsorption kinetics were well fitted by using a pseudo-second-order model at various initial Hg(II) concentrations with R (2) of >0.99. The experimental data were plotted using the interparticle diffusion model, which indicated that the interparticle diffusion is not the only rate-limiting step. The data is well described by the Freundlich isotherm equation. The activation energy (Ea) for adsorption was 12.7 kJ mol(-1), indicating the process is to be physisorption. Consistent with an endothermic process, an increase in the temperature resulted in increasing mercury removal with a ∆H(o) of 13.3 kJ/mol and a ∆S(o) 67.5 J/mol K. The experimental results demonstrate that the combining of silica and nanotubes is a promising alternative material, which can be used to remove the mercury from wastewaters.

  15. Solvothermal synthesis of different phase N-TiO2 and their kinetics, isotherm and thermodynamic studies on the adsorption of methyl orange.

    PubMed

    Fan, Jimin; Zhao, Zhihuan; Liu, Wenhui; Xue, Yongqiang; Yin, Shu

    2016-05-15

    The different crystal forms of nitrogen doped-titanium oxide (N-TiO2) with different particle sizes were produced by precipitation-solvothermal method and their adsorption mechanism were also investigated. The adsorption kinetics showed that rutile N-TiO2 displayed higher adsorption capacity than anatase for methyl orange (MO) and its adsorption behavior followed the pseudo-second-order kinetics. The equilibrium adsorption rate of N-TiO2 for MO was well fitted by the Langmuir isotherm model and the adsorption process was monolayer adsorption. The adsorption capacity decreased with increasing temperature. The average correlation coefficient was beyond 97%. The thermodynamic parameters (ΔaGm(ө), ΔaHm(ө), and ΔaSm(ө)) were calculated. It was found that anatase and rutile N-TiO2 had different adsorption enthalpy and entropy. The smaller the particle size, the greater the surface area and surface energy was, then ΔaGm(ө) decreased and the standard equilibrium constant increased at the same time. The adsorption process onto different crystalline phase N-TiO2 was exothermic and non-spontaneous.

  16. Investigation of simultaneous biosorption of copper(II) and chromium(VI) on dried Chlorella vulgaris from binary metal mixtures: Application of multicomponent adsorption isotherms

    SciTech Connect

    Aksu, Z.; Acikel, U.; Kutsal, T.

    1999-02-01

    Although the biosorption of single metal ions to various kinds of microorganisms has been extensively studied and the adsorption isotherms have been developed for only the single metal ion situation, very little attention has been given to the bioremoval and expression of adsorption isotherms of multimetal ions systems. In this study the simultaneous biosorption of copper(II) and chromium(VI) to Chlorella vulgaris from a binary metal mixture was studied and compared with the single metal ion situation in a batch stirred system. The effects of pH and single- and dual-metal ion concentrations on the equilibrium uptakes were investigated. In previous studies the optimum biosorption pH had been determined as 4.0 for copper(II) and as 2.0 for chromium(VI). Multimetal ion biosorption studies were performed at these two pH values. It was observed that the equilibrium uptakes of copper(II) or chromium(VI) ions were changed due to the biosorption pH and the presence of other metal ions. Adsorption isotherms were developed for both single- and dual-metal ions systems at these two pH values, and expressed by the mono- and multicomponent Langmuir and Freundlich adsorption models. Model parameters were estimated by nonlinear regression. It was seen that the adsorption equilibrium data fitted very well to the competitive Freundlich model in the concentration ranges studied.

  17. Effects of gas adsorption isotherm and liquid contact angle on capillary force for sphere-on-flat and cone-on-flat geometries.

    PubMed

    Hsiao, Erik; Marino, Matthew J; Kim, Seong H

    2010-12-15

    This paper explains the origin of the vapor pressure dependence of the asperity capillary force in vapor environments. A molecular adsorbate layer is readily formed on solid surface in ambient conditions unless the surface energy of the solid is low enough and unfavorable for vapor adsorption. Then, the capillary meniscus formed around the solid asperity contact should be in equilibrium with the adsorbate layer, not with the bare solid surface. A theoretical model incorporating the vapor adsorption isotherm into the solution of the Young-Laplace equation is developed. Two contact geometries--sphere-on-flat and cone-on-flat--are modeled. The calculation results show that the experimentally-observed strong vapor pressure dependence can be explained only when the adsorption isotherm of the vapor on the solid surface is taken into account. The large relative partial pressure dependence mainly comes from the change in the meniscus size due to the presence of the adsorbate layer.

  18. Design of β-cyclodextrin modified TiO2 nanotubes for the adsorption of Cu(II): Isotherms and kinetics study.

    PubMed

    Triki, Mohamed; Tanazefti, Haythem; Kochkar, Hafedh

    2017-05-01

    This paper builds on previous literature showing the interesting adsorptive properties of TiO2 nanotubes. It further explores the positive effect of β-cyclodextrin on these properties. Hence, β-cyclodextrin modified TiO2 nanotubes were successfully prepared and characterized by XRD, N2 physisorption at 77K, Raman, FTIR-ATR, (1)H NMR, TEM and EPR. The adsorptive interaction of Cu(II) with materials was investigated in aqueous solution at pH 9.25 (NH4(+)/NH3). The main conclusion is that copper(II)-ammonia complexation equilibria play an important role in the adsorption process. The β-cyclodextrin was found to improve the Cu(NH3)4(2+) adsorption mainly by retarding its precipitation to high concentrations values (>400mgL(-1)). Adsorption experimental data showed good fit with the pseudo-second-order model and the Langmuir isotherm model.

  19. Structure regulation of silica nanotubes and their adsorption behaviors for heavy metal ions: pH effect, kinetics, isotherms and mechanism.

    PubMed

    Wang, Pan; Du, Mingliang; Zhu, Han; Bao, Shiyong; Yang, Tingting; Zou, Meiling

    2015-04-09

    Silica nanotubes (SNTs) with controlled nanotubular structure were synthesized via an electrospinning and calcination process. In this regard, SNTs were found to be ideal adsorbents for Pb(II) removal with a higher adsorption capacity, and surface modification of the SNTs by sym-diphenylcarbazide (SD-SNTs) markedly enhanced the adsorption ability due to the chelating interaction between imino groups and Pb(II). The pH effect, kinetics, isotherms and adsorption mechanism of SNTs and SD-SNTs on Pb(II) adsorption were investigated and discussed detailedly. The adsorption capacity for Pb(II) removal was found to be significantly improved with the decrease of pH value. The Langmuir adsorption model agreed well with the experimental data. As for kinetic study, the adsorption onto SNTs and SD-SNTs could be fitted to pseudo-first-order and pseudo-second-order model, respectively. In addition, the as-prepared SNTs and SD-SNTs also exhibit high adsorption ability for Cd(II) and Co(II). The experimental results demonstrate that the SNTs and SD-SNTs are potential adsorbents and can be used effectively for the treatment of heavy-metal-ions-containing wastewater.

  20. Adsorption isotherms, kinetics, thermodynamics and desorption studies of 2,4,6-trichlorophenol on oil palm empty fruit bunch-based activated carbon.

    PubMed

    Tan, I A W; Ahmad, A L; Hameed, B H

    2009-05-30

    The adsorption characteristics of 2,4,6-trichlorophenol (TCP) on activated carbon prepared from oil palm empty fruit bunch (EFB) were evaluated. The effects of TCP initial concentration, agitation time, solution pH and temperature on TCP adsorption were investigated. TCP adsorption uptake was found to increase with increase in initial concentration, agitation time and solution temperature whereas adsorption of TCP was more favourable at acidic pH. The adsorption equilibrium data were best represented by the Freundlich and Redlich-Peterson isotherms. The adsorption kinetics was found to follow the pseudo-second-order kinetic model. The mechanism of the adsorption process was determined from the intraparticle diffusion model. Boyd plot revealed that the adsorption of TCP on the activated carbon was mainly governed by particle diffusion. Thermodynamic parameters such as standard enthalpy (DeltaH degrees ), standard entropy (DeltaS degrees ), standard free energy (DeltaG degrees ) and activation energy were determined. The regeneration efficiency of the spent activated carbon was high, with TCP desorption of 99.6%.

  1. Relative importance of column and adsorption parameters on the productivity in preparative liquid chromatography II: Investigation of separation systems with competitive Langmuir adsorption isotherms.

    PubMed

    Forssén, Patrik; Samuelsson, Jörgen; Fornstedt, Torgny

    2014-06-20

    In this study we investigated how the maximum productivity for commonly used, realistic separation system with a competitive Langmuir adsorption isotherm is affected by changes in column length, packing particle size, mobile phase viscosity, maximum allowed column pressure, column efficiency, sample concentration/solubility, selectivity, monolayer saturation capacity and retention factor of the first eluting compound. The study was performed by generating 1000 random separation systems whose optimal injection volume was determined, i.e., the injection volume that gives the largest achievable productivity. The relative changes in largest achievable productivity when one of the parameters above changes was then studied for each system and the productivity changes for all systems were presented as distributions. We found that it is almost always beneficial to use shorter columns with high pressure drops over the column and that the selectivity should be greater than 2. However, the sample concentration and column efficiency have very limited effect on the maximum productivity. The effect of packing particle size depends on the flow rate limiting factor. If the pumps maximum flow rate is the limiting factor use smaller packing, but if the pressure of the system is the limiting factor use larger packing up to about 40μm.

  2. Thermodynamics, interfacial pressure isotherms and dilational rheology of mixed protein-surfactant adsorption layers.

    PubMed

    Fainerman, V B; Aksenenko, E V; Krägel, J; Miller, R

    2016-07-01

    Proteins and their mixtures with surfactants are widely used in many applications. The knowledge of their solution bulk behavior and its impact on the properties of interfacial layers made great progress in the recent years. Different mechanisms apply to the formation process of protein/surfactant complexes for ionic and non-ionic surfactants, which are governed mainly by electrostatic and hydrophobic interactions. The surface activity of these complexes is often remarkably different from that of the individual protein and has to be considered in respective theoretical models. At very low protein concentration, small amounts of added surfactants can change the surface activity of proteins remarkably, even though no strongly interfacial active complexes are observed. Also small added amounts of non-ionic surfactants change the surface activity of proteins in the range of small bulk concentrations or surface coverages. The modeling of the equilibrium adsorption behavior of proteins and their mixtures with surfactants has reached a rather high level. These models are suitable also to describe the high frequency limits of the dilational viscoelasticity of the interfacial layers. Depending on the nature of the protein/surfactant interactions and the changes in the interfacial layer composition rather complex dilational viscoelasticities can be observed and described by the available models. The differences in the interfacial behavior, often observed in literature for studies using different experimental methods, are at least partially explained by a depletion of proteins, surfactants and their complexes in the range of low concentrations. A correction of these depletion effects typically provides good agreement between the data obtained with different methods, such as drop and bubble profile tensiometry.

  3. Isotherm and kinetics study of malachite green adsorption onto copper nanowires loaded on activated carbon: artificial neural network modeling and genetic algorithm optimization.

    PubMed

    Ghaedi, M; Shojaeipour, E; Ghaedi, A M; Sahraei, Reza

    2015-05-05

    In this study, copper nanowires loaded on activated carbon (Cu-NWs-AC) was used as novel efficient adsorbent for the removal of malachite green (MG) from aqueous solution. This new material was synthesized through simple protocol and its surface properties such as surface area, pore volume and functional groups were characterized with different techniques such XRD, BET and FESEM analysis. The relation between removal percentages with variables such as solution pH, adsorbent dosage (0.005, 0.01, 0.015, 0.02 and 0.1g), contact time (1-40min) and initial MG concentration (5, 10, 20, 70 and 100mg/L) was investigated and optimized. A three-layer artificial neural network (ANN) model was utilized to predict the malachite green dye removal (%) by Cu-NWs-AC following conduction of 248 experiments. When the training of the ANN was performed, the parameters of ANN model were as follows: linear transfer function (purelin) at output layer, Levenberg-Marquardt algorithm (LMA), and a tangent sigmoid transfer function (tansig) at the hidden layer with 11 neurons. The minimum mean squared error (MSE) of 0.0017 and coefficient of determination (R(2)) of 0.9658 were found for prediction and modeling of dye removal using testing data set. A good agreement between experimental data and predicted data using the ANN model was obtained. Fitting the experimental data on previously optimized condition confirm the suitability of Langmuir isotherm models for their explanation with maximum adsorption capacity of 434.8mg/g at 25°C. Kinetic studies at various adsorbent mass and initial MG concentration show that the MG maximum removal percentage was achieved within 20min. The adsorption of MG follows the pseudo-second-order with a combination of intraparticle diffusion model.

  4. Isotherm and kinetics study of malachite green adsorption onto copper nanowires loaded on activated carbon: Artificial neural network modeling and genetic algorithm optimization

    NASA Astrophysics Data System (ADS)

    Ghaedi, M.; Shojaeipour, E.; Ghaedi, A. M.; Sahraei, Reza

    2015-05-01

    In this study, copper nanowires loaded on activated carbon (Cu-NWs-AC) was used as novel efficient adsorbent for the removal of malachite green (MG) from aqueous solution. This new material was synthesized through simple protocol and its surface properties such as surface area, pore volume and functional groups were characterized with different techniques such XRD, BET and FESEM analysis. The relation between removal percentages with variables such as solution pH, adsorbent dosage (0.005, 0.01, 0.015, 0.02 and 0.1 g), contact time (1-40 min) and initial MG concentration (5, 10, 20, 70 and 100 mg/L) was investigated and optimized. A three-layer artificial neural network (ANN) model was utilized to predict the malachite green dye removal (%) by Cu-NWs-AC following conduction of 248 experiments. When the training of the ANN was performed, the parameters of ANN model were as follows: linear transfer function (purelin) at output layer, Levenberg-Marquardt algorithm (LMA), and a tangent sigmoid transfer function (tansig) at the hidden layer with 11 neurons. The minimum mean squared error (MSE) of 0.0017 and coefficient of determination (R2) of 0.9658 were found for prediction and modeling of dye removal using testing data set. A good agreement between experimental data and predicted data using the ANN model was obtained. Fitting the experimental data on previously optimized condition confirm the suitability of Langmuir isotherm models for their explanation with maximum adsorption capacity of 434.8 mg/g at 25 °C. Kinetic studies at various adsorbent mass and initial MG concentration show that the MG maximum removal percentage was achieved within 20 min. The adsorption of MG follows the pseudo-second-order with a combination of intraparticle diffusion model.

  5. Highly efficient ultrasonic-assisted removal of Hg(II) ions on graphene oxide modified with 2-pyridinecarboxaldehyde thiosemicarbazone: Adsorption isotherms and kinetics studies.

    PubMed

    Tadjarodi, Azadeh; Moazen Ferdowsi, Somayeh; Zare-Dorabei, Rouholah; Barzin, Ahmad

    2016-11-01

    A novel adsorbent, based on modifying graphene oxide (GO) chemically with 2-pyridinecarboxaldehyde thiosemicarbazone (2-PTSC) as ligand, was designed by facile process for removal of Hg(II) from aqueous solution. Characterization of the adsorbent was performed using various techniques, such as FT-IR, XRD, XPS, SEM and AFM analysis. The adsorption capacity was affected by variables such as adsorbent dosage, pH solution, Hg(2+) initial concentration and sonicating time. These variables were optimized by rotatable central composite design (CCD) under response surface methodology (RSM). The predictive model for Hg(II) adsorption was constructed and applied to find the best conditions at which the responses were maximized. In this conditions, the adsorption capacity of this adsorbent for Hg(2+) ions was calculated to be 309mgg(-1) that was higher than that of GO. Appling the ultrasound power combined with adsorption method was very efficient in shortening the removal time of Hg(2+) ions by enhancing the dispersion of adsorbent and metal ions in solution and effective interactions among them. The adsorption process was well described by second-order kinetic and Langmuir isotherm model in which the maximum adsorption capacity (Qm) was found to be 555mgg(-1) for adsorption of Hg(2+) ions over the obtained adsorbent. The performance of adsorbent was examined on the real wastewaters and confirmed the applicability of adsorbent for practical applications.

  6. FTIR spectrophotometry, kinetics and adsorption isotherms modeling, ion exchange, and EDX analysis for understanding the mechanism of Cd(2+) and Pb(2+) removal by mango peel waste.

    PubMed

    Iqbal, Muhammad; Saeed, Asma; Zafar, Saeed Iqbal

    2009-05-15

    Mango peel waste (MPW) was evaluated as a new sorbent for the removal of Cd(2+) and Pb(2+) from aqueous solution. The maximum sorption capacity of Cd(2+) and Pb(2+) was found to be 68.92 and 99.05mgg(-1), respectively. The kinetics of sorption of both metals was fast, reaching at equilibrium in 60min. Sorption kinetics and equilibria followed pseudo-second order and Langmuir adsorption isotherm models. FTIR analysis revealed that carboxyl and hydroxyl functional groups were mainly responsible for the sorption of Cd(2+) and Pb(2+). Chemical modification of MPW for blocking of carboxyl and hydroxyl groups showed that 72.46% and 76.26% removal of Cd(2+) and Pb(2+), respectively, was due to the involvement of carboxylic group, whereas 26.64% and 23.74% was due to the hydroxyl group. EDX analysis of MPW before and after metal sorption and release of cations (Ca(2+), Mg(2+), Na(+), K(+)) and proton H(+) from MPW with the corresponding uptake of Cd(2+) and Pb(2+) revealed that the main mechanism of sorption was ion exchange. The regeneration experiments showed that the MPW could be reused for five cycles without significant loss in its initial sorption capacity. The study points to the potential of new use of MPW as an effective sorbent for the removal of Cd(2+) and Pb(2+) from aqueous solution.

  7. Phase Transitions at Liquid Solid Interfaces: Pade Approximant for Adsorption Isotherms and Voltammograms

    DTIC Science & Technology

    1991-01-29

    the underpotential deposition of metals on an electrode, and obtain voltammograms that show the sharp spikes seen in recent experiments. 20 DISTRIBUTION...recursion relation. and can be computed from the fugacity series in closed form. We apply this approxiant to the underpotential deposition of metals on an...the sudden formation of films at electrodes. It has been possible to perform structural analysis of underpotential deposits of metallic monolavers [4

  8. Heavy Metal Adsorption onto Kappaphycus sp. from Aqueous Solutions: The Use of Error Functions for Validation of Isotherm and Kinetics Models

    PubMed Central

    Rahman, Md. Sayedur; Sathasivam, Kathiresan V.

    2015-01-01

    Biosorption process is a promising technology for the removal of heavy metals from industrial wastes and effluents using low-cost and effective biosorbents. In the present study, adsorption of Pb2+, Cu2+, Fe2+, and Zn2+ onto dried biomass of red seaweed Kappaphycus sp. was investigated as a function of pH, contact time, initial metal ion concentration, and temperature. The experimental data were evaluated by four isotherm models (Langmuir, Freundlich, Temkin, and Dubinin-Radushkevich) and four kinetic models (pseudo-first-order, pseudo-second-order, Elovich, and intraparticle diffusion models). The adsorption process was feasible, spontaneous, and endothermic in nature. Functional groups in the biomass involved in metal adsorption process were revealed as carboxylic and sulfonic acids and sulfonate by Fourier transform infrared analysis. A total of nine error functions were applied to validate the models. We strongly suggest the analysis of error functions for validating adsorption isotherm and kinetic models using linear methods. The present work shows that the red seaweed Kappaphycus sp. can be used as a potentially low-cost biosorbent for the removal of heavy metal ions from aqueous solutions. Further study is warranted to evaluate its feasibility for the removal of heavy metals from the real environment. PMID:26295032

  9. Heavy Metal Adsorption onto Kappaphycus sp. from Aqueous Solutions: The Use of Error Functions for Validation of Isotherm and Kinetics Models.

    PubMed

    Rahman, Md Sayedur; Sathasivam, Kathiresan V

    2015-01-01

    Biosorption process is a promising technology for the removal of heavy metals from industrial wastes and effluents using low-cost and effective biosorbents. In the present study, adsorption of Pb(2+), Cu(2+), Fe(2+), and Zn(2+) onto dried biomass of red seaweed Kappaphycus sp. was investigated as a function of pH, contact time, initial metal ion concentration, and temperature. The experimental data were evaluated by four isotherm models (Langmuir, Freundlich, Temkin, and Dubinin-Radushkevich) and four kinetic models (pseudo-first-order, pseudo-second-order, Elovich, and intraparticle diffusion models). The adsorption process was feasible, spontaneous, and endothermic in nature. Functional groups in the biomass involved in metal adsorption process were revealed as carboxylic and sulfonic acids and sulfonate by Fourier transform infrared analysis. A total of nine error functions were applied to validate the models. We strongly suggest the analysis of error functions for validating adsorption isotherm and kinetic models using linear methods. The present work shows that the red seaweed Kappaphycus sp. can be used as a potentially low-cost biosorbent for the removal of heavy metal ions from aqueous solutions. Further study is warranted to evaluate its feasibility for the removal of heavy metals from the real environment.

  10. Estimation of adsorption isotherm and mass transfer parameters in protein chromatography using artificial neural networks.

    PubMed

    Wang, Gang; Briskot, Till; Hahn, Tobias; Baumann, Pascal; Hubbuch, Jürgen

    2017-03-03

    Mechanistic modeling has been repeatedly successfully applied in process development and control of protein chromatography. For each combination of adsorbate and adsorbent, the mechanistic models have to be calibrated. Some of the model parameters, such as system characteristics, can be determined reliably by applying well-established experimental methods, whereas others cannot be measured directly. In common practice of protein chromatography modeling, these parameters are identified by applying time-consuming methods such as frontal analysis combined with gradient experiments, curve-fitting, or combined Yamamoto approach. For new components in the chromatographic system, these traditional calibration approaches require to be conducted repeatedly. In the presented work, a novel method for the calibration of mechanistic models based on artificial neural network (ANN) modeling was applied. An in silico screening of possible model parameter combinations was performed to generate learning material for the ANN model. Once the ANN model was trained to recognize chromatograms and to respond with the corresponding model parameter set, it was used to calibrate the mechanistic model from measured chromatograms. The ANN model's capability of parameter estimation was tested by predicting gradient elution chromatograms. The time-consuming model parameter estimation process itself could be reduced down to milliseconds. The functionality of the method was successfully demonstrated in a study with the calibration of the transport-dispersive model (TDM) and the stoichiometric displacement model (SDM) for a protein mixture.

  11. Removal of 2,4-dichlorophenol using cyclodextrin-ionic liquid polymer as a macroporous material: characterization, adsorption isotherm, kinetic study, thermodynamics.

    PubMed

    Raoov, Muggundha; Mohamad, Sharifah; Abas, Mohd Radzi

    2013-12-15

    Cyclodextrin-ionic liquid polymer (βCD-BIMOTs-TDI) was firstly synthesized using functionalized β-Cyclodextrin (CD) with 1-benzylimidazole (BIM) to form monofunctionalized CD (βCD-BIMOTs) and was further polymerized using toluene diisocyanate (TDI) linker to form insoluble βCD-BIMOTs-TDI. SEM characterization result shows that βCD-BIMOTs-TDI exhibits macropore size while the BET result shows low surface area (1.254 m(2)g(-1)). The unique properties of the ILs allow us to produce materials with different morphologies. The adsorption isotherm and kinetics of 2,4-dichlorophenol (2,4-DCP) onto βCD-BIMOTs-TDI is studied. Freundlich isotherm and pseudo-second order kinetics are found to be the best to represent the data for 2,4-DCP adsorption on the βCD-BIMOTs-TDI. The presence of macropores decreases the mass transfer resistance and increases the adsorption process by reducing the diffusion distance. The change in entropy (ΔS°) and heat of adsorption (ΔH°) for 2,4-DCP on βCD-BIMOTs-TDI were estimated as -55.99 J/Kmol and -18.10 J/mol, respectively. The negative value of Gibbs free energy (ΔG°) indicates that the adsorption process is thermodynamically feasible, spontaneous and chemically controlled. Finally, the interactions between the cavity of βCD-BIMOTs and 2,4-DCP are investigated and the results shows that the inclusion of the complex formation and π-π interaction are the main processes involved in the adsorption process.

  12. CO2 adsorption isotherm on clay minerals and the CO2 accessibility into the clay interlayer

    NASA Astrophysics Data System (ADS)

    Gensterblum, Yves; Bertier, Pieter; Busch, Andreas; Rother, Gernot; Krooß, Bernhard

    2013-04-01

    Large-scale CO2 storage in porous rock formations at 1-3 km depth is seen as a global warming mitigation strategy. In this process, CO2 is separated from the flue gas of coal or gas power plants, compressed, and pumped into porous subsurface reservoirs with overlying caprocks (seals). Good seals are mechanically and chemically stable caprocks with low porosity and permeability. They prevent leakage of buoyant CO2 from the reservoir. Caprocks are generally comprised of thick layers of shale, and thus mainly consist of clay minerals. These clays can be affected by CO2-induced processes, such as swelling or dissolution. The interactions of CO2 with clay minerals in shales are at present poorly understood. Sorption measurements in combination scattering techniques could provide fundamental insight into the mechanisms governing CO2-clay interaction. Volumetric sorption techniques have assessed the sorption of supercritical CO2 onto coal (Gensterblum et al., 2010; Gensterblum et al., 2009), porous silica (Rother et al., 2012a) and clays as a means of exploring the potential of large-scale storage of anthropogenic CO2 in geological reservoirs (Busch et al., 2008). On different clay minerals and shales, positive values of excess sorption were measured at gas pressures up to 6 MPa, where the interfacial fluid is assumed to be denser than the bulk fluid. However, zero and negative values were obtained at higher densities, which suggests the adsorbed fluid becomes equal to and eventually less dense than the corresponding bulk fluid, or that the clay minerals expand on CO2 charging. Using a combination of neutron diffraction and excess sorption measurements, we recently deduced the interlayer density of scCO2 in Na-montmorillonite clay in its single-layer hydration state (Rother et al., 2012b), and confirmed its low density, as well as the expansion of the basal spacings. We performed neutron diffraction experiments at the FRMII diffractometer on smectite, kaolinite and illite

  13. Competitive adsorption of VOCcs and BOM: Oxic and anoxic environments

    SciTech Connect

    Sorial, G.A.; Papadimas, S.P.; Suidan, M.T.; Speth, T.F.

    1994-01-01

    The effect of the presence of molecular oxygen on the adsorption of volatile organic compounds (VOCs) in distilled Milli-Q water and in water supplemented with background organic matter (BOM) is evaluated. Experiments are conducted under conditions where molecular oxygen is present in the test environment (oxic adsorption), and where oxygen is absent from the test environment (anoxic adsorption). Adsorption isotherms for tetrachloroethylene (PCE) and trichloroethylene (TCE) in Milli-Q water showed no impact of the presence of oxygen on their adsorption behavior, while adsorption isotherms for cis-1,2-dichloroethylene (DCE) showed higher capacities under toxic conditions. The Ideal Adsorbed Solution Theory (IAST) successfully predicted the VOCs anoxic adsorption isotherms in BOM. However, the IAST model did not predict the VOCs oxic adsorption isotherms in BOM.

  14. Adsorption of chromium (VI) by ethylenediamine-modified cross-linked magnetic chitosan resin: isotherms, kinetics and thermodynamics.

    PubMed

    Hu, Xin-jiang; Wang, Jing-song; Liu, Yun-guo; Li, Xin; Zeng, Guang-ming; Bao, Zheng-lei; Zeng, Xiao-xia; Chen, An-wei; Long, Fei

    2011-01-15

    The adsorption of chromium (VI) ions from aqueous solution by ethylenediamine-modified cross-linked magnetic chitosan resin (EMCMCR) was studied in a batch adsorption system. Chromium (VI) removal is pH dependent and the optimum adsorption was observed at pH 2.0. The adsorption rate was extremely fast and the equilibrium was established within 6-10min. The adsorption data could be well interpreted by the Langmuir and Temkin model. The maximum adsorption capacities obtained from the Langmuir model are 51.813mgg(-1), 48.780mgg(-1) and 45.872mgg(-1) at 293, 303 and 313K, respectively. The adsorption process could be described by pseudo-second-order kinetic model. The intraparticle diffusion study revealed that film diffusion might be involved in the present case. Thermodynamic parameters revealed the feasibility, spontaneity and exothermic nature of adsorption. The sorbents were successfully regenerated using 0.1N NaOH solutions.

  15. Use of solid waste for chemical stabilization: Adsorption isotherms and {sup 13}C solid-state NMR study of hazardous organic compounds sorbed on coal fly ash

    SciTech Connect

    Netzel, D.A.; Lane, D.C.; Rovani, J.F.; Cox, J.D.; Clark, J.A.; Miknis, F.P.

    1993-09-01

    Adsorption of hazardous organic compounds on the Dave Johnston plant fly ash is described. Fly ash from Dave Johnston and Laramie River power plants were characterized using elemental, x-ray, and {sup 29}Si NMR; the Dave Johnston (DJ) fly ash had higher quartz contents, while the Laramie River fly ash had more monomeric silicate anions. Adsorption data for hydroaromatics and chlorobenzenes indicate that the adsorption capacity of DJ coal fly ash is much less than that of activated carbon by a factor of >3000; but it is needed to confirm that solid-gas and solid-liquid equilibrium isotherms can indeed be compared. However, for pyridine, pentachlorophenol, naphthalene, and 1,1,2,2-tetrachloroethane, the DJ fly ash appears to adsorb these compounds nearly as well as activated carbon. {sup 13}C NMR was used to study the adsorption of hazardous org. cpds on coal fly ash; the nuclear spin relaxation times often were very long, resulting in long experimental times to obtain a spectrum. Using a jumbo probe, low concentrations of some hazardous org. cpds could be detected; for pentachlorophenol adsorbed onto fly ash, the chemical shift of the phenolic carbon was changed. Use of NMR to study the adsorption needs further study.

  16. Non-isothermal infiltration and tracer transport experiments on large soil columns

    NASA Astrophysics Data System (ADS)

    Sobotkova, Martina; Snehota, Michal; Cejkova, Eva; Tesar, Miroslav

    2016-04-01

    Isothermal and non-isothermal infiltration experiments were carried out in the laboratory on large undisturbed soil columns (19 cm in diameter, 25 cm high) taken at the experimental catchments Roklan (Sumava Mountains, Czech Republic) and Uhlirska (Jizera Mountains, Czech republic). The aim of the study was twofold. The first goal was to obtain water flow and heat transport data for indirect parameter estimation of thermal and hydraulic properties of soils from two sites by inverse modelling. The second aim was to investigate the extent of impact of the temperature on saturated hydraulic conductivity (Ksat) and dispersity of solute transport. The temperature of infiltrating water in isothermal experiment (20 °C) was equal to the initial temperature of the sample. For non-isothermal experiment water temperature was 5°C, while the initial temperature of the sample was 20°C as in previous case. The experiment was started by flooding the sample surface. Then water level was maintained at constant level throughout the infiltration run using the optical sensor and peristaltic pump. Concentration pulse of deuterium was applied at the top of the soil sample, during the steady state flow. Initial pressure head in the sample was close to field capacity. Two tensiometers and two temperature sensors were inserted in the soil sample in two depths (9 and 15 cm below the top of the sample). Two additional temperature sensors monitored the temperature entering and leaving the samples. Water drained freely through the perforated plate at the bottom of sample by gravity. Inflow and outflow water flux densities, water pressure heads and soil temperatures were monitored continuously during experiments. Effluent was sampled in regular time intervals and samples were analysed for deuterium concentrations by laser spectroscopy to develop breakthrough curves. The outcome of experiments are the series of measured water fluxes, pressure heads and temperatures ready for inverse modelling

  17. Equilibrium and kinetics of water adsorption in carbon molecular sieve: theory and experiment.

    PubMed

    Rutherford, S W; Coons, J E

    2004-09-28

    Measurements of water adsorption equilibrium and kinetics in Takeda carbon molecular sieve (CMS) were undertaken in an effort to characterize fundamental mechanisms of adsorption and transport. Adsorption equilibrium revealed a type III isotherm that was characterized by cooperative multimolecular sorption theory. Water adsorption was found to be reversible and did not display hysteresis upon desorption over the conditions studied. Adsorption kinetics measurements revealed that a Fickian diffusion mechanism governed the uptake of water and that the rate of adsorption decreased with increasing relative pressure. Previous investigations have attributed the observed decreasing trend in the rate of adsorption to blocking of micropores. Here, it is proposed that the decrease is attributed to the thermodynamic correction to Fick's law which is formulated on the basis of the chemical potential as the driving force for transport. The thermodynamically corrected formulation accounted for observations of transport of water and other molecules in CMS.

  18. Adsorption of aluminum and lead from wastewater by chitosan-tannic acid modified biopolymers: Isotherms, kinetics, thermodynamics and process mechanism.

    PubMed

    Badawi, M A; Negm, N A; Abou Kana, M T H; Hefni, H H; Abdel Moneem, M M

    2017-06-01

    Chitosan was reacted by tannic acid to obtain three modified chitosan biopolymer. Their chemical structures were characterized by FTIR and elemental analysis. The prepared biopolymers were used to adsorb Al(III) and Pb(II) metal ions from industrial wastewater. The factors affecting the adsorption process were biosorbent amount, initial concentration of metal ion and pH of the medium. The adsorption efficiency increased considerably with the increase of the biosorbent amount and pH of the medium. The adsorption process of biosorbent on different metal ions was fitted by Freundlich adsorption model. The adsorption kinetics was followed Pseudo-second-order kinetic model. The adsorption process occurred according to diffusion mechanism which was confirmed by the interparticle diffusion model. The modified biopolymers were efficient biosorbents for removal of Pb(II) and Al(III) metal ions from the medium.

  19. ISOTHERMAL AIR INGRESS VALIDATION EXPERIMENTS AT IDAHO NATIONAL LABORATORY: DESCRIPTION AND SUMMARY OF DATA

    SciTech Connect

    Chang H. Oh; Eung S. Kim

    2010-09-01

    Idaho National Laboratory performed air ingress experiments as part of validating computational fluid dynamics code (CFD). An isothermal stratified flow experiment was designed and set to understand stratified flow phenomena in the very high temperature gas cooled reactor (VHTR) and to provide experimental data for validating computer codes. The isothermal experiment focused on three flow characteristics unique in the VHTR air-ingress accident: stratified flow in the horizontal pipe, stratified flow expansion at the pipe and vessel junction, and stratified flow around supporting structures. Brine and sucrose were used as heavy fluids and water was used as light fluids. The density ratios were changed between 0.87 and 0.98. This experiment clearly showed that a stratified flow between heavy and light fluids is generated even for very small density differences. The code was validated by conducting blind CFD simulations and comparing the results to the experimental data. A grid sensitivity study was also performed based on the Richardson extrapolation and the grid convergence index method for modeling confidence. As a result, the calculated current speed showed very good agreement with the experimental data, indicating that the current CFD methods are suitable for predicting density gradient stratified flow phenomena in the air-ingress accident.

  20. Characteristics of selective fluoride adsorption by biocarbon-Mg/Al layered double hydroxides composites from protein solutions: kinetics and equilibrium isotherms study.

    PubMed

    Ma, Wei; Lv, Tengfei; Song, Xiaoyan; Cheng, Zihong; Duan, Shibo; Xin, Gang; Liu, Fujun; Pan, Decong

    2014-03-15

    In the study, two novel applied biocarbon-Mg/Al layered double hydroxides composites (CPLDH and CPLDH-Ca) were successfully prepared and characterized by TEM, ICP-AES, XFS, EDS, FTIR, XRD, BET and pHpzc. The fluoride removal efficiency (RF) and protein recovery ratio (RP) of the adsorbents were studied in protein systems of lysozyme (LSZ) and bovine serum albumin (BSA). The results showed that the CPLDH-Ca presented remarkable performance for selective fluoride removal from protein solution. It reached the maximum RF of 92.1% and 94.8% at the CPLDH-Ca dose of 2.0g/L in LSZ and BSA system, respectively. The RP in both systems of LSZ and BSA were more than 90%. Additionally, the RP of CPLDH-Ca increased with the increase of ionic strengths, and it almost can be 100% with more than 93% RF. Fluoride adsorption by the CPLDH-Ca with different initial fluoride concentrations was found to obey the mixed surface reaction and diffusion controlled adsorption kinetic model, and the overall reaction rate is probably controlled by intra-particle diffusion, boundary layer diffusion and reaction process. The adsorption isotherms of fluoride in BSA system fit the Langmuir-Freundlich model well. The BSA has synergistic effect on fluoride adsorption and the degree increased with the increase of the initial BSA concentration.

  1. Predicting Multicomponent Adsorption Isotherms in Open-Metal Site Materials Using Force Field Calculations Based on Energy Decomposed Density Functional Theory.

    PubMed

    Heinen, Jurn; Burtch, Nicholas C; Walton, Krista S; Fonseca Guerra, Célia; Dubbeldam, David

    2016-12-12

    For the design of adsorptive-separation units, knowledge is required of the multicomponent adsorption behavior. Ideal adsorbed solution theory (IAST) breaks down for olefin adsorption in open-metal site (OMS) materials due to non-ideal donor-acceptor interactions. Using a density-function-theory-based energy decomposition scheme, we develop a physically justifiable classical force field that incorporates the missing orbital interactions using an appropriate functional form. Our first-principles derived force field shows greatly improved quantitative agreement with the inflection points, initial uptake, saturation capacity, and enthalpies of adsorption obtained from our in-house adsorption experiments. While IAST fails to make accurate predictions, our improved force field model is able to correctly predict the multicomponent behavior. Our approach is also transferable to other OMS structures, allowing the accurate study of their separation performances for olefins/paraffins and further mixtures involving complex donor-acceptor interactions.

  2. Follow-on Research Activities for the Rensselaer Isothermal Dendritic Growth Experiment (RIDGE)

    NASA Technical Reports Server (NTRS)

    LaCombe, J. C.; Koss, M. B.; Lupulescu, A. O.; Frei, J. E.; Giummarra, C.; Glicksman, M. E.

    2001-01-01

    The RIDGE effort continues the aegis of the earlier, NASA-sponsored, Isothermal Dendritic Growth Experiment (IDGE) series of experiments through the continued analysis of microgravity data acquired during these earlier space flights. The preliminary observations presented here demonstrate that there are significant differences between SCN and the more anisotropic PVA dendrites. The side branch structure becomes amplified only further behind the tip, and the interface shape is generally wider (i.e. more hyperbolic than parabolic) in PVA than in SCN. These characteristics are seen to affect the process of heat transport. Additionally, the dendrites grown during the fourth United States Microgravity Payload (USMP-4) exhibit time-dependent growth characteristics and may not always have reached steady-state growth during the experiment.

  3. Single-experiment displacement assay for quantifying high-affinity binding by isothermal titration calorimetry.

    PubMed

    Krainer, Georg; Keller, Sandro

    2015-04-01

    Isothermal titration calorimetry (ITC) is the gold standard for dissecting the thermodynamics of a biomolecular binding process within a single experiment. However, reliable determination of the dissociation constant (KD) from a single titration is typically limited to the range 100 μM>KD>1 nM. Interactions characterized by a lower KD can be assessed indirectly by so-called competition or displacement assays, provided that a suitable competitive ligand is available whose KD falls within the directly accessible window. However, this protocol is limited by the fact that it necessitates at least two titrations to characterize one high-affinity inhibitor, resulting in considerable consumption of both sample material and time. Here, we introduce a fast and efficient ITC displacement assay that allows for the simultaneous characterization of both a high-affinity ligand and a moderate-affinity ligand competing for the same binding site on a receptor within a single experiment. The protocol is based on a titration of the high-affinity ligand into a solution containing the moderate-affinity ligand bound to the receptor present in excess. The resulting biphasic binding isotherm enables accurate and precise determination of KD values and binding enthalpies (ΔH) of both ligands. We discuss the theoretical background underlying the approach, demonstrate its practical application to metal ion chelation, explore its potential and limitations with the aid of simulations and statistical analyses, and elaborate on potential applications to protein-inhibitor interactions.

  4. Generalized adsorption isotherms for molecular and dissociative adsorption of a polar molecular species on two polar surface geometries: Perovskite (100) (Pm-3m) and fluorite (111) (Fm-3m)

    NASA Astrophysics Data System (ADS)

    Danielson, Thomas; Hin, Celine; Savara, Aditya

    2016-08-01

    Lattice based kinetic Monte Carlo simulations have been used to determine a functional form for the second order adsorption isotherms on two commonly investigated crystal surfaces: the (111) fluorite surface and the (100) perovskite surface which has the same geometric symmetry as the NaCl (100) surface. The functional form is generalized to be applicable to all values of the equilibrium constant by a shift along the pressure axis. Functions have been determined for estimating the pressure at which a desired coverage would be achieved and, conversely, for estimating the coverage at a certain pressure. The generalized form has been calculated by investigating the surface adsorbate coverage across a range of thermodynamic equilibrium constants that span the range 10-26 to 1013. The equations have been shown to be general for any value of the adsorption equilibrium constant.

  5. Generalized adsorption isotherms for molecular and dissociative adsorption of a polar molecular species on two polar surface geometries: Perovskite (100) (Pm-3m) and fluorite (111) (Fm-3m)

    DOE PAGES

    Danielson, Thomas; Hin, Celine; Savara, Aditya

    2016-08-10

    Lattice based kinetic Monte Carlo (KMC) simulations have been used to determine a functional form for the second order adsorption isotherms on two commonly investigated crystal surfaces: the (111) fluorite surface and the (100) perovskite surface which has the same geometric symmetry as the NaCl (100) surface. The functional form is generalized to be applicable to all values of the equilibrium constant by a shift along the pressure axis. Functions have been determined for estimating the pressure at which a desired coverage would be achieved and for estimating the coverage at a certain pressure. The generalized form has been calculatedmore » by investigating the surface adsorbate coverage across a range of thermodynamic equilibrium constants that span the range 10-26 to 1013. Finally, the equations have been shown to be general for any value of the adsorption equilibrium constant.« less

  6. Generalized adsorption isotherms for molecular and dissociative adsorption of a polar molecular species on two polar surface geometries: Perovskite (100) (Pm-3m) and fluorite (111) (Fm-3m)

    SciTech Connect

    Danielson, Thomas; Hin, Celine; Savara, Aditya

    2016-08-10

    Lattice based kinetic Monte Carlo (KMC) simulations have been used to determine a functional form for the second order adsorption isotherms on two commonly investigated crystal surfaces: the (111) fluorite surface and the (100) perovskite surface which has the same geometric symmetry as the NaCl (100) surface. The functional form is generalized to be applicable to all values of the equilibrium constant by a shift along the pressure axis. Functions have been determined for estimating the pressure at which a desired coverage would be achieved and for estimating the coverage at a certain pressure. The generalized form has been calculated by investigating the surface adsorbate coverage across a range of thermodynamic equilibrium constants that span the range 10-26 to 1013. Finally, the equations have been shown to be general for any value of the adsorption equilibrium constant.

  7. Optimization, isotherm, kinetic and thermodynamic studies of Pb(II) ions adsorption onto N-maleated chitosan-immobilized TiO₂ nanoparticles from aqueous media.

    PubMed

    Shaker, Medhat A; Yakout, Amr A

    2016-02-05

    Chitosan, CS was chemically engineered by maleic anhydride via simple protocol to produce N-maleated chitosan, MCS which immobilized on anatase TiO2 to synthesize novel eco-friendly nanosorbent (51±3.8 nm), MCS@TiO2 for cost-effective and efficient removal of Pb(II) ions from aqueous media. The chemical structure, surface properties and morphology of MCS@TiO2 were recognized by FTIR, (1)H NMR, XRD, TEM, DLS and zeta-potential techniques. The relations between %removal of Pb(II) and different analytical parameters such as solution acidity (pH), MCS@TiO2 dosage, time of contact and initial Pb(II) concentration were optimized using response surface methodology (RSM) and Box-Behnken design (BBD) statistical procedures. The fitting of the experimental data to four different isotherm models at optimized conditions was carried out by various statistical treatments including the correlation coefficient (r), coefficient of determination (r(2)) and non-linear Chi-square (χ(2)) test analyses which all confirm the suitability of Langmuir model to explain the adsorption isotherm data. Also, statistics predicted that the pseudo-second-order model is the optimum kinetic model among four applied kinetic models to closely describe the rate equation of the adsorption process. Thermodynamics viewed the adsorption as endothermic and feasible physical process. EDTA could release the sorbed Pb(II) ions from MCS@TiO2 with a recovery above 92% after three sorption-desorption cycles. The novel synthesized nanosorbent is evidenced to be an excellent solid phase extractor for Pb(II) ions from wastewaters.

  8. Optimization, isotherm, kinetic and thermodynamic studies of Pb(II) ions adsorption onto N-maleated chitosan-immobilized TiO2 nanoparticles from aqueous media

    NASA Astrophysics Data System (ADS)

    Shaker, Medhat A.; Yakout, Amr A.

    2016-02-01

    Chitosan, CS was chemically engineered by maleic anhydride via simple protocol to produce N-maleated chitosan, MCS which immobilized on anatase TiO2 to synthesize novel eco-friendly nanosorbent (51 ± 3.8 nm), MCS@TiO2 for cost-effective and efficient removal of Pb(II) ions from aqueous media. The chemical structure, surface properties and morphology of MCS@TiO2 were recognized by FTIR, 1H NMR, XRD, TEM, DLS and zeta-potential techniques. The relations between %removal of Pb(II) and different analytical parameters such as solution acidity (pH), MCS@TiO2 dosage, time of contact and initial Pb(II) concentration were optimized using response surface methodology (RSM) and Box-Behnken design (BBD) statistical procedures. The fitting of the experimental data to four different isotherm models at optimized conditions was carried out by various statistical treatments including the correlation coefficient (r), coefficient of determination (r2) and non-linear Chi-square (χ2) test analyses which all confirm the suitability of Langmuir model to explain the adsorption isotherm data. Also, statistics predicted that the pseudo-second-order model is the optimum kinetic model among four applied kinetic models to closely describe the rate equation of the adsorption process. Thermodynamics viewed the adsorption as endothermic and feasible physical process. EDTA could release the sorbed Pb(II) ions from MCS@TiO2 with a recovery above 92% after three sorption-desorption cycles. The novel synthesized nanosorbent is evidenced to be an excellent solid phase extractor for Pb(II) ions from wastewaters.

  9. Bioremoval of Basic Violet 3 and Acid Blue 93 by Pseudomonas putida and its adsorption isotherms and kinetics.

    PubMed

    Arunarani, A; Chandran, Preethy; Ranganathan, B V; Vasanthi, N S; Sudheer Khan, S

    2013-02-01

    Basic Violet 3 and Acid Blue 93 are the most important group of synthetic colourants extensively used in textile industries for dyeing cotton, wool, silk and nylon. Release of these dye pollutants in to the environment adversely affects the human health and aquatic organisms. The present study we used Pseudomonas putida MTCC 4910 for the adsorptive removal of Basic Violet 3 and Acid Blue 93 from the aqueous solutions. The pH (4-9) and NaCl concentrations (1mM-1M) did not influence the adsorption process. The equilibrium adsorption process fitted well to Freundlich model than Langmuir model. The kinetics of adsorption fitted well by pseudo-second-order. Thus in the present study an attempt has been made to exploit the dye removal capability of P. putida MTCC 4910, and it was found to be an efficient microbe that could be used for bio removal of dyes from textile effluents.

  10. Kinetic Model for Surface-Active Enzymes Based on the Langmuir Adsorption Isotherm: Phospholipase C (Bacillus cereus) Activity toward Dimyristoyl Phosphatidylcholine/Detergent Micelles

    NASA Astrophysics Data System (ADS)

    Burns, Ramon A.; El-Sayed, Maha Y.; Roberts, Mary F.

    1982-08-01

    A simple kinetic model for the enzymatic activity of surface-active proteins against mixed micelles has been developed. This model uses the Langmuir adsorption isotherm, the classic equation for the binding of gas molecules to metal surfaces, to characterize enzyme adsorption to micelles. The number of available enzyme binding sites is equated with the number of substrate and inhibitor molecules attached to micelles; enzyme molecules are attracted to the micelle due to the affinity of the enzyme active site for the molecules in the micelle. Phospholipase C (Bacillus cereus) kinetics in a wide variety of dimyristoyl phosphatidylcholine/detergent micelles are readily explained by this model and the assumption of competitive binding of the detergent at the enzyme active site. Binding of phospholipase C to pure detergent micelles is demonstrated by gel filtration chromatography. The experimentally determined enzyme-detergent micelle binding constants are used directly in the rate equation. The Langmuir adsorption model predicts a variety of the characteristics observed for phospholipase kinetics, such as differential inhibition by various charged, uncharged, and zwitterionic detergents and surface-dilution inhibition. The essential idea of this model, that proteins can be attracted and bound to bilayers or micelles by possessing a binding site for the molecules composing the surface, may have wider application in the study of water-soluble (extrinsic) protein-membrane interactions.

  11. Near-isothermal furnace for in situ and real time X-ray radiography solidification experiments.

    PubMed

    Becker, M; Dreißigacker, C; Klein, S; Kargl, F

    2015-06-01

    In this paper, we present a newly developed near-isothermal X-ray transparent furnace for in situ imaging of solidification processes in thin metallic samples. We show that the furnace is ideally suited to study equiaxed microstructure evolution and grain interaction. To observe the growth dynamics of equiaxed dendritic structures, a minimal temperature gradient across the sample is required. A uniform thermal profile inside a circular sample is achieved by positioning the sample in the center of a cylindrical furnace body surrounded by a circular heater arrangement. Performance tests with the hypo-eutectic Al-15wt.%Cu and the near-eutectic Al-33wt.%Cu alloys validate the near-isothermal character of the sample environment. Controlled cooling rates of less than 0.5 K min(-1) up to 10 K min(-1) can be achieved in a temperature range of 720 K-1220 K. Integrated in our rotatable laboratory X-ray facility, X-RISE, the furnace provides a large field of view of 10.5 mm in diameter and a high spatial resolution of ∼4 μm. With the here presented furnace, equiaxed dendrite growth models can be rigorously tested against experiments on metal alloys by, e.g., enabling dendrite growth velocities to be determined as a function of undercooling or solutal fields in front of the growing dendrite to be measured.

  12. Near-isothermal furnace for in situ and real time X-ray radiography solidification experiments

    SciTech Connect

    Becker, M. Dreißigacker, C.; Klein, S.; Kargl, F.

    2015-06-15

    In this paper, we present a newly developed near-isothermal X-ray transparent furnace for in situ imaging of solidification processes in thin metallic samples. We show that the furnace is ideally suited to study equiaxed microstructure evolution and grain interaction. To observe the growth dynamics of equiaxed dendritic structures, a minimal temperature gradient across the sample is required. A uniform thermal profile inside a circular sample is achieved by positioning the sample in the center of a cylindrical furnace body surrounded by a circular heater arrangement. Performance tests with the hypo-eutectic Al-15wt.%Cu and the near-eutectic Al-33wt.%Cu alloys validate the near-isothermal character of the sample environment. Controlled cooling rates of less than 0.5 K min{sup −1} up to 10 K min{sup −1} can be achieved in a temperature range of 720 K–1220 K. Integrated in our rotatable laboratory X-ray facility, X-RISE, the furnace provides a large field of view of 10.5 mm in diameter and a high spatial resolution of ∼4 μm. With the here presented furnace, equiaxed dendrite growth models can be rigorously tested against experiments on metal alloys by, e.g., enabling dendrite growth velocities to be determined as a function of undercooling or solutal fields in front of the growing dendrite to be measured.

  13. Isothermal Dendritic Growth Experiment - Science, engineering, and hardware development for USMP space flights

    NASA Technical Reports Server (NTRS)

    Glicksman, M. E.; Hahn, R. C.; Koss, M. B.; Tirmizi, S. H.; Selleck, M. E.; Velosa, A.; Winsa, E.

    1991-01-01

    The Isothermal Dendritic Growth Experiment (IDGE) has been designed to provide microgravity data on dendritic growth for a critical test of theory. This paper updates progress on constructing a crystal growth chamber suitable for space flight. The IDGE chamber is constructed from glass and stainless steel and is hermetically sealed by electron beam welds and glass-metal seals. Initial tests of the chambers sample's melting point plateau show that the new chamber design is capable of preserving the 99.9995 percent purity of succinonitrile. Dendrite growth can be initiated in the center of the IDGE chamber by means of thermo-electric coolers and a capillary injector tube (stinger). The new IDGE chamber is ready for fully integrated tests with the prototype IDGE engineering hardware at NASA's Lewis Research Center.

  14. Precipitation and surface adsorption of metal complexes during electropolishing. Theory and characterization with X-ray nanotomography and surface tension isotherms.

    PubMed

    Nave, Maryana I; Chen-Wiegart, Yu-chen Karen; Wang, Jun; Kornev, Konstantin G

    2015-09-21

    Electropolishing of metals often leads to supersaturation conditions resulting in precipitation of complex compounds. The solubility diagrams and Gibbs adsorption isotherms of the electropolishing products are thus very important to understand the thermodynamic mechanism of precipitation of reaction products. Electropolishing of tungsten wires in aqueous solutions of potassium hydroxide is used as an example illustrating the different thermodynamic scenarios of electropolishing. Electropolishing products are able to form highly viscous films immiscible with the surrounding electrolyte or porous shells adhered to the wire surface. Using X-ray nanotomography, we discovered a gel-like phase formed at the tungsten surface during electropolishing. The results of these studies suggest that the electropolishing products can form a rich library of compounds. The surface tension of the electrolyte depends on the metal oxide ions and alkali-metal complexes.

  15. Successful Isothermal Dendritic Growth Experiment (IDGE) Proves Current Theories of Dendritic Solidification are Flawed

    NASA Technical Reports Server (NTRS)

    1996-01-01

    The scientific objective of the Isothermal Dendritic Growth Experiment (IDGE) is to test fundamental assumptions about dendritic solidification of molten materials. "Dendrites"-- from the ancient Greek word for tree--are tiny branching structures that form inside molten metal alloys when they solidify during manufacturing. The size, shape, and orientation of the dendrites have a major effect on the strength, ductility (ability to be molded or shaped), and usefulness of an alloy. Nearly all of the cast metal alloys used in everyday products (such as automobiles and airplanes) are composed of thousands to millions of tiny dendrites. Gravity, present on Earth, causes convection currents in molten alloys that disturb dendritic solidification and make its precise study impossible. In space, gravity is negated by the orbiting of the space shuttle. Consequently, IDGE (which was conducted on the space shuttle) gathered the first precise data regarding undisturbed dendritic solidification. IDGE is a microgravity materials science experiment that uses an apparatus which was designed, built, tested, and operated by people from the NASA Lewis Research Center. This experiment was conceived by the principal investigator, Professor Martin E. Glicksman, from Rensselaer Polytechnic Institute in Troy, New York. The experiment was a team effort of Lewis civil servants, contractors from Aerospace Design & Fabrication Inc. (ADF), and personnel at Rensselaer.

  16. Optimization of simultaneous ultrasound assisted toxic dyes adsorption conditions from single and multi-components using central composite design: Application of derivative spectrophotometry and evaluation of the kinetics and isotherms.

    PubMed

    Sharifpour, Ebrahim; Haddadi, Hedayat; Ghaedi, Mehrorang

    2017-05-01

    Present study is devoted on the efficient application of Sn (O, S)-NPs -AC for simultaneous sonicated accelerated adsorption of some dyes from single and multi-components systems. Sn (O, S) nanoparticles characterization by FESEM, EDX, EDX mapping and XRD revel its nano size structure with high purity of good crystallinity. Present adsorbent due to its nano spherical shape particles with approximate diameter of 40-60nm seems to be highly effective in this regard. The effects of five variables viz. pH (3.5-9.5), 0.010-0.028g of adsorbent and 0.5-6.5min mixing by sonication is good and practical conditions for well and expected adsorption of MB and CV over concentration range of 3-15mgL(-1). Combination of response surface methodology (RSM) based on central composite design (CCD) and subsequent of analysis of variance (ANOVA) and t-test statistics were used to test the significance of the independent variables and their interactions. Regression analysis reveal that experimental data with high repeatability and efficiency well represented by second-order polynomial model with coefficient of determination value of 0.9988 and 0.9976 for MB and CV, respectively following conditions like pH 8.0, 0.016g adsorbent, 15mgL(-1) of both dyes 4min sonication time is proportional with achievement of experimental removal percentage of 99.80% of MB and 99.87% of CV in batch experiment. Evaluation and estimation of adsorption data with Langmuir and Freundlich isotherm well justify the results based on their correlation coefficient and error analysis confirm that Langmuir model is good model with adsorption capacity of 109.17 and 115.34mgg(-1) in single system and 95.69 and 102.99mgg(-1) in binary system for MB and CV, respectively. MB and CV kinetic and rate of adsorption well fitted by pseudo-second order equation both in single and binary systems and experimental results denote more and favorable adsorption of CV than respective value in single system. The pseudo-second-order rate

  17. Comparative Study on the Implication of Three Nanoparticles on the Removal of Trichloroethylene by Adsorption - The Pilot and Rapid Small-Scale Column Tests

    EPA Science Inventory

    The impact of three commercially-available nanoparticles (NPs) on trichloroethylene (TCE) adsorption onto granular activated carbon (GAC) was investigated. TCE Adsorption isotherm and column breakthrough experiments were conducted in the presence and absence of silicon dioxide (S...

  18. Evaluation of the stability of aspirin in solid state by the programmed humidifying and non-isothermal experiments.

    PubMed

    Li, Lin-Li; Zhan, Xian-Cheng; Tao, Jian-Lin

    2008-03-01

    The influence of both moisture and heat on the stability of aspirin was investigated by a single pair of experiments, one with programmed humidity control and the other non-isothermal, rather than many standard isothermal studies, each at constant relative humidity. In experiments, we adopted the acid-base back titration method to measure the content of aspirin in the presence of its degradation products. It was found that the degradation of aspirin could be expressed as ln[(c0-c)/c]=kt+D, where D was a lag time item not related to humidity and temperature. The relationship between the degradation rate constant k and humidity Hr) and temperature T could be described as Arrhenius equation multiplied by an exponential item of relative humidity: k = A . exp(mHr) . exp(-(Ea/RT)), where A, Ea and m were the pre-exponential factor, observed activation energy, and a parameter related to humidity, respectively. The results obtained from the programmed humidifying and non-isothermal experiments, A=(1.09+/-2.04)x10(12) h(-1), Ea=(93.5+/-2.2) kJ . mol(-1) and m=1.18+/-0.19, were comparable to those from isothermal studies at constant humidity, A=(1.71+/-0.35)x10(12) h(-1), Ea=(94.9+/-0.7) kJ . mol(-1) and m=1.20+/-0.02. Since the programmed humidifying and non-isothermal experiments save time, labor and materials, it is suggested that the new experimental method can be used to investigate the stability of drugs unstable to both moisture and heat, instead of many classical isothermal experiments at constant humidity.

  19. A review on zinc and nickel adsorption on natural and modified zeolite, bentonite and vermiculite: examination of process parameters, kinetics and isotherms.

    PubMed

    Malamis, S; Katsou, E

    2013-05-15

    Adsorption and ion exchange can be effectively employed for the treatment of metal-contaminated wastewater streams. The use of low-cost materials as sorbents increases the competitive advantage of the process. Natural and modified minerals have been extensively employed for the removal of nickel and zinc from water and wastewater. This work critically reviews existing knowledge and research on the uptake of nickel and zinc by natural and modified zeolite, bentonite and vermiculite. It focuses on the examination of different parameters affecting the process, system kinetics and equilibrium conditions. The process parameters under investigation are the initial metal concentration, ionic strength, solution pH, adsorbent type, grain size and concentration, temperature, agitation speed, presence of competing ions in the solution and type of adsorbate. The system's performance is evaluated with respect to the overall metal removal and the adsorption capacity. Furthermore, research works comparing the process kinetics with existing reaction kinetic and diffusion models are reviewed as well as works examining the performance of isotherm models against the experimental equilibrium data.

  20. Non-Isothermic Chemical Kinetics in the Undergraduate Laboratory: Arrhenius Parameters from Experiments with Hyperbolic Temperature Variation.

    ERIC Educational Resources Information Center

    Salvador, F.; And Others

    1984-01-01

    Describes a method which adapts itself to the characteristics of the kinetics of a chemical reaction in solution, enabling students to determine the Arrhenius parameters with satisfactory accuracy by means of a single non-isothermic experiment. Both activation energy and the preexponential factor values can be obtained by the method. (JN)

  1. Phycoremediation and adsorption isotherms of cadmium and copper ions by Merismopedia tenuissima and their effect on growth and metabolism.

    PubMed

    Fawzy, Mustafa A

    2016-09-01

    The current study tends to investigate the removal of cadmium and copper ions by Merismopedia tenuissima, grown in different concentrations of cadmium and copper ions, as well to investigate their effects on growth and metabolism. Sorption isotherms of Langmuir and Freundlich were obtained for the quantitative description of cadmium and copper uptake by M. tenuissima. Langmuir model adequately to describe the data of biosorption for these metals. However, the Freundlich model could work well in case of Cu(2+) only. M. tenuissima appears to be more efficient for removing Cd(2+) ions than Cu(2+). However, the affinity constant of Cu(2+) on the biomass of M. tenuissima was higher than Cd(2+) indicating that M. tenuissima is more tolerant to Cd(2+) phytotoxicity than Cu(2+). FTIR analysis of algae with and without biosorption revealed the presence of carboxyl, amino, amide and hydroxyl groups, which were responsible for biosorption of Cd(+2) and Cu(+2) ions.

  2. The Isothermal Dendritic Growth Experiment (IDGE): USMP-4 One-Year-Report

    NASA Technical Reports Server (NTRS)

    Glicksman, M. E.; Koss, M. B.; LaCombe, J. C.; Lupulescu, A. O.; Malarik, D. C.

    1999-01-01

    Dendrites describe the tree-like crystal morphology commonly assumed in many material systems--particularly in metals and alloys that freeze from supercooled or supersaturated melts. There remains a high level of engineering interest in dendritic solidification because of the role of dendrites in the determination of cast alloy microstructures. Microstructure plays a key role in determining the physical properties of cast or welded products. In addition, dendritic solidification provides an example of non-equilibrium physics and is one of the simplest non-trivial examples of dynamic pattern formation, where an amorphous melt, under simple starting conditions, evolves into a complex ramified microstructure. Although it is well-known that dendritic growth is controlled by the transport of latent heat from the moving solid-melt interface as the dendrite advances into a supercooled melt, an accurate, and predictive model has not been developed. Current theories consider: 1) the transfer of heat or solute from the solid-liquid interface into the melt, and 2) the interfacial crystal growth and growth selection physics for the interface. However, the effects of gravity-induced convection on the transfer of heat from the interface prevent either element from being adequately tested solely under terrestrial conditions. The Isothermal Dendritic Growth Experiment (IDGE) constituted a series of three NASA-supported microgravity experiments, all of which flew aboard the space shuttle, Columbia. This experimental space flight series was designed and operated to grow and record dendrite solidification in the absence of gravity-induced convective heat transfer, and thereby produce a wealth of benchmark-quality data for testing solidification scaling laws. The data collection from the on-orbit phase of the IDGE flight series is now complete. We are currently completing analyses and moving towards final data archiving.

  3. Adsorption in single-walled carbon nanotubes by experiments and molecular simulation II: Effect of morphology and temperature on organic adsorption

    USGS Publications Warehouse

    Agnihotri, S.; Rostam-Abadi, M.; Mota, J.P.B.; Rood, M.J.

    2005-01-01

    Hexane adsorption on single-walled carbon nanotube (SWNT) bundles was studied. Hexane adsorption capacities of two purified SWNT samples was gravimetrically determined at isothermal conditions of 25??, 37??, and 50??C for 10-4 < p/po < 0.9, where p/po is hexane vapor pressure relative to its saturation pressure. Simulation of hexane adsorption under similar temperature and pressure conditions were performed on the external and internal sites of nanotube bundles of diameters same as those in experimental samples. The simulations could predict isotherms for a hypothetical scenario where all nanotubes in a sample would be open. This is an abstract of a paper presented at the AIChE Annual Meeting and Fall Showcase (Cincinnati, OH 10/30/2005-11/4/2005).

  4. Effects of Humidity Swings on Adsorption Columns for Air Revitalization: Modeling and Experiments

    NASA Technical Reports Server (NTRS)

    LeVan, M. Douglas; Finn, John E.

    1997-01-01

    Air purification systems are necessary to provide clean air in the closed environments aboard spacecraft. Trace contaminants are removed using adsorption. One major factor concerning the removal of trace contaminants is relative humidity. Water can reduce adsorption capacity and, due to constant fluctuations, its presence is difficult to incorporate into adsorption column designs. The purpose of the research was to allow for better design techniques in trace contaminant adsorption systems, especially for feeds with water present. Experiments and mathematical modeling research on effects of humidity swings on adsorption columns for air revitalization were carried out.

  5. Adsorption of thorium from aqueous solutions by perlite.

    PubMed

    Talip, Z; Eral, M; Hiçsönmez, U

    2009-02-01

    The use of expanded perlite for the adsorption of thorium from aqueous solution by batch technique is presented. The effects of particle size, pH of the solution, initial thorium concentration, shaking time, V/m ratio and temperature were determined. It was found that the adsorption capacity increases by the increase in the pH of the suspensions. The rate of thorium adsorption on expanded perlite was observed to be fast in the first hour of the reaction time. Adsorption isotherms were expressed by Langmuir and Freundlich adsorption models and the adsorption experiments conducted at 30 +/- 1 degrees C showed that the adsorption isotherms correlated well with the Langmuir model. From the adsorption data, thermodynamic parameters such as DeltaG(o), DeltaH(o) and DeltaS(o) were calculated as a function of temperature.

  6. Isotherms and kinetic study of dihydrogen and hydrogen phosphate ions (H{2}PO{4}- and HPO{4}2-) adsorption onto crushed plant matter of the semi-arid zones of Morocco: Asphodelus microcarpus, Asparagus albus and Senecio anthophorbium

    NASA Astrophysics Data System (ADS)

    Chiban, M.; Benhima, H.; Saadi, B.; Nounah, A.; Sinan, F.

    2005-03-01

    In the present work H{2}PO4- and HPO42- ions adsorption onto organic matter (OM) obtained from ground dried three plants growing in arid zones of Morocco has been studied. The adsorption process is affected by various parameters such as contact time, particle size and initial concentration of phosphate solution (Ci ≤ 30 mg/l). The uptake of both ions is increased by increasing the concentration of them selves. The retention of phosphate ions by Asphodelus microcarpus, Asparagus albus are well defined by several isotherms such as the Langmuir, Temkin and Freundlich.

  7. Multilayer adsorption on fractal surfaces.

    PubMed

    Vajda, Péter; Felinger, Attila

    2014-01-10

    Multilayer adsorption is often observed in liquid chromatography. The most frequently employed model for multilayer adsorption is the BET isotherm equation. In this study we introduce an interpretation of multilayer adsorption measured on liquid chromatographic stationary phases based on the fractal theory. The fractal BET isotherm model was successfully used to determine the apparent fractal dimension of the adsorbent surface. The nonlinear fitting of the fractal BET equation gives us the estimation of the adsorption equilibrium constants and the monolayer saturation capacity of the adsorbent as well. In our experiments, aniline and proline were used as test molecules on reversed phase and normal phase columns, respectively. Our results suggest an apparent fractal dimension 2.88-2.99 in the case of reversed phase adsorbents, in the contrast with a bare silica column with a fractal dimension of 2.54.

  8. Effect of grain size on uranium(VI) surface complexation kinetics and adsorption additivity.

    PubMed

    Shang, Jianying; Liu, Chongxuan; Wang, Zheming; Zachara, John M

    2011-07-15

    The contribution of variable grain sizes to uranium adsorption/desorption was studied using a sediment from the US DOE Hanford site. The sediment was wet sieved into four size fractions: coarse sand (1-2 mm), medium sand (0.2-1 mm), fine sand (0.053-0.2 mm), and clay/silt fraction (<0.053 mm). For each size fraction and their composite (sediment), batch and flow-cell experiments were performed to determine uranium adsorption isotherms and kinetic uranium adsorption and subsequent desorption. The results showed that uranium adsorption isotherms and adsorption/desorption kinetics were size specific, reflecting the effects of size-specific adsorption site concentration and kinetic rate constants. The larger-size fraction had a larger mass percentage in the sediment but with a smaller adsorption site concentration and generally a slower uranium adsorption/desorption rate. The same equilibrium surface complexation reaction and reaction constant could describe uranium adsorption isotherms for all size fractions and the composite after accounting for the effect of adsorption site concentration. Mass-weighted, linear additivity was observed for both uranium adsorption isotherms and adsorption/desorption kinetics in the composite. One important implication of this study is that grain-size distribution may be used to estimate uranium adsorption site and adsorption/desorption kinetic rates in heterogeneous sediments from a common location.

  9. A Simple Rate Law Experiment Using a Custom-Built Isothermal Heat Conduction Calorimeter

    ERIC Educational Resources Information Center

    Wadso, Lars; Li, Xi.

    2008-01-01

    Most processes (whether physical, chemical, or biological) produce or consume heat: measuring thermal power (the heat production rate) is therefore a typical method of studying processes. Here we describe the design of a simple isothermal heat conduction calorimeter built for use in teaching; we also provide an example of its use in simultaneously…

  10. High resolution N2 adsorption isotherms at 77.4 K and 87.3 K by carbon blacks and activated carbon fibers--analysis of porous texture of activated carbon fibers by αs-method.

    PubMed

    Nakai, Kazuyuki; Nakada, Yoko; Hakuman, Masako; Yoshida, Masayuki; Senda, Yousuke; Tateishi, Yuko; Sonoda, Joji; Naono, Hiromitsu

    2012-02-01

    The standard α(s)-data of N(2) at 87.3 K by graphitized and nongraphitized carbon black samples (GCB-I and NGCB) (cf.Figs. 3 and 4) have been determined on the basis of the high resolution adsorption isotherms of N(2) at 87.3 K, which were repeatedly measured in the pressure range of p/p(o)=5×10(-8)-0.4. The high resolution adsorption isotherms of N(2) by two kinds of activated carbon fibers (ACF-I and ACF-II) were measured from p/p(o)=10(-7) to p/p(o)=0.995 at 77.4 K and from p/p(o)=10(-7) to p/p(o)=0.4 at 87.3 K. Combination of the adsorption isotherms by ACF-I and ACF-II with the standard α(s)-data by NGCB at 77.4 K and 87.3 K make it possible to construct the high resolution α(s)-plots from very low filling (1%) to complete filling (100%). The high resolution α(s)-plots of N(2) at 77.4 K and 87.3 K were analyzed. On the basis of the analyzed result, the porous textures of ACF-I and ACF-II will be discussed.

  11. Theoretical consideration of the use of a Langmuir adsorption isotherm to describe the effect of light intensity on electron transfer in photosystem II.

    PubMed

    Fragata, Mário; Viruvuru, Venkataramanaiah; Dudekula, Subhan

    2007-03-29

    Electron transport through photosystem II (PSII), measured as oxygen evolution, was investigated in isolated PSII particles and thylakoid membranes irradiated with white light of intensities (I) of 20 to about 4000 micromol of photons/(m2.s). In steady-state conditions, the evolution of oxygen varies with I according to the hyperbolic expression OEth = OEth(max)I/(L1/2 + I) (eq i) where OEth is the theoretical oxygen evolution, OEth(max) is the maximum oxygen evolution, and L1/2 is the light intensity giving OEth(max)/2. In this work, the mathematical derivation of this relationship was performed by using the Langmuir adsorption isotherm and assuming that the photon interaction with the chlorophyll (Chl) in the PSII reaction center is a heterogeneous reaction in which the light is represented as a stream of particles instead of an electromagnetic wave (see discussion in Turro, N. J. Modern Molecular Photochemistry; University Science Books: Mill Valley, CA, 1991). In accordance with this approximation, the Chl molecules (P680) were taken as the adsorption surfaces (or heterogeneous catalysts), and the incident (or exciting) photons as the substrate, or the reagent. Using these notions, we demonstrated that eq i (Langmuir equation) is a reliable interpretation of the photon-P680 interaction and the subsequent electron transfer from the excited state P680, i.e., P680*, to the oxidized pheophytin (Phe), then from Phe- to the primary quinone QA. First, eq i contains specific functional and structural information that is apparent in the definition of OEth(max) as a measure of the maximal number of PSII reaction centers open for photochemistry, and L1/2 as the equilibrium between the electron transfer from Phe- to QA and the formation of reduced Phe in the PSII reaction center by electrons in provenance from P680*. Second, a physiological control mechanism in eq i is proved by the observation that the magnitudes of OEth(max) and L1/2 are affected differently by exogenous

  12. A Biomedical Application of Activated Carbon Adsorption: An Experiment Using Acetaminophen and N-Acetylcysteine.

    ERIC Educational Resources Information Center

    Rybolt, Thomas R.; And Others

    1988-01-01

    Illustrates an interesting biomedical application of adsorption from solution and demonstrates some of the factors that influence the in vivo adsorption of drug molecules onto activated charcoal. Uses acetaminophen and N-acetylcysteine for the determination. Suggests several related experiments. (MVL)

  13. Adsorption of natural organic matter and disinfection byproduct precursors from surface water onto TiO2 nanoparticles: pH effects, isotherm modelling and implications for using TiO2 for drinking water treatment.

    PubMed

    Gora, Stephanie L; Andrews, Susan A

    2017-05-01

    Titanium dioxide is a photocatalyst that can remove organic contaminants of interest to the drinking water treatment industry, including natural organic matter (NOM) and disinfection byproduct (DBP) precursors. The photocatalytic reaction occurs in two steps: adsorption of the contaminant followed by degradation of the adsorbed contaminant upon irradiation with UV light. The second part of this process can lead to the formation of reactive intermediates and negative impacts on treated water quality, such as increased DBP formation potential (DBPfp). Adsorption alone does not result in the formation of reactive intermediates and thus may prove to be a safe way to incorporate TiO2 into drinking water treatment processes. The goal of this study was to expand on the current understanding of NOM adsorption on TiO2 and examine it in a drinking water context by observing NOM adsorption from real water sources and evaluating the effects of the resulting reductions on the DBPfp of the treated water. Bottle point isotherm tests were conducted with raw water from two Canadian water treatment plants adjusted to pH 4, pH 6 and pH 8 and dosed with TiO2 nanoparticles. The DOC results were a good fit to a modified Freundlich isotherm. DBP precursors and liquid chromatography with organic carbon detection NOM fractions associated with DBP formation were removed to some extent at all pHs, but most effectively at pH 4.

  14. Design, construction, and calibration of an isothermal titration calorimeter and its application in the study of the adsorption of phenolic compounds

    NASA Astrophysics Data System (ADS)

    Moreno-Piraján, Juan Carlos; Giraldo, Liliana

    2012-01-01

    An isothermal calorimetric titration was designed and built, and some of the results obtained are presented here. For this purpose, a Calvet heat-conducting microcalorimeter was developed and connected to a titration unit built for this experiment to record titration thermograms. The microcalorimeter was electrically calibrated to establish its sensitivity and reproducibility, obtaining K = 13.56 ± 0.21 W V-1. Additionally, the equipment was tested using the heat of neutralisation for the tris-hydroxymethyl-aminomethane-HCl (THAM-HCl) system, obtaining ΔH = -30.92 ± 0.03 kJ mol-1. The unit was assembled to obtain titration heats and the corresponding thermodynamic variables (ΔH, ΔG, ΔS, and Ke) with a system of phenolic derivatives-activated carbon (synthesised from potato peel).

  15. Design, construction, and calibration of an isothermal titration calorimeter and its application in the study of the adsorption of phenolic compounds.

    PubMed

    Moreno-Piraján, Juan Carlos; Giraldo, Liliana

    2012-01-01

    An isothermal calorimetric titration was designed and built, and some of the results obtained are presented here. For this purpose, a Calvet heat-conducting microcalorimeter was developed and connected to a titration unit built for this experiment to record titration thermograms. The microcalorimeter was electrically calibrated to establish its sensitivity and reproducibility, obtaining K = 13.56 ± 0.21 W V(-1). Additionally, the equipment was tested using the heat of neutralisation for the tris-hydroxymethyl-aminomethane-HCl (THAM-HCl) system, obtaining ΔH = -30.92 ± 0.03 kJ mol(-1). The unit was assembled to obtain titration heats and the corresponding thermodynamic variables (ΔH, ΔG, ΔS, and K(e)) with a system of phenolic derivatives-activated carbon (synthesised from potato peel).

  16. Effect of Grain Size on Uranium(VI) Surface Complexation Kinetics and Adsorption Additivity

    SciTech Connect

    Shang, Jianying; Liu, Chongxuan; Wang, Zheming; Zachara, John M.

    2011-07-27

    Laboratory experiments were performed to investigate the contribution of variable grain sizes to uranium adsorption/desorption in a sediment collected from the US DOE Hanford site. The sediment was wet-sieved into four size fractions: coarse sand (1-2 mm), medium sand (0.2-1 mm), fine sand (0.05-0.2 mm), and clay/silt fraction (< 0.05mm). For each size fraction and their composite (sediment), batch experiments were performed to determine uranium adsorption isotherms, and stirred flow-cell experiments were conducted to derive kinetic data of uranium adsorption and subsequent desorption. The results showed that uranium adsorption isotherms and adsorption/desorption kinetics were size-specific, reflecting the effects of size-specific adsorption site concentration and kinetic rate constants. The larger-size fraction had a larger mass percentage in the sediment, but with a smaller adsorption site concentration and generally a slower uranium adsorption/desorption rate. The same equilibrium surface complexation reaction and reaction constant could describe uranium adsorption isotherms for all size fractions and the composite after accounting for the effect of adsorption site concentration. Mass-weighted, linear additivity was observed for both uranium adsorption isotherms and adsorption/desorption kinetics in the composite. Our analysis also showed that uranium adsorption site concentration estimated from the adsorption isotherms was 3 orders of magnitude less than a site concentration estimated from sediment surface area and generic site density. One important implication of this study is that grain size distribution may be used to estimate uranium adsorption site, and adsorption/desorption kinetic rates in heterogeneous sediments from a common location.

  17. Insights into tetracycline adsorption onto kaolinite and montmorillonite: experiments and modeling.

    PubMed

    Zhao, Yanping; Gu, Xueyuan; Li, Shiyin; Han, Ruiming; Wang, Guoxiang

    2015-11-01

    Adsorption of tetracycline (TC) on kaolinite and montmorillonite was investigated using batch adsorption experiments with different pH, ionic strength, and surface coverage. As a result, pH and ionic strength-dependent adsorption of TC was observed for the two clay minerals. The adsorption of TC decreased with the increase of pH and ionic strength, and high initial TC concentration had high adsorption. In addition, a triple-layer model was used to predict the adsorption and surface speciation of TC on the two minerals. As a result, four complex species on kaolinite (≡X(-)∙H3TC(+), ≡X(-)∙H2TC(±), ≡SOH(0)∙H2TC(±), and ≡SOH(0)∙HTC(-)) and three species on montmorillonite (≡X(-)∙H3TC(+), ≡X(-)∙H2TC(±), and ≡SOH(0)∙HTC(-)) were structurally constrained by spectroscopy, and these species were also successfully fitted to the adsorption edges of TC. Three functional groups of TC were involved in these adsorption reactions, including the positively charged dimethylamino group, the C=O amide I group, and the C=O group at the C ring. Combining adsorption experiments and model in this study, the adsorption of TC on kaolinite and montmorillonite was mainly attributed to cation exchange on the surface sites (≡X(-)) compared to surface complexation on the edge sites (≡SOH) at natural soil pH condition. Moreover, the surface adsorption species, the corresponding adsorption modes, and the binding constants for the surface reactions were also estimated.

  18. Combined Yamamoto approach for simultaneous estimation of adsorption isotherm and kinetic parameters in ion-exchange chromatography.

    PubMed

    Rüdt, Matthias; Gillet, Florian; Heege, Stefanie; Hitzler, Julian; Kalbfuss, Bernd; Guélat, Bertrand

    2015-09-25

    Application of model-based design is appealing to support the development of protein chromatography in the biopharmaceutical industry. However, the required efforts for parameter estimation are frequently perceived as time-consuming and expensive. In order to speed-up this work, a new parameter estimation approach for modelling ion-exchange chromatography in linear conditions was developed. It aims at reducing the time and protein demand for the model calibration. The method combines the estimation of kinetic and thermodynamic parameters based on the simultaneous variation of the gradient slope and the residence time in a set of five linear gradient elutions. The parameters are estimated from a Yamamoto plot and a gradient-adjusted Van Deemter plot. The combined approach increases the information extracted per experiment compared to the individual methods. As a proof of concept, the combined approach was successfully applied for a monoclonal antibody on a cation-exchanger and for a Fc-fusion protein on an anion-exchange resin. The individual parameter estimations for the mAb confirmed that the new approach maintained the accuracy of the usual Yamamoto and Van Deemter plots. In the second case, offline size-exclusion chromatography was performed in order to estimate the thermodynamic parameters of an impurity (high molecular weight species) simultaneously with the main product. Finally, the parameters obtained from the combined approach were used in a lumped kinetic model to simulate the chromatography runs. The simulated chromatograms obtained for a wide range of gradient lengths and residence times showed only small deviations compared to the experimental data.

  19. Surface area and pore size characteristics of nanoporous gold subjected to thermal, mechanical, or surface modification studied using gas adsorption isotherms, cyclic voltammetry, thermogravimetric analysis, and scanning electron microscopy.

    PubMed

    Tan, Yih Horng; Davis, Jason A; Fujikawa, Kohki; Ganesh, N Vijaya; Demchenko, Alexei V; Stine, Keith J

    2012-01-01

    Nitrogen adsorption/desorption isotherms are used to investigate the Brunauer, Emmett, and Teller (BET) surface area and Barrett-Joyner-Halenda (BJH) pore size distribution of physically modified, thermally annealed, and octadecanethiol functionalized np-Au monoliths. We present the full adsorption-desorption isotherms for N(2) gas on np-Au, and observe type IV isotherms and type H1 hysteresis loops. The evolution of the np-Au under various thermal annealing treatments was examined using scanning electron microscopy (SEM). The images of both the exterior and interior of the thermally annealed np-Au show that the porosity of all free standing np-Au structures decreases as the heat treatment temperature increases. The modification of the np-Au surface with a self-assembled monolayer (SAM) of C(18)-SH (coverage of 2.94 × 10(14) molecules cm(-2) based from the decomposition of the C(18)-SH using thermogravimetric analysis (TGA)), was found to reduce the strength of the interaction of nitrogen gas with the np-Au surface, as reflected by a decrease in the 'C' parameter of the BET equation. From cyclic voltammetry studies, we found that the surface area of the np-Au monoliths annealed at elevated temperatures followed the same trend with annealing temperature as found in the BET surface area study and SEM morphology characterization. The study highlights the ability to control free-standing nanoporous gold monoliths with high surface area, and well-defined, tunable pore morphology.

  20. Adsorption selectivity: a way to homochirality? Computational experiments

    NASA Astrophysics Data System (ADS)

    Pauzat, F.; Ellinger, Y.; Markovits, A.

    2015-10-01

    Life, as we know it today, is inseparable from homochirality; standing within the panspermia hypothesis, we investigate computationally the still unknown origin of the enantiomeric excess present in the organic matter of well-defined families of meteorites [1,2,3] through the possibilities open by a selective adsorption of the enantiomers.

  1. Adsorption kinetics of laterally and polarly flagellated Vibrio.

    PubMed Central

    Belas, M R; Colwell, R R

    1982-01-01

    The adsorption of laterally and polarly flagellated bacteria to chitin was measured, and from the data obtained, a modified Langmuir adsorption isotherm was derived. Results indicated that the adsorption of laterally flagellated Vibrio parahaemolyticus follows the Langmuir adsorption isotherm, a type of adsorption referred to as surface saturation kinetics, when conditions are favorable for the production of lateral flagella. When conditions were not favorable for the production of lateral flagella, bacterial adsorption did not follow the Langmuir adsorption isotherm; instead, proportional adsorption kinetics were observed. The adsorption of some polarly flagellated bacteria exhibited surface saturation kinetics. However, the binding index (the product of the number of binding sites and bacterial affinity to the surface) of polarly flagellated bacteria differed significantly from that of laterally flagellated bacteria, suggesting that polarly flagellated bacteria adsorb to chitin by a different mechanism from that used by the laterally flagellated bacteria. From the results of dual-label adsorption competition experiments, in which polarly flagellated V. cholerae competed with increasing concentrations of laterally flagellated V. parahaemolyticus, it was observed that laterally flagellated bacteria inhibited the adsorption of polarly flagellated bacteria. In contrast, polarly flagellated bacteria enhanced the adsorption of V. cholerae. In competition experiments, where V. parahaemolyticus competed against increasing concentrations of other bacteria, polarly flagellated bacteria enhanced V. parahaemolyticus adsorption significantly, whereas laterally flagellated bacteria only slightly enhanced the process. The direct correlation observed between surface saturation kinetics, the production of lateral flagella, and the ability of laterally flagellated bacteria to inhibit the adsorption of polarly flagellated bacteria suggests that lateral flagella represent a

  2. Enhancement of the adsorption capacity of the light-weight expanded clay aggregate surface for the metronidazole antibiotic by coating with MgO nanoparticles: Studies on the kinetic, isotherm, and effects of environmental parameters.

    PubMed

    Kalhori, Ebrahim Mohammadi; Al-Musawi, Tariq J; Ghahramani, Esmaeil; Kazemian, Hossein; Zarrabi, Mansur

    2017-02-09

    The synthesized MgO nanoparticles were used to coat the light-weight expanded clay aggregates (LECA) and as a metronidazole (MNZ) adsorbent. X-ray diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM), and Fourier-transformed infrared (FTIR) techniques were employed to study the surface morphology and characteristics of the adsorbents. MgO/LECA clearly revealed the advantages of the nanocomposite particles, showing high specific surface area (76.12 m(2)/g), significant adsorption sites and functional groups. Between pH 5 and 9, the MNZ sorption was not significantly affected. Kinetic studies revealed that the MNZ adsorption closely followed the Avrami model, with no dominant process controlling the sorption rate. The study of the effects of foreign ions revealed that the addition of carbonate raised the MNZ removal efficiency of LECA by 8% and the total removal of MNZ by MgO/LECA. Furthermore, nitrate and hardness only marginally influenced the MNZ removal efficiency and their effects can be ranked in the order of carbonate>nitrate>hardness. The isotherm adsorption of MNZ was best fitted with the Langmuir model enlighten the monolayer MNZ adsorption on the homogeneous LECA and MgO/LECA surfaces. The maximum adsorption capacity under optimum conditions was enhanced from 56.31 to 84.55 mg/g for LECA and MgO/LECA, respectively. These findings demonstrated that the MgO/LECA nanocomposite showed potential as an efficient adsorbent for MNZ removal.

  3. Hydrocarbon adsorption on gold clusters: Experiment and quantum chemical modeling

    NASA Astrophysics Data System (ADS)

    Lanin, S. N.; Pichugina, D. A.; Shestakov, A. F.; Smirnov, V. V.; Nikolaev, S. A.; Lanina, K. S.; Vasil'Kov, A. Yu.; Zung, Fam Tien; Beletskaya, A. V.

    2010-12-01

    Heats of adsorption Q of n-alkanes C6-C9 on ZrO2 modified with gold and nickel nanoparticles were determined experimentally. The Q values were found to be higher on average by 7 kJ/mol on the modified samples as compared to the pure support. Density functional theory with the PBE functional and the pseudopotential for gold effectively allowing for relativistic corrections was used to model the adsorption of saturated hydrocarbons on Au and Au + Ni, as exemplified by the interaction of alkanes C1-C3 with Au m , Au m - 1Ni ( m = 3, 4, 5) clusters as well as the interaction of C1-C8 with Au20. Based on the calculation results, the probable coordination centers of alkanes on nanoparticle surfaces were found to be vertices and edges, whereas face localization was less probable.

  4. Adsorption of phenolic compound by aged-refuse.

    PubMed

    Xiaoli, Chai; Youcai, Zhao

    2006-09-01

    The adsorption of phenol, 2-chlorophenol, 4-chlorophenol and 2,4-dichlorophenol by aged-refuse has been studied. Adsorption isotherms have been determined for phenol, 2-chlorophenol, 4-chlorophenol and 2,4-dichlorophenol and the data fits well to the Freundlich equation. The chlorinated phenols are absorbed more strongly than the phenol and the adsorption capacity has an oblivious relationship with the numbers and the position of chlorine subsistent. The experiment data suggests that both the partition function and the chemical adsorption involve in the adsorption process. Pseudo-first-order and pseudo-second-order model were applied to investigate the kinetics of the adsorption and the results show that it fit the pseudo-second-order model. More than one step involves in the adsorption process and the overall rate of the adsorption process appears to be controlled by the chemical reaction. The thermodynamic analysis indicates that the adsorption is spontaneous and endothermic.

  5. Removal of microcystin-LR and microcystin-RR by graphene oxide: adsorption and kinetic experiments.

    PubMed

    Pavagadhi, Shruti; Tang, Ai Ling Lena; Sathishkumar, Muthuswamy; Loh, Kian Ping; Balasubramanian, Rajasekhar

    2013-09-01

    Graphene oxide (GO) was employed in the present study for removal of two commonly occurring algal toxins, microcystin-LR (MC-LR) and microcystin-RR (MC-RR), from water. The adsorption performance of GO was compared to that of commercially available activated carbon. Further, adsorption experiments were conducted in the presence of other environmental pollutants to understand the matrix effects of contaminated water on the selective adsorption of MC-LR and MC-RR onto GO. The environmental pollutants addressed in this study included different anions (nitrate NO3-, nitrite NO2-, sulphate SO4(2-), chloride (Cl(-)), phosphate PO4(3-) and fluoride (F(-))) and cations (sodium (Na(+)), potassium (K(+)), magnesium (Mg(2+)) and calcium (Ca(2+))). GO showed very a high adsorption capacity of 1700 μg/g for removal of MC-LR and 1878 μg/g for MC-RR while the maximum adsorption capacity obtained with the commercial activated carbon was 1481.7 μg/g and 1034.1 μg/g for MC-LR and MC-RR, respectively. The sorption kinetic experiments revealed that more than 90% removal of both MC-LR/RR was achieved within 5 min for all the doses studied (500, 700 and 900 μg/L). GO could be reused as an adsorbent following ten cycles of adsorption/desorption with no significant loss in its adsorption capacity.

  6. [Virus adsorption from batch experiments as influenced by air-water interface].

    PubMed

    Zhang, Hui; Zhao, Bing-zi; Zhang, Jia-bao; Zhang, Cong-zhi; Wang, Qiu-ying; Chen, Ji

    2007-12-01

    The presence of air-water interface in batch sorption experiments may result in inaccurate estimation of virus adsorption onto various soils. A batch sorption experiment was conducted to compare the adsorption results of MS2 in different soils under presence/absence of air-water interface. Soils with sterilization/nonterilization treatment were used. Virus recovery efficiency in a blank experiment (no soil) was also evaluated as affected by different amount of air-water interface. The presence of air-water interface altered the results of virus adsorption in different soils with different extent, with Sandy fluvo-aquic soil being the most considerably affected, followed by Red loam soil, and the least being Red clay soil, probably because of different soil properties associated with virus adsorption/inactivation. Soil sterilization resulted in more significant difference of virus adsorption onto the Sandy fluvo-aquic soil between the presence and absence of air-water interface, while a reduced difference was observed in the Red loam soil. The presence of air-water interface significantly decreased virus recovery efficiency, with the values being decreased with increase in the amount of air-water interface. Soil particles likely prohibit viruses from reaching the air-water interface or alter the forces at the solid-water-air interface so that the results from the blank experiment did not truly represent results from control blank, which probably resulted in adsorption difference between presence and absence of the air-water interface.

  7. Drop Tower Experiments on Non-isothermal Reorientation of Cryogenic Liquids

    NASA Astrophysics Data System (ADS)

    Kulev, Nikolai; Dreyer, Michael

    2010-10-01

    Capillary driven surface oscillations of liquid argon (Tsat = 87.3 K at 1,013 hPa) have been investigated in a partly filled right circular cylinder under non-isothermal boundary conditions. The oscillations take place during the reorientation from the normal gravity surface position towards a new position upon step reduction of gravity. The situation is similar to the end of thrust in a rocket tank when the cold propellant moves along the warmer tank wall driven by capillary forces. The aim was to investigate the influence of the temperature difference between the slightly subcooled cryogenic liquid and the superheated cylinder wall on the oscillations and their characteristics in a single-component, two-phase system. Axial wall temperature gradients of averaged 0.15 K/mm - 1.93 K/mm above the normal gravity surface position were implemented. A general dependence of the reorientation behavior on the gradient value was observed, concerning the apparent contact line behavior, the frequency and damping of the oscillations of the free surface center point, and the apparent contact angle. The behavior of the ullage pressure was found to follow the behavior of the contact line.

  8. Thermal Cycling and Isothermal Deformation Response of Polycrystalline NiTi: Simulations vs. Experiment

    NASA Technical Reports Server (NTRS)

    Manchiraju, Sivom; Gaydosh, Darrell; Benafan, Othmane; Noebe, Ronald; Vaidyanathan, Raj; Anderson, Peter M.

    2011-01-01

    A recent microstructure-based FEM model that couples crystal-based plasticity, the B2<-> MB190 phase transformation and anisotropic elasticity at the grain scale is calibrated to recent data for polycrystalline NiTi (49.9 at.% Ni). Inputs include anisotropic elastic properties, texture and differential scanning calorimetry data, as well as a subset of recent isothermal deformation and load-biased thermal cycling data. The model is assessed against additional experimental data. Several experimental trends are captured - in particular, the transformation strain during thermal cycling monotonically increases and reaches a peak with increasing bias stress. This is achieved, in part, by modifying the martensite hardening matrix proposed by Patoor et al. [Patoor E, Eberhardt A, Berveiller M. J Phys IV 1996;6:277]. Some experimental trends are underestimated - in particular, the ratcheting of macrostrain during thermal cycling. This may reflect a model limitation that transformation-plasticity coupling is captured on a coarse (grain) scale but not on a fine (martensitic plate) scale.

  9. Adsorptive removal of PPCPs by biomorphic HAP templated from cotton.

    PubMed

    Huang, Bin; Xiong, Dan; Zhao, Tingting; He, Huan; Pan, Xuejun

    2016-01-01

    Biomorphic nano-hydroxyapatite (HAP) was fabricated by a co-precipitation method using cotton as bio-templates and employed in adsorptive removal of ofloxacin (OFL) and triclosan (TCS) that are two representative pharmaceuticals and personal care products (PPCPs). The surface area and porosity, crystal phase, functional group, morphology and micro-structure of the synthesized HAP were characterized by Brunauer-Emmett-Teller isotherm, X-ray powder diffraction, Fourier transform infrared spectroscopy, scanning electron macroscopic and transmission electron microscopy. The effects of initial pH, ionic strength, initial concentration, contact time and temperature on the removal of PPCPs were studied in a batch experiment. The adsorption of OFL and TCS was rapid and almost accomplished within 50 min. Kinetic studies indicated that the adsorption process of OFL and TCS followed the pseudo-first-order and pseudo-second-order models, respectively. The Freundlich isotherm described the OFL adsorption process well but the adsorption of TCS fitted the Langmuir isotherm better. Thermodynamics and isotherm parameters suggested that both OFL and TCS adsorption were feasible and spontaneous. Hydrogen bond and Lewis acid-base reaction may be the dominating adsorption mechanism of OFL and TCS, respectively. Compared to other adsorbents, biomorphic HAP is environmentally friendly and has the advantages of high adsorption capacity, exhibiting potential application for PPCPs removal.

  10. Study on Adsorption of Cu(II) on Chitosan Nanofiber Membranes

    NASA Astrophysics Data System (ADS)

    Cao, Jianhua; Li, Dongzhou; Liang, Weihua; Wu, Dayong

    2014-12-01

    Chitosan nanofiber membranes by electrospinning technique were used to remove Cu(II) from aqueous solution. The adsorption kinetics, equilibrium isotherms, and pH effect were investigated in batch experiments. The Langmuir isotherm and pseudo second-order kinetic models agree well with the experimental data. The chitosan nanofiber membranes are effective for Cu(II) adsorption at pH6. Results showed that the maximum adsorption capacity of the chitosan nanofiber membranes with Cu(II) is 118.62 mg g-1. The chitosan nanofiber membranes can be used as an effective adsorbent for the removal of Cu(II) in aqueous solution due to high adsorption capacity.

  11. Unified superresolution experiments and stochastic theory provide mechanistic insight into protein ion-exchange adsorptive separations

    PubMed Central

    Kisley, Lydia; Chen, Jixin; Mansur, Andrea P.; Shuang, Bo; Kourentzi, Katerina; Poongavanam, Mohan-Vivekanandan; Chen, Wen-Hsiang; Dhamane, Sagar; Willson, Richard C.; Landes, Christy F.

    2014-01-01

    Chromatographic protein separations, immunoassays, and biosensing all typically involve the adsorption of proteins to surfaces decorated with charged, hydrophobic, or affinity ligands. Despite increasingly widespread use throughout the pharmaceutical industry, mechanistic detail about the interactions of proteins with individual chromatographic adsorbent sites is available only via inference from ensemble measurements such as binding isotherms, calorimetry, and chromatography. In this work, we present the direct superresolution mapping and kinetic characterization of functional sites on ion-exchange ligands based on agarose, a support matrix routinely used in protein chromatography. By quantifying the interactions of single proteins with individual charged ligands, we demonstrate that clusters of charges are necessary to create detectable adsorption sites and that even chemically identical ligands create adsorption sites of varying kinetic properties that depend on steric availability at the interface. Additionally, we relate experimental results to the stochastic theory of chromatography. Simulated elution profiles calculated from the molecular-scale data suggest that, if it were possible to engineer uniform optimal interactions into ion-exchange systems, separation efficiencies could be improved by as much as a factor of five by deliberately exploiting clustered interactions that currently dominate the ion-exchange process only accidentally. PMID:24459184

  12. Unified superresolution experiments and stochastic theory provide mechanistic insight into protein ion-exchange adsorptive separations.

    PubMed

    Kisley, Lydia; Chen, Jixin; Mansur, Andrea P; Shuang, Bo; Kourentzi, Katerina; Poongavanam, Mohan-Vivekanandan; Chen, Wen-Hsiang; Dhamane, Sagar; Willson, Richard C; Landes, Christy F

    2014-02-11

    Chromatographic protein separations, immunoassays, and biosensing all typically involve the adsorption of proteins to surfaces decorated with charged, hydrophobic, or affinity ligands. Despite increasingly widespread use throughout the pharmaceutical industry, mechanistic detail about the interactions of proteins with individual chromatographic adsorbent sites is available only via inference from ensemble measurements such as binding isotherms, calorimetry, and chromatography. In this work, we present the direct superresolution mapping and kinetic characterization of functional sites on ion-exchange ligands based on agarose, a support matrix routinely used in protein chromatography. By quantifying the interactions of single proteins with individual charged ligands, we demonstrate that clusters of charges are necessary to create detectable adsorption sites and that even chemically identical ligands create adsorption sites of varying kinetic properties that depend on steric availability at the interface. Additionally, we relate experimental results to the stochastic theory of chromatography. Simulated elution profiles calculated from the molecular-scale data suggest that, if it were possible to engineer uniform optimal interactions into ion-exchange systems, separation efficiencies could be improved by as much as a factor of five by deliberately exploiting clustered interactions that currently dominate the ion-exchange process only accidentally.

  13. Adsorption of Single and Binary Gases on Polystyrene and Carbon Adsorbents

    NASA Astrophysics Data System (ADS)

    Rothstein, Daniel P.

    Time-dependent transmissions of light organic gases at low concentrations through crosslinked polystyrene and activated carbon adsorbents were measured and analyzed to extract kinetic and equilibrium parameters and to evaluate these parameters in terms of several models of adsorption. Mass -balance in the adsorber bed allows calculation of the equilibrium adsorbed-phase concentration and the model-independent adsorption capacity. Adsorption isotherms are calculated from transmission curves for eight light organic gases adsorbed on polystyrene at several temperatures. The power-law forms of the Freundlich and Chakravarti-Dhar isotherms and the concentration-dependent adsorption capacities indicate heterogeneous adsorption well below monolayer coverage. The effects of heterogeneity increase as non-linearity of the isotherm increases. A mesopore structure is indicated for polystyrene. Characteristic curves are independent of temperature, but the use of an affinity coefficient is not able to demonstrate their independence of adsorbate. Isosteric hearts of adsorption are larger than the heats of vaporization and decrease with increasing surface coverage for three alkanes adsorbed on polystyrene. The transmission curves of several binary mixtures of gases with non-linear isotherms reveal adsorption interference, with adsorption capacities smaller than those from single -component experiments. The pairs with unequal adsorption capacities exhibit displacement, in qualitative agreement with adsorption interference models. The equilibrium adsorption of the binary mixtures cannot be reproduced by single-component isotherm parameters alone, but are described by modified Freundlich isotherms requiring binary experiments. Adsorption in a porous medium is described by a model including four dynamic processes: gas- and solid -phase diffusion, interfacial mass-transfer resistance, and a first-order chemical reaction. A new time-dependent solution to the differential equations of

  14. Mechanistic understanding and performance of biosorption of metal ions by grapefruit peel using FTIR spectroscopy, kinetics and adsorption isotherms modeling, alkali and alkaline metal displacement and EDX analysis

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The performance and mechanism of the sorptive removal of Ni2+ and Zn2+ from aqueous solution using grapefruit peel (GFP) as a new sorbent was investigated. The sorption process was fast, equilibrium was established in 60 min. The equilibrium process was described well by the Langmuir isotherm model,...

  15. Adsorption isotherms, kinetics and column operations for the removal of hazardous dye, Tartrazine from aqueous solutions using waste materials--Bottom Ash and De-Oiled Soya, as adsorbents.

    PubMed

    Mittal, Alok; Mittal, Jyoti; Kurup, Lisha

    2006-08-25

    Adsorbents, Bottom Ash (a power plant waste) and De-Oiled Soya (an agricultural waste) exhibit good efficacy to adsorb a highly toxic dye, Tartrazine. Through the batch technique equilibrium uptake of the dye is observed at different concentrations, pH of the solution, dosage of adsorbents and sieve size of adsorbents. Langmuir and Freundlich adsorption isotherms are successfully employed on both the adsorbents and on the basis of these models the thermodynamic parameters are evaluated. Kinetic investigations reveal that more than 50% adsorption of dye is achieved in about 1h in both the cases, whereas, equilibrium establishment takes about 3-4h. The linear plots obtained in rate constant and mass transfer studies further confirm the applicability of first order rate expression and mass transfer model, respectively. The kinetic data treated to identify rate controlling step of the ongoing adsorption processes indicate that for both the systems, particle diffusion process is predominant at higher concentrations, while film diffusion takes place at lower concentrations. The column studies reveal that about 96% saturation of both the columns is attained during their exhaustion, while about 88 and 84% of the dye material is recovered by eluting dilute NaOH solution through exhausted Bottom Ash and De-Oiled Soya columns, respectively.

  16. Critical analysis of adsorption data statistically

    NASA Astrophysics Data System (ADS)

    Kaushal, Achla; Singh, S. K.

    2016-09-01

    Experimental data can be presented, computed, and critically analysed in a different way using statistics. A variety of statistical tests are used to make decisions about the significance and validity of the experimental data. In the present study, adsorption was carried out to remove zinc ions from contaminated aqueous solution using mango leaf powder. The experimental data was analysed statistically by hypothesis testing applying t test, paired t test and Chi-square test to (a) test the optimum value of the process pH, (b) verify the success of experiment and (c) study the effect of adsorbent dose in zinc ion removal from aqueous solutions. Comparison of calculated and tabulated values of t and χ 2 showed the results in favour of the data collected from the experiment and this has been shown on probability charts. K value for Langmuir isotherm was 0.8582 and m value for Freundlich adsorption isotherm obtained was 0.725, both are <1, indicating favourable isotherms. Karl Pearson's correlation coefficient values for Langmuir and Freundlich adsorption isotherms were obtained as 0.99 and 0.95 respectively, which show higher degree of correlation between the variables. This validates the data obtained for adsorption of zinc ions from the contaminated aqueous solution with the help of mango leaf powder.

  17. Impact of Nanoparticles and Natural Organic Matter on the Removal of Organic Pollutants by Activated Carbon Adsorption

    EPA Science Inventory

    Isotherm experiments evaluating trichloroethylene (TCE) adsorption onto powdered activated carbon (PAC) were conducted in the presence and absence of three commercially available nanomaterials— iron oxide (Fe2O3), titanium dioxide (TiO2), and silicon dioxide (SiO2). Isotherm exp...

  18. ZnS:Cu nanoparticles loaded on activated carbon as novel adsorbent for kinetic, thermodynamic and isotherm studies of Reactive Orange 12 and Direct yellow 12 adsorption.

    PubMed

    Ghaedi, Mehrorang; Ansari, Amin; Sahraei, Reza

    2013-10-01

    The objective of this work is the study of adsorption of Reactive Orange 12 (RO-12) and Direct yellow 12 (DY 12) by zinc sulfide:copper (ZnS-Cu-NP-AC) nanoparticles loaded on activated carbon. This new material with high efficiency in a routine manner was synthesized in our laboratory and its surface properties viz surface area, pore volume and functional groups was characterized with different techniques such FT-IR, SEM, and BET analysis. Generally, in batch adsorption procedure variables including amount of adsorbent, initial dyes concentration, contact time, temperature on dyes removal percentage has great effect on removal percentage that their influence was optimized. The kinetic of proposed adsorption processes efficiently followed, pseudo-second-order, and intra-particle diffusion kinetic models. The equilibrium data the removal strongly follow Langmuir monolayer adsorption with high adsorption capacity in short time. This novel adsorbent by small amount (0.08 g) really is applicable for removal of high amount of both dyes (RO 12 and DY 12) in short time (<20 min). Based on the calculated thermodynamic parameters such as enthalpy (ΔH), entropy (ΔS), activation energy (Ea), sticking probability (S*) and Gibb's free energy changes (ΔG), it is noticeable that the sorption of both dyes onto ZnS:Cu-AC was spontaneous and endothermic process. At optimum values all variables the effect of contact time on adsorption was investigated and the dependency of adsorption data to different kinetic model such as pseudo-first-order, pseudo-second-order, Elovich and intra-particle diffusion was assessed and it was found that the removal processes follow pseudo second order kinetics and interparticle diffusion mechanism.

  19. Third and Final Shuttle Mission of the Isothermal Dendritic Growth Experiment Conducted: Highest Supercooling Ever Recorded Achieved

    NASA Technical Reports Server (NTRS)

    Glicksman, Martin E.; Malarik, Diane C.

    1999-01-01

    Dendrites describe the treelike crystal morphology commonly assumed in metals and alloys that freeze from supercooled or supersaturated melts. There remains a high level of engineering interest in dendritic solidification because the size, shape, and orientation of the dendrites determine the final microstructure of a material. It is the microstructure that then determines the physical properties of cast or welded products. Although it is well known that dendritic growth is controlled by the transport of latent heat from the moving solid-liquid interface, an accurate and predictive model has not yet been developed. The effects of gravity-induced convection on the transfer of heat from the interface have prevented adequate testing, under terrestrial conditions, of solidification models. The Isothermal Dendritic Growth Experiment (IDGE) constituted a series of three microgravity experiments flown aboard the Space Shuttle Columbia. The apparatus was used to grow and record dendrite solidification in the absence of gravity-induced convective heat transfer, thereby producing a wealth of benchmark-quality data for testing solidification models and theories.

  20. Evaluation of surface excess isotherms in liquid chromatography.

    PubMed

    Vajda, Péter; Felinger, Attila; Guiochon, Georges

    2013-05-24

    Methods are proposed to calculate surface excess isotherms and to use them to derive adsorption isotherms in liquid chromatography. The consequences of these methods are discussed. The excess isotherm of isopropyl alcohol from its aqueous solutions on a C18 adsorbent was obtained using the minor disturbance method. The slope of the inflection tangent of the excess isotherm provides the position of the plane separating the adsorbed layer and the bulk phase, from which the adsorption isotherm was derived. At low concentrations of isopropyl alcohol, frontal analysis was used to derive the adsorption isotherm on the same adsorbent using an independent method. The isotherm was thus derived from both frontal analysis data and the minor disturbance method. The results obtained are compared. Our results show that the use of the same concentration unit for the calculation and the representation of the data is the only correct way to calculate the excess isotherms in practical applications of liquid chromatography.

  1. Application des modèles de Langmuir et Freundlich aux isothermes d'adsorption des métaux lourds par l'argile purifiée

    NASA Astrophysics Data System (ADS)

    Ayari, F.; Srasra, E.; Trabelsi-Ayadi, M.

    2004-12-01

    Bentonite, which consist essentially of clay minerals belonging to the smectite group, have a wide range of chemical and industrial uses. The structure chemical composition, exchangeable-ion type and small crystal size of smectite are responsible for several properties, including a large chemically active surface area, a high cation-exchange capacity and interlamellar surface having usual hydratation characteristics. A sample collected from Zaghouan (North East Tunisia, North Africa) is studied through some physico-chemical methods. Results from X-ray diffraction, chemical analysis, infrared spectroscopy, thermogravimetric analysis (TGA) and differential thermal analysis (DTA), cation exchange capacities, specific and total surfaces, confirm the general smectite character of the sample. The adsorption capacity of this clay was tested out using three metallic ions (Pb2+, Zn2+, Ni2+). The results showed that, in all cases, adsorption can be illustrated by Freundlich or Langmuir isotherms. However, for 10-3M Pb2+ the low value of the correlation coefficient (R2) indicated that the experimental data for the adsorption didn't fit to any linear form of the Langmuir equation. Metal adsorbed onto Zaghouan clay varied in the decreasing order PbPb2+ > Zn2+ > Ni2+ and fitted in satisfactorily with the uptake capacity. For Pb2+ the amount of adsorbed ions remained higher than the CEC (cation exchange capacity) of the clay fraction. This result may be due to adsorption of hydroxy lead complex in addition to sorption of bivalent lead form which explains the high amount of Pb2+ removed from aqueous solution.

  2. Healing of snow interfaces: cold laboratory experiments on isothermal snow sintering

    NASA Astrophysics Data System (ADS)

    Podolskiy, E. A.; Barbero, M.; Barpi, F.; Borri-Brunetto, M.; Pallara, O.; Frigo, B.; Chiaia, B.; Chambon, G.; Naaim, M.

    2013-12-01

    Snow has the fastest sintering rate in geology, compared to any other earth material at similar pressures and temperatures. Due to this, sintering may play a crucial role in post-fracture healing of snowpack weak layers, which are prerequisites of avalanche release. The strength recovery of the latter is of interest for snow avalanche modeling focused on sub-critical weak layer fractures. However, it remains very poorly documented and studied. In this work, our main focus is on the fundamental physical property of simple flat snow interfaces to heal and regain their strength with time through sintering (at time scales up to 23 hours). We conducted a series of well controlled cold laboratory experiments (-10°C) with a newly developed shear apparatus and natural snow samples of different densities and grain types. Preliminary results of force-controlled shearing tests at various normal pressures (0-1kPa) showed the healing of snow interfaces, leading to a fast power-law recovery of their strength. The observed power-law dependency (mean exponent ~ 0.2) agrees with several other experimental and theoretical studies, which were based on homogeneous snow and different instrumental methods.

  3. Adsorption of iodine on hydrogen-reduced silver-exchanged mordenite: Experiments and modeling

    SciTech Connect

    Nan, Yue; Tavlarides, Lawrence L.; DePaoli, David W.

    2016-08-03

    The adsorption process of iodine, a major volatile radionuclide in the off-gas streams of spent nuclear fuel reprocessing, on hydrogen-reduced silver-exchanged mordenite (Ag0Z) was studied at the micro-scale. The gas-solid mass transfer and reaction involved in the adsorption process were investigated and evaluated with appropriate models. Optimal conditions for reducing the silver-exchanged mordenite (AgZ) in a hydrogen stream were determined. Kinetic and equilibrium data of iodine adsorption on Ag0Z were obtained by performing single-layer adsorption experiments with experimental systems of high precision at 373–473 K over various iodine concentrations. Results indicate approximately 91% to 97% of the iodine adsorption was through the silver-iodine reaction. The effect of temperature on the iodine loading capacity of Ag0Z was discussed. In conclusion, the Shrinking Core model describes the data well, and the primary rate controlling mechanisms were macro-pore diffusion and silver-iodine reaction. © 2016 American Institute of Chemical Engineers AIChE J, 2016

  4. Adsorption of iodine on hydrogen-reduced silver-exchanged mordenite: Experiments and modeling

    DOE PAGES

    Nan, Yue; Tavlarides, Lawrence L.; DePaoli, David W.

    2016-08-03

    The adsorption process of iodine, a major volatile radionuclide in the off-gas streams of spent nuclear fuel reprocessing, on hydrogen-reduced silver-exchanged mordenite (Ag0Z) was studied at the micro-scale. The gas-solid mass transfer and reaction involved in the adsorption process were investigated and evaluated with appropriate models. Optimal conditions for reducing the silver-exchanged mordenite (AgZ) in a hydrogen stream were determined. Kinetic and equilibrium data of iodine adsorption on Ag0Z were obtained by performing single-layer adsorption experiments with experimental systems of high precision at 373–473 K over various iodine concentrations. Results indicate approximately 91% to 97% of the iodine adsorption wasmore » through the silver-iodine reaction. The effect of temperature on the iodine loading capacity of Ag0Z was discussed. In conclusion, the Shrinking Core model describes the data well, and the primary rate controlling mechanisms were macro-pore diffusion and silver-iodine reaction. © 2016 American Institute of Chemical Engineers AIChE J, 2016« less

  5. Designing isothermal titration calorimetry experiments for the study of 1:1 binding: problems with the "standard protocol".

    PubMed

    Tellinghuisen, Joel

    2012-05-15

    Literature recommendations for designing isothermal titration calorimetry (ITC) experiments to study 1:1 binding, M+X -->/<-- MX, are not consistent and have persisted through time with little quantitative justification. In particular, the "standard protocol" employed by most workers involves 20 to 30 injections of titrant to a final titrant/titrand mole ratio (R(m)) of ~ 2-a scheme that can be far from optimal and can needlessly limit applicability of the ITC technique. These deficiencies are discussed here along with other misconceptions. Whether a specific binding process can be studied by ITC is determined less by c (the product of binding constant K and titrand concentration [M](0)) than by the total detectable heat q(tot) and the extent to which M can be converted to MX. As guidelines, with 90% conversion to MX, K can be estimated within 5% over the range 10 to 10(8)M(-1) when q(tot)/σ(q)≈700, where σ(q) is the standard deviation for estimation of q. This ratio drops to ~150 when the stoichiometry parameter n is treated as known. A computer application for modeling 1:1 binding yields realistic estimates of parameter standard errors for use in protocol design and feasibility assessment.

  6. Quaternized dimethylaminoethyl methacrylate strong base anion exchange fibers for As(V) adsorption

    NASA Astrophysics Data System (ADS)

    Kavaklı, Cengiz; Akkaş Kavaklı, Pınar; Turan, Burcu Dila; Hamurcu, Aslı; Güven, Olgun

    2014-09-01

    N,N-Dimethylaminoethyl methacrylate (DMAEMA) grafted polyethylene/polypropylene (PE/PP) nonwoven fibers (DMAEMA-g-PE/PP) was prepared by radiation-induced graft polymerization. DMAEMA graft chains on nonwoven fibers were quaternized with dimethyl sulfate solution for the preparation of strong base anion exchange fibers (QDMAEMA-g-PE/PP). Fiber structures were characterized by FTIR, XPS and SEM techniques. The effect of solution pH, contact time, initial As(V) ion concentration and coexisting ions on the As(V) adsorption capacity of the QDMAEMA-g-PE/PP fibers were investigated by performing batch adsorption experiments. The adsorption of As(V) by QDMAEMA-g-PE/PP fibers was found to be independent on solution pH in the range 4.00-10.00. Kinetic experiments show that the As(V) adsorption rate was rapid and As(V) adsorption follows pseudo second-order kinetic model. As(V) adsorption equilibrium data were analyzed using Langmuir and Freundlich adsorption isotherm model equations. Langmuir and Freundlich adsorption isotherm models fitted the experimental data well. The maximum adsorption capacity (qmax) calculated from Langmuir isotherm was found to be 83.33 mg As(V)/g polymer at pH 7.00. The adsorbent was used for three cycles without significant loss of adsorption capacity. The adsorbed As(V) ions were desorbed effectively by a 0.1 M NaOH solution.

  7. Adsorption of EDTA on activated carbon from aqueous solutions.

    PubMed

    Zhu, Hai-song; Yang, Xiao-juan; Mao, Yan-peng; Chen, Yu; Long, Xiang-li; Yuan, Wei-kang

    2011-01-30

    In this study, the adsorption of EDTA on activated carbon from aqueous solutions has been investigated in a batch stirred cell. Experiments have been carried out to investigate the effects of temperature, EDTA concentration, pH, activated carbon mass and particle size on EDTA adsorption. The experimental results manifest that the EDTA adsorption rate increases with its concentration in the aqueous solutions. EDTA adsorption also increases with temperature. The EDTA removal from the solution increases as activated carbon mass increases. The Langmuir and Freundlich equilibrium isotherm models are found to provide a good fitting of the adsorption data, with R(2) = 0.9920 and 0.9982, respectively. The kinetic study shows that EDTA adsorption on the activated carbon is in good compliance with the pseudo-second-order kinetic model. The thermodynamic parameters (E(a), ΔG(0), ΔH(0), ΔS(0)) obtained indicate the endothermic nature of EDTA adsorption on activated carbon.

  8. Heavy metal adsorption changes of EAF steel slag after phosphorus adsorption.

    PubMed

    Song, Guanling; Cao, Lijing; Chen, Xiao; Hou, Wenhua; Wang, Qunhui

    2012-01-01

    A kind of electric arc furnace (EAF) steel slag was phosphated, and its isothermal and dynamic adsorptions of copper, cadmium, and lead ions were measured to determine if heavy metal adsorption changes after phosphorus adsorption. The surface area increased greatly after the slag was phosphated. Isothermal adsorption experiments showed that the theoretical Q(max) of the EAF steel slag on Cu(2+), Cd(2+), and Pb(2+) improved 59, 50, and 89% respectively after it was phosphated. Dynamic adsorption results showed that the greatest adsorption capacities of unit volume of Cu(2+), Cd(2+), and Pb(2+) were 2.2, 1.8, and 1.8 times that of the column packed with original EAF steel slag when the column was packed with phosphate EAF steel slag at the same heavy metal ion concentration. The breakthrough time, the exhaustion time and elution efficiency of the column also increased when the column was packed with phosphated EAF steel slag compared with that packed with original EAF steel slag. Phosphorus adsorption could further improve the heavy metal ion adsorption of the EAF steel slag.

  9. Methylene blue adsorption from aqueous solution by activated carbon: effect of acidic and alkaline solution treatments.

    PubMed

    Ijagbemi, Christianah O; Chun, Ji I; Han, Da H; Cho, Hye Y; O, Se J; Kim, Dong S

    2010-01-01

    The removal of Methylene Blue (MB) from aqueous solution using activated carbon (AC) has been investigated. Adsorption experiments were conducted and the maximum adsorption capacity was determined. The effect of experimental parameters such as pH, dye concentration and temperature were studied on the adsorption process. Equilibrium data were mathematically modeled using the Langmuir and Freundlich adsorption models to describe the equilibrium isotherms at different dye concentrations and temperature. Parameters of best-fit model were calculated and discussed. To understand the mechanism of adsorption, kinetic models were employed to follow the adsorption processes; the pseudo-first-order best described the adsorption of MB onto AC. It was found that pH plays a major role in the adsorption process; adsorption capacity was influenced by the physical and surface chemical properties of carbon and the pH of the solution. 99.0% MB removal was achieved at equilibrium.

  10. Comparative studies on removal of Erythrosine using ZnS and AgOH nanoparticles loaded on activated carbon as adsorbents: Kinetic and isotherm studies of adsorption

    NASA Astrophysics Data System (ADS)

    Ghaedi, M.; Rozkhoosh, Z.; Asfaram, A.; Mirtamizdoust, B.; Mahmoudi, Z.; Bazrafshan, A. A.

    2015-03-01

    Erythrosine adsorption (Er) onto ZnS and AgOH nanoparticle-loaded activated carbon (ZnS-NP-AC and AgOH-NP-AC) was studied and results were compared. Subsequent preparation were fully analyzed by different approach such as BET to obtain knowledge about surface area, pore volume, while FT-IR analysis give comprehensive information about functional group the dependency of removal percentage to adsorbent mass, initial Er concentration and contact time were investigated and optimum conditions for pH, adsorbent dosage, Er concentration and contact time was set as be 3.2, 0.016 g, 20 mg/L and 16 min and 3.2, 0.015 g, 19 mg/L and 2 min for ZnS-NP-AC and AgOH-NP-AC, respectively. The equilibrium data correspond to adsorption strongly follow Langmuir model by ZnS-NP-AC and Freundlich model for AgOH-NP-AC. High adsorption capacity for of 55.86-57.80 mg g-1 and 67.11-89.69 mg g-1 for ZnS-NP-AC and AgOH-NP-AC, respectively. The result of present study confirm the applicability of small amount of these adsorbent (<0.02 g) for efficient removal of Er (>95%) in short reasonable time (20 min).

  11. Comparative studies on removal of Erythrosine using ZnS and AgOH nanoparticles loaded on activated carbon as adsorbents: Kinetic and isotherm studies of adsorption.

    PubMed

    Ghaedi, M; Rozkhoosh, Z; Asfaram, A; Mirtamizdoust, B; Mahmoudi, Z; Bazrafshan, A A

    2015-03-05

    Erythrosine adsorption (Er) onto ZnS and AgOH nanoparticle-loaded activated carbon (ZnS-NP-AC and AgOH-NP-AC) was studied and results were compared. Subsequent preparation were fully analyzed by different approach such as BET to obtain knowledge about surface area, pore volume, while FT-IR analysis give comprehensive information about functional group the dependency of removal percentage to adsorbent mass, initial Er concentration and contact time were investigated and optimum conditions for pH, adsorbent dosage, Er concentration and contact time was set as be 3.2, 0.016g, 20mg/L and 16min and 3.2, 0.015g, 19mg/L and 2min for ZnS-NP-AC and AgOH-NP-AC, respectively. The equilibrium data correspond to adsorption strongly follow Langmuir model by ZnS-NP-AC and Freundlich model for AgOH-NP-AC. High adsorption capacity for of 55.86-57.80mgg(-1) and 67.11-89.69mgg(-1) for ZnS-NP-AC and AgOH-NP-AC, respectively. The result of present study confirm the applicability of small amount of these adsorbent (<0.02g) for efficient removal of Er (>95%) in short reasonable time (20min).

  12. Preparation and properties of ion-imprinted hollow particles for the selective adsorption of silver ions.

    PubMed

    Hou, Hongbin; Yu, Demei; Hu, Guohe

    2015-02-03

    Four kinds of silver ion-imprinted particles (Ag-IIPs) with different morphologies were prepared by the surface ion-imprinting technology (SIIT) and were used for the selective removal and concentration of silver ions from wastewater. The favorable adsorptivity and selectivity of Ag-IIPs for Ag(+) were confirmed by a series of adsorption experiments at a suitable pH value. The adsorption mechanism was elucidated by analyzing the adsorption isotherms, adsorption thermodynamics, and adsorption kinetics systematically. The Ag(+) adsorption onto the Ag-IIPs was well-described by the Langmuir isotherm model, and it was likely to be a monolayer chemical adsorption. This conclusion was also confirmed by the thermodynamic parameters. Moreover, the adsorption kinetics indicated that the adsorption rate would be controlled jointly by the intraparticle diffusion and the inner surface adsorption process, and the latter process was generally associated with the formation and breaking of chemical bonds. Finally, the effects of different morphologies of the Ag-IIPs for Ag(+) adsorption were also investigated. In aqueous solution, the adsorptivity of the Ag(+) ion-imprinting single-hole hollow particles (Ag-IISHPs) for Ag(+) was highest (80.5 mg g(-1)) because of a specific morphology that features a single hole in the shell. In an oil-water mixture, Ag(+) in the water phase could be adsorbed efficiently by the Ag(+) ion-imprinting Janus hollow particles (Ag-IIJHPs), with emulsifiability originating from the Janus structure.

  13. Adsorption efficiency of natural materials for low-concentration cesium in solution.

    PubMed

    Miura, A; Kubota, T; Hamada, K; Hitomi, T

    2016-01-01

    In this study, several natural materials were investigated in order to clarify their potential use as cesium (Cs) adsorbents in situ. Four materials--carbonized rice hull, beech sawdust, oak sawdust, and charcoal (Japanese cedar)--which were previously shown to have Cs adsorption capabilities, were examined. Cs adsorption experiments were conducted using different initial Cs and adsorbent concentrations. The physical properties, adsorption isotherms, and adsorption processes were then examined, so as to exploit the Cs adsorption characteristics in the field. Based on these findings, carbonized rice hull and beech sawdust were selected as effective Cs adsorbents. It was found that these materials show continuous and stable Cs adsorption rates for different initial Cs concentrations. The adsorption efficiency of these two adsorption materials in combination was considered, and it was shown that the adsorption isotherms for carbonized rice hull and beech sawdust follow the Freundlich model. Furthermore, the beech sawdust adsorption process exhibited better agreement with the calculated values obtained via the adsorption rate model and the adsorption kinetics model than did the carbonized rice hull adsorption.

  14. Experiments and Modeling of Uranium Adsorption in the Presence of Other Ions in Simulated Seawater

    SciTech Connect

    Ladshaw, Austin; Das, Sadananda; Liao, Wei-Po; Yiacoumi, Sotira; Janke, Christopher James; Mayes, Richard T.; Dai, Sheng; Tsouris, Costas

    2015-11-19

    Seawater contains uranium at an average concentration of 3.3 ppb, as well as a variety of other ions at either overwhelmingly higher or similar concentrations, which complicate the recovery of uranium. This report describes an investigation of the effects of various factors such as uranium speciation and presence of salts including sodium, calcium, magnesium, and bicarbonate, as well as trace elements such as vanadium on uranium adsorption kinetics in laboratory experiments. Adsorption models are also developed to describe the experimental data of uranium extraction from seawater. Results show that the presence of calcium and magnesium significantly slows down the uranium adsorption kinetics. Vanadium can replace uranium from amidoxime-based adsorbent in the presence of sodium in the solution. Results also show that bicarbonate in the solution strongly competes with amidoxime for binding uranium, and thus slows down the uranium adsorption kinetics. Developed on the basis of the experimental findings, the model is capable of describing the effects of pH, ionic strength, temperature, and concentration of various species. The results of this work are useful in the understanding of the important factors that control the adsorbent capacity and kinetics of uranium uptake by amidoxime-based adsorbents.

  15. Experiments and Modeling of Uranium Adsorption in the Presence of Other Ions in Simulated Seawater

    DOE PAGES

    Ladshaw, Austin; Das, Sadananda; Liao, Wei-Po; ...

    2015-11-19

    Seawater contains uranium at an average concentration of 3.3 ppb, as well as a variety of other ions at either overwhelmingly higher or similar concentrations, which complicate the recovery of uranium. This report describes an investigation of the effects of various factors such as uranium speciation and presence of salts including sodium, calcium, magnesium, and bicarbonate, as well as trace elements such as vanadium on uranium adsorption kinetics in laboratory experiments. Adsorption models are also developed to describe the experimental data of uranium extraction from seawater. Results show that the presence of calcium and magnesium significantly slows down the uraniummore » adsorption kinetics. Vanadium can replace uranium from amidoxime-based adsorbent in the presence of sodium in the solution. Results also show that bicarbonate in the solution strongly competes with amidoxime for binding uranium, and thus slows down the uranium adsorption kinetics. Developed on the basis of the experimental findings, the model is capable of describing the effects of pH, ionic strength, temperature, and concentration of various species. The results of this work are useful in the understanding of the important factors that control the adsorbent capacity and kinetics of uranium uptake by amidoxime-based adsorbents.« less

  16. [Adsorption of perchlorate by calcined Mg/Zn/Al layered double hydroxides].

    PubMed

    Wang, Hong-Yu; Liu, Yan

    2014-07-01

    The adsorption capacity of perchlorate by Mg/Zn/Al layered double hydroxides was investigated. The samples were characterized by X-ray diffraction (XRD) and the adsorption isothermal model and dynamic model were discussed. The effect of calcination temperature, Mg/Zn/Al molar ratio, pH value of solution, adsorption time and dosage on the adsorption capacity of samples were studied. The experiment results showed that the removal ratio and adsorption capacity reached the highest and the pH value had good applicability when the molar ratio was Mg/Zn/Al = 2: 1 : 1. The adsorption of perchlorate basically conformed to the pseudo-second kinetics and Langmuir, Freundlich isotherm model.

  17. Application of isothermal titration calorimetry for characterizing thermodynamic parameters of biomolecular interactions: peptide self-assembly and protein adsorption case studies.

    PubMed

    Kabiri, Maryam; Unsworth, Larry D

    2014-10-13

    The complex nature of macromolecular interactions usually makes it very hard to identify the molecular-level mechanisms that ultimately dictate the result of these interactions. This is especially evident in the case of biological systems, where the complex interaction of molecules in various situations may be responsible for driving biomolecular interactions themselves but also has a broader effect at the cell and/or tissue level. This review will endeavor to further the understanding of biomolecular interactions utilizing the isothermal titration calorimetry (ITC) technique for thermodynamic characterization of two extremely important biomaterial systems, viz., peptide self-assembly and nonfouling polymer-modified surfaces. The advantages and shortcomings of this technique will be presented along with a thorough review of the recent application of ITC to these two areas. Furthermore, the controversies associated with the enthalpy-entropy compensation effect as well as thermodynamic equilibrium state for such interactions will be discussed.

  18. Analysis of diffusion models for protein adsorption to porous anion-exchange adsorbent.

    PubMed

    Chen, Wei-Dong; Dong, Xiao-Yan; Sun, Yan

    2002-07-12

    The ion-exchange adsorption kinetics of bovine serum albumin (BSA) and gamma-globulin to an anion exchanger, DEAE Spherodex M, has been studied by batch adsorption experiments. Various diffusion models, that is, pore diffusion, surface diffusion, homogeneous diffusion and parallel diffusion models, are analyzed for their suitabilities to depict the adsorption kinetics. Protein diffusivities are estimated by matching the models with the experimental data. The dependence of the diffusivities on initial protein concentration is observed and discussed. The adsorption isotherm of BSA is nearly rectangular, so there is little surface diffusion. As a result, the surface and homogeneous diffusion models do not fit to the kinetic data of BSA adsorption. The adsorption isotherm of gamma-globulin is less favorable, and the surface diffusion contributes greatly to the mass transport. Consequently, both the surface and homogeneous diffusion models fit to the kinetic data of gamma-globulin well. The adsorption kinetics of BSA and gamma-globulin can be very well fitted by parallel diffusion model, because the model reflects correctly the intraparticle mass transfer mechanism. In addition, for both the favorably bound proteins, the pore diffusion model fits the adsorption kinetics reasonably well. The results here indicate that the pore diffusion model can be used as a good approximate to depict protein adsorption kinetics for protein adsorption systems from rectangular to linear isotherms.

  19. Thermodynamic signature of substrates and substrate analogs binding to human blood group B galactosyltransferase from isothermal titration calorimetry experiments.

    PubMed

    Sindhuwinata, Nora; Grimm, Lena L; Weißbach, Sophie; Zinn, Sabrina; Munoz, Eva; Palcic, Monica M; Peters, Thomas

    2013-10-01

    It has been observed earlier that human blood group B galactosyltransferase (GTB) hydrolyzes its donor substrate UDP-Galactose (UDP-Gal) in the absence of acceptor substrate, and that this reaction is promoted by the presence of an acceptor substrate analog, α-L-Fuc-(1,2)-β-D-3-deoxy-Gal-O-octyl (3DD). This acceleration of enzymatic hydrolysis of UDP-Gal was traced back to an increased affinity of GTB toward the donor substrate in the presence of 3DD. Herein, we present new thermodynamic data from isothermal titration calorimetry (ITC) on the binding of donor and acceptor substrates and analogs to GTB. ITC data are supplemented by surface plasmon resonance and STD-NMR titration experiments. These new data validate mutual allosteric control of binding of donor and acceptor substrates to GTB. It is of note that ITC experiments reveal significant differences in enthalpic and entropic contributions to binding of the natural donor substrate UDP-Gal, when compared with its analog UDP-Glucose (UDP-Glc). This may reflect different degrees of ordering of an internal loop (amino acids 176-194) and the C-terminus (amino acids 346-354), which close the binding pocket on binding of UDP-Gal or UDP-Glc. As both ligands have rather similar dissociation constants KD and almost identical modes of binding this finding is unexpected. Another surprising finding is that an acceptor analog, α-L-Fuc-(1,2)-β-D-3-amino-3-deoxy-Gal-O-octyl (3AD) as well as the constituent monosaccharide β-D-3-amino-3-deoxy-Gal-O-octyl (3AM) effectively inhibit enzymatic hydrolysis of UDP-Gal. This is unexpected, too, because in analogy to the effects of 3DD one would have predicted acceleration of enzymatic hydrolysis of UDP-Gal. It is difficult to explain these observations based on structural data alone. Therefore, our results highlight that there is an urgent need of experimental studies into the dynamic properties of GTB.

  20. Measuring and modeling ammonium adsorption by calcareous soils.

    PubMed

    Ranjbar, F; Jalali, M

    2013-04-01

    The aim of this study was assessment of ammonium (NH 4(+) ) adsorption isotherms in some agricultural calcareous soils and modeling of that by using the mechanistic exchange model. Ten surface soils (0-30 cm) were collected from areas covered with different land uses in Hamedan, western Iran. Isotherm experiments were carried out by concentrations of NH 4(+) prepared from NH4Cl salt (0, 10, 20, 30, 40, 50, 100, and 150 mg NH 4(+)  l(-1)) in presence of 0.01 M CaCl2 solution. The empirical models including simple adsorption isotherm and Freundlich equations were fitted well to the experimental data. The average amounts of adsorbed NH 4(+) in studied soils varied from 8.95 to 35.23 %. Adsorption percentage indicated positive correlation with pH, cation-exchange capacity (CEC), equivalent calcium carbonate, and clay content and had negative correlation with sand content. In order to predict and model NH 4(+) adsorption, cation-exchange model in PHREEQC program was used. The model could simulate the NH 4(+) adsorption very well in all studied soils. The values of CEC played the major role in modeling of NH 4(+) adsorption in this study indicating that cation-exchange process was the major mechanism controlling NH 4(+) adsorption in studied soils.

  1. Adsorption structures and energetics of molecules on metal surfaces: Bridging experiment and theory

    NASA Astrophysics Data System (ADS)

    Maurer, Reinhard J.; Ruiz, Victor G.; Camarillo-Cisneros, Javier; Liu, Wei; Ferri, Nicola; Reuter, Karsten; Tkatchenko, Alexandre

    2016-05-01

    Adsorption geometry and stability of organic molecules on surfaces are key parameters that determine the observable properties and functions of hybrid inorganic/organic systems (HIOSs). Despite many recent advances in precise experimental characterization and improvements in first-principles electronic structure methods, reliable databases of structures and energetics for large adsorbed molecules are largely amiss. In this review, we present such a database for a range of molecules adsorbed on metal single-crystal surfaces. The systems we analyze include noble-gas atoms, conjugated aromatic molecules, carbon nanostructures, and heteroaromatic compounds adsorbed on five different metal surfaces. The overall objective is to establish a diverse benchmark dataset that enables an assessment of current and future electronic structure methods, and motivates further experimental studies that provide ever more reliable data. Specifically, the benchmark structures and energetics from experiment are here compared with the recently developed van der Waals (vdW) inclusive density-functional theory (DFT) method, DFT + vdWsurf. In comparison to 23 adsorption heights and 17 adsorption energies from experiment we find a mean average deviation of 0.06 Å and 0.16 eV, respectively. This confirms the DFT + vdWsurf method as an accurate and efficient approach to treat HIOSs. A detailed discussion identifies remaining challenges to be addressed in future development of electronic structure methods, for which the here presented benchmark database may serve as an important reference.

  2. Adsorption characteristics of methylene blue onto agricultural wastes lotus leaf in bath and column modes.

    PubMed

    Han, Xiuli; Wang, Wei; Ma, Xiaojian

    2011-01-01

    The adsorption potential of lotus leaf to remove methylene blue (MB) from aqueous solution was investigated in batch and fixed-bed column experiments. Langmuir, Freundlich, Temkin and Koble-Corrigan isotherm models were employed to discuss the adsorption behavior. The results of analysis indicated that the equilibrium data were perfectly represented by Temkin isotherm and the Langmuir saturation adsorption capacity of lotus leaf was found to be 239.6 mg g(-1) at 303 K. In fixed-bed column experiments, the effects of flow rate, influent concentration and bed height on the breakthrough characteristics of adsorption were discussed. The Thomas and the bed-depth/service time (BDST) models were applied to the column experimental data to determine the characteristic parameters of the column adsorption. The two models were found to be suitable to describe the dynamic behavior of MB adsorbed onto the lotus leaf powder column.

  3. Assessment of in vitro binding of isolated pectic domains to cellulose by adsorption isotherms, electron microscopy, and X-ray diffraction methods.

    PubMed

    Zykwinska, Agata; Gaillard, Cédric; Buléon, Alain; Pontoire, Bruno; Garnier, Catherine; Thibault, Jean-François; Ralet, Marie-Christine

    2007-01-01

    Isolated pectic domains representative of the pectic backbone and the neutral sugar side chains were tested for their ability to interact with cellulose in comparison to the well-known binding of xyloglucan. Pectic side chains displayed a significant in vitro binding capacity to cellulose, whereas pectic backbone domains exhibited only slight adsorption to cellulose microfibrils. To support the binding results, electron microscopy and X-ray diffraction were applied. Celluloses from bacteria and sugar beet cell walls were used as substrates for the precipitation of isolated pectic domains or xyloglucan by acetone vapor diffusion. Pectic side chains grew attached to the cellulose surfaces, whereas pectic backbone domains were observed separately from cellulose microfibrils. Xyloglucan seeded with cellulose provoked a decrease of microfibrils entanglement, but no clear cross-links between neighboring microfibrils were observed. These results led to the elucidation of the pectic domains responsible for binding with cellulose microfibrils.

  4. A pressure-amplifying framework material with negative gas adsorption transitions.

    PubMed

    Krause, Simon; Bon, Volodymyr; Senkovska, Irena; Stoeck, Ulrich; Wallacher, Dirk; Többens, Daniel M; Zander, Stefan; Pillai, Renjith S; Maurin, Guillaume; Coudert, François-Xavier; Kaskel, Stefan

    2016-04-21

    Adsorption-based phenomena are important in gas separations, such as the treatment of greenhouse-gas and toxic-gas pollutants, and in water-adsorption-based heat pumps for solar cooling systems. The ability to tune the pore size, shape and functionality of crystalline porous coordination polymers--or metal-organic frameworks (MOFs)--has made them attractive materials for such adsorption-based applications. The flexibility and guest-molecule-dependent response of MOFs give rise to unexpected and often desirable adsorption phenomena. Common to all isothermal gas adsorption phenomena, however, is increased gas uptake with increased pressure. Here we report adsorption transitions in the isotherms of a MOF (DUT-49) that exhibits a negative gas adsorption; that is, spontaneous desorption of gas (methane and n-butane) occurs during pressure increase in a defined temperature and pressure range. A combination of in situ powder X-ray diffraction, gas adsorption experiments and simulations shows that this adsorption behaviour is controlled by a sudden hysteretic structural deformation and pore contraction of the MOF, which releases guest molecules. These findings may enable technologies using frameworks capable of negative gas adsorption for pressure amplification in micro- and macroscopic system engineering. Negative gas adsorption extends the series of counterintuitive phenomena such as negative thermal expansion and negative refractive indices and may be interpreted as an adsorptive analogue of force-amplifying negative compressibility transitions proposed for metamaterials.

  5. A pressure-amplifying framework material with negative gas adsorption transitions

    NASA Astrophysics Data System (ADS)

    Krause, Simon; Bon, Volodymyr; Senkovska, Irena; Stoeck, Ulrich; Wallacher, Dirk; Többens, Daniel M.; Zander, Stefan; Pillai, Renjith S.; Maurin, Guillaume; Coudert, François-Xavier; Kaskel, Stefan

    2016-04-01

    Adsorption-based phenomena are important in gas separations, such as the treatment of greenhouse-gas and toxic-gas pollutants, and in water-adsorption-based heat pumps for solar cooling systems. The ability to tune the pore size, shape and functionality of crystalline porous coordination polymers—or metal-organic frameworks (MOFs)—has made them attractive materials for such adsorption-based applications. The flexibility and guest-molecule-dependent response of MOFs give rise to unexpected and often desirable adsorption phenomena. Common to all isothermal gas adsorption phenomena, however, is increased gas uptake with increased pressure. Here we report adsorption transitions in the isotherms of a MOF (DUT-49) that exhibits a negative gas adsorption; that is, spontaneous desorption of gas (methane and n-butane) occurs during pressure increase in a defined temperature and pressure range. A combination of in situ powder X-ray diffraction, gas adsorption experiments and simulations shows that this adsorption behaviour is controlled by a sudden hysteretic structural deformation and pore contraction of the MOF, which releases guest molecules. These findings may enable technologies using frameworks capable of negative gas adsorption for pressure amplification in micro- and macroscopic system engineering. Negative gas adsorption extends the series of counterintuitive phenomena such as negative thermal expansion and negative refractive indices and may be interpreted as an adsorptive analogue of force-amplifying negative compressibility transitions proposed for metamaterials.

  6. Artificial neural network (ANN) method for modeling of sunset yellow dye adsorption using zinc oxide nanorods loaded on activated carbon: Kinetic and isotherm study

    NASA Astrophysics Data System (ADS)

    Maghsoudi, M.; Ghaedi, M.; Zinali, A.; Ghaedi, A. M.; Habibi, M. H.

    2015-01-01

    In this research, ZnO nanoparticle loaded on activated carbon (ZnO-NPs-AC) was synthesized simply by a low cost and nontoxic procedure. The characterization and identification have been completed by different techniques such as SEM and XRD analysis. A three layer artificial neural network (ANN) model is applicable for accurate prediction of dye removal percentage from aqueous solution by ZnO-NRs-AC following conduction of 270 experimental data. The network was trained using the obtained experimental data at optimum pH with different ZnO-NRs-AC amount (0.005-0.015 g) and 5-40 mg/L of sunset yellow dye over contact time of 0.5-30 min. The ANN model was applied for prediction of the removal percentage of present systems with Levenberg-Marquardt algorithm (LMA), a linear transfer function (purelin) at output layer and a tangent sigmoid transfer function (tansig) in the hidden layer with 6 neurons. The minimum mean squared error (MSE) of 0.0008 and coefficient of determination (R2) of 0.998 were found for prediction and modeling of SY removal. The influence of parameters including adsorbent amount, initial dye concentration, pH and contact time on sunset yellow (SY) removal percentage were investigated and optimal experimental conditions were ascertained. Optimal conditions were set as follows: pH, 2.0; 10 min contact time; an adsorbent dose of 0.015 g. Equilibrium data fitted truly with the Langmuir model with maximum adsorption capacity of 142.85 mg/g for 0.005 g adsorbent. The adsorption of sunset yellow followed the pseudo-second-order rate equation.

  7. Artificial neural network (ANN) method for modeling of sunset yellow dye adsorption using zinc oxide nanorods loaded on activated carbon: Kinetic and isotherm study.

    PubMed

    Maghsoudi, M; Ghaedi, M; Zinali, A; Ghaedi, A M; Habibi, M H

    2015-01-05

    In this research, ZnO nanoparticle loaded on activated carbon (ZnO-NPs-AC) was synthesized simply by a low cost and nontoxic procedure. The characterization and identification have been completed by different techniques such as SEM and XRD analysis. A three layer artificial neural network (ANN) model is applicable for accurate prediction of dye removal percentage from aqueous solution by ZnO-NRs-AC following conduction of 270 experimental data. The network was trained using the obtained experimental data at optimum pH with different ZnO-NRs-AC amount (0.005-0.015 g) and 5-40 mg/L of sunset yellow dye over contact time of 0.5-30 min. The ANN model was applied for prediction of the removal percentage of present systems with Levenberg-Marquardt algorithm (LMA), a linear transfer function (purelin) at output layer and a tangent sigmoid transfer function (tansig) in the hidden layer with 6 neurons. The minimum mean squared error (MSE) of 0.0008 and coefficient of determination (R(2)) of 0.998 were found for prediction and modeling of SY removal. The influence of parameters including adsorbent amount, initial dye concentration, pH and contact time on sunset yellow (SY) removal percentage were investigated and optimal experimental conditions were ascertained. Optimal conditions were set as follows: pH, 2.0; 10 min contact time; an adsorbent dose of 0.015 g. Equilibrium data fitted truly with the Langmuir model with maximum adsorption capacity of 142.85 mg/g for 0.005 g adsorbent. The adsorption of sunset yellow followed the pseudo-second-order rate equation.

  8. Combination of computational methods, adsorption isotherms and selectivity tests for the conception of a mixed non-covalent-semi-covalent molecularly imprinted polymer of vanillin.

    PubMed

    Puzio, Kinga; Delépée, Raphaël; Vidal, Richard; Agrofoglio, Luigi A

    2013-08-06

    A novel molecularly imprinted polymer (MIP) for vanillin was prepared by photo initiated polymerization in dichloromethane using a mixed semi-covalent and non-covalent imprinting strategy. Taking polymerisable syringaldehyde as "dummy" template, acrylamide was chosen as functional monomer on B3LYP/6-31+G(d,p) density functional theory computational method basis with counterpoise. The binding parameters for the recognition of vanillin on imprinted polymers were studied with three different isotherm models (Langmuir, bi-Langmuir and Langmuir-Freundlich) and compared. The results indicate an heterogeneity of binding sites. It was found and proved by DFT calculations that the specific binding of vanillin in the cavities is due to non-covalent interactions of the template with the hydroxyphenyl- and the amide-moieties. The binding geometry of vanillin in the MIP cavity was also modelled. The obtained MIP is highly specific for vanillin (with an imprinting factor of 7.4) and was successfully applied to the extraction of vanillin from vanilla pods, red wine spike with vanillin, natural and artificial vanilla sugar with a recovery of 80%.

  9. Adsorptive Removal and Adsorption Kinetics of Fluoroquinolone by Nano-Hydroxyapatite.

    PubMed

    Chen, Yajun; Lan, Tao; Duan, Lunchao; Wang, Fenghe; Zhao, Bin; Zhang, Shengtian; Wei, Wei

    2015-01-01

    Various kinds of antibiotics, especially fluoroquinolone antibiotics (FQs) have been widely used for the therapy of infectious diseases in human and livestock. For their poorly absorbed by living organisms, large-scale misuse or abuse of FQs will foster drug resistance among pathogenic bacteria, as well as a variety of environmental problems when they were released in the environment. In this work, the adsorption properties of two FQs, namely norfloxacin (NOR) and ciprofloxacin (CIP), by nano-hydroxyapatite (n-HAP) were studied by batch adsorption experiments. The adsorption curves of FQs by n-HAP were simulated by Langmuir and Freundlich isotherms. The results shown that NOR and CIP can be adsorbed effectively by the adsorbent of n-HAP, and the adsorption capacity of FQs increase with increasing dosage of n-HAP. The optimum dosage of n-HAP for FQs removal was 20 g · L(-1), in which the removal efficiencies is 51.6% and 47.3%, and an adsorption equilibrium time is 20 min. The maximum removal efficiency occurred when pH is 6 for both FQs. The adsorption isotherm of FQs fits well for both Langmuir and Freundlich equations. The adsorption of both FQs by n-HAP follows second-order kinetics.

  10. Adsorptive Removal and Adsorption Kinetics of Fluoroquinolone by Nano-Hydroxyapatite

    PubMed Central

    Chen, Yajun; Lan, Tao; Duan, Lunchao; Wang, Fenghe; Zhao, Bin; Zhang, Shengtian; Wei, Wei

    2015-01-01

    Various kinds of antibiotics, especially fluoroquinolone antibiotics (FQs) have been widely used for the therapy of infectious diseases in human and livestock. For their poorly absorbed by living organisms, large-scale misuse or abuse of FQs will foster drug resistance among pathogenic bacteria, as well as a variety of environmental problems when they were released in the environment. In this work, the adsorption properties of two FQs, namely norfloxacin (NOR) and ciprofloxacin (CIP), by nano-hydroxyapatite (n-HAP) were studied by batch adsorption experiments. The adsorption curves of FQs by n-HAP were simulated by Langmuir and Freundlich isotherms. The results shown that NOR and CIP can be adsorbed effectively by the adsorbent of n-HAP, and the adsorption capacity of FQs increase with increasing dosage of n-HAP. The optimum dosage of n-HAP for FQs removal was 20 g·L-1, in which the removal efficiencies is 51.6% and 47.3%, and an adsorption equilibrium time is 20 min. The maximum removal efficiency occurred when pH is 6 for both FQs. The adsorption isotherm of FQs fits well for both Langmuir and Freundlich equations. The adsorption of both FQs by n-HAP follows second-order kinetics. PMID:26698573

  11. [Adsorption characteristics of f2 bacteriophages by four substrates in constructed wetland].

    PubMed

    Chen, Di; Zheng, Xiang; Wei, Yuan-Song; Yang, Yong

    2013-10-01

    Performance of f2 phages adsorption by four substrates including anthracite coal, steel slag, zeolite and forsterite was investigated through batch and dynamic experiments. Results of batch experiments showed that the removal efficiency of f2 phages by these four substrates was in the order of anthracite > steel slag > forsterite approximately zeolite. The adsorption of f2 phages by anthracite experienced fast, medium and slow stages, and the removal efficiency of f2 phages increased gradually with the increase of anthracite dosage, e. g. the optimized dosage of anthracite was 8.0 g at a solid/liquid ratio of 1:12.5 (m/V). The isothermal adsorption of all four substrates was described with Freundlich and Langmuir isothermal adsorption equation very well, and the adsorption of f2 phages by both anthracite and steel slag fitted pseudo-second order adsorption kinetics at their theoretical adsorption capacities of 3. 35 x 10(8) PFU.g-1 and 2.56 x 10(8) PFU.g-1, respectively, nearly the same as the equilibrium adsorption capacities obtained under the experiment conditions. And the liquid diffusion process was a rate-limiting step of the adsorption of f2 phage by both anthracite and steel slag, but not the only one. The results of dynamic adsorption experiments showed that the adsorption process of f2 phages in the three adsorption columns including anthracite, steel slag and zeolite experienced four stages of adaption, adsorption, pulse adsorption and adsorption equilibrium, and the total removal rates of f2 phages were more than 2. 55 Ig.

  12. Kinetics and equilibrium adsorption studies of dimethylamine (DMA) onto ion-exchange resin.

    PubMed

    Hu, Qinhai; Meng, Yuanyuan; Sun, Tongxi; Mahmood, Qaisar; Wu, Donglei; Zhu, Jianhang; Lu, George

    2011-01-30

    The fine grained resin ZGSPC106 was used to adsorb dimethylamine (DMA) from aqueous solution in the present research. Batch experiments were performed to examine the effects of initial pH of solution and agitation time on the adsorption process. The thermodynamics and kinetics of adsorption were also analyzed. The maximum adsorption was found at natural pH of DMA solution and equilibrium could be attained within 12 min. The equilibrium adsorption data were conformed satisfactorily to the Langmuir equation. The evaluation based on Langmuir isotherm gave the maximal static saturated adsorption capacity of 138.89 mg/g at 293K. Various thermodynamic parameters such as free energy (ΔG°), enthalpy (ΔH°) and entropy (ΔS°) showed that the adsorption was spontaneous, endothermic and feasible. DMA adsorption on ZGSPC106 fitted well to the pseudo-second-order kinetic model. Furthermore, the adsorption mechanism was discussed by Fourier transform infrared spectroscopy (FT-IR) analysis.

  13. Determination of binding capacity and adsorption enthalpy between Human Glutamate Receptor (GluR1) peptide fragments and kynurenic acid by surface plasmon resonance experiments.

    PubMed

    Csapó, E; Majláth, Z; Juhász, Á; Roósz, B; Hetényi, A; Tóth, G K; Tajti, J; Vécsei, L; Dékány, I

    2014-11-01

    The interaction between kynurenic acid (KYNA) and two peptide fragments (ca. 30 residues) of Human Glutamate Receptor 201-300 (GluR1) using surface plasmon resonance (SPR) spectroscopy was investigated. Because of the medical interest in the neuroscience, GluR1 is one of the important subunits of the α-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid receptors (AMPAR). AMPARs are ionotoropic glutamate receptors, which are mediating fast synaptic transmission and are crucial for plasticity in the brain. On the other hand, KYNA has been suggested to have neuroprotective activity and it has been considered for apply in therapy in certain neurobiological disorders. In this article the adsorption of the GluR1201-230 and GluR1231-259 peptides were studied on gold biosensor chip. The peptides were chemically bonded onto the gold surface via thiol group of L-cysteine resulted in the formation of peptide monolayer on the SPR chip surface. Because the GluR1231-259 peptide does not contain L-cysteine the Val256 was replaced by Cys256. The cross sectional area and the surface orientation of the studied peptides were determined by SPR and theoretical calculations (LOMETS) as well. The binding capability of KYNA on the peptide monolayer was studied in the concentration range of 0.1-5.0 mM using 150 mM NaCl ionic strength at pH 7.4 (±0.02) in phosphate buffer solutions. In order to determine the binding enthalpy the experiments were carried out between +10°C and +40°C. The heat of adsorption was calculated by using adsorption isotherms at different surface loading of KYNA on the SPR chip.

  14. Co-adsorption of Trichloroethylene and Arsenate by Iron-Impregnated Granular Activated Carbon.

    PubMed

    Deng, Baolin; Kim, Eun-Sik

    2016-05-01

    Co-adsorption of trichloroethylene (TCE) and arsenate [As(V)] was investigated using modified granular activated carbons (GAC): untreated, sodium hypochlorite-treated (NaClO-GAC), and NaClO with iron-treated GAC (NaClO/Fe-GAC). Batch experiments of single- [TCE or As(V)] and binary- [TCE and As(V)] components solutions are evaluated through Langmuir and Freundlich isotherm models and adsorption kinetic tests. In the single-component system, the adsorption capacity of As(V) was increased by the NaClO-GAC and the NaClO/Fe-GAC. The untreated GAC showed a low adsorption capacity for As(V). Adsorption of TCE by the NaClO/Fe-GAC was maximized, with an increased Freundlich constant. Removal of TCE in the binary-component system was decreased 15% by the untreated GAC, and NaClO- and NaClO/Fe-GAC showed similar efficiency to the single-component system because of the different chemical status of the GAC surfaces. Results of the adsorption isotherms of As(V) in the binary-component system were similar to adsorption isotherms of the single-component system. The adsorption affinities of single- and binary-component systems corresponded with electron transfer, competitive adsorption, and physicochemical properties.

  15. Arsenic Adsorption Equilibrium Concentration and Adsorption Rate of Activated Carbon Coated with Ferric-Aluminum Hydroxides

    NASA Astrophysics Data System (ADS)

    Zhang, M.; Sugita, H.; Oguma, T.; Hara, J.; Takahashi, S.

    2015-12-01

    In some areas of developing countries, ground or well water contaminated with arsenic has been reluctantly used as drinking water. It is highly desirable that effective and inexpensive arsenic removal agents should be developed and provided to reduce the potential health risk. Previous studies demonstrated that activated carbon coated with ferric-aluminum hydroxides (Fe-Al-C) has high adsorptive potential for removal of arsenic. In this study, a series of experiments using Fe-Al-C were carried to discuss adsorption equilibrium time, adsorption equilibrium concentration and adsorption rate of arsenic for Fe-Al-C. Fe-Al-C used in this study was provided by Astec Co., Ltd. Powder reagent of disodium hydrogen arsenate heptahydrate was dissolved into ion-exchanged water. The solution was then further diluted with ion-exchanged water to be 1 and 10 mg/L as arsenic concentration. The pH of the solution was adjusted to be around 7 by adding HCl and/or NaOH. The solution was used as artificial arsenic contaminated water in two types of experiments (arsenic adsorption equilibrium and arsenic adsorption rate tests). The results of the arsenic equilibrium tests were showed that a time period of about 3 days to reach apparent adsorption equilibrium for arsenic. The apparent adsorption equilibrium concentration and adsorbed amount of arsenic on Fe-Al-C adsorbent could be estimated by application of various adsorption isotherms, but the distribution coefficient of arsenic between solid and liquid varies with experimental conditions such as initial concentration of arsenic and addition concentration of adsorbent. An adsorption rate equation that takes into account the reduction in the number of effective adsorption sites on the adsorbent caused by the arsenic adsorption reaction was derived based on the data obtained from the arsenic adsorption rate tests.

  16. Adsorption-desorption studies of indigocarmine from industrial effluents by using deoiled mustard and its comparison with charcoal.

    PubMed

    Gupta, Vinod K; Jain, Rajeev; Malathi, S; Nayak, Arunima

    2010-08-15

    Deoiled mustard obtained from local oil mills has been used as an inexpensive and effective adsorbent for the removal of indigocarmine dye from industrial effluents. The influence of various factors on the adsorption capacity has been studied by batch experiments. The adsorption studies validate both Langmuir and Freundlich adsorption isotherms. Thermodynamic parameters such as DeltaG degrees, DeltaH degrees, and DeltaS degrees for the adsorption process were calculated, which indicated the feasibility of the adsorption process. Desorption profiles revealed that a significant portion (85%) could be desorbed from deoiled mustard by using 30% glycerol as eluting agent.

  17. Adsorption, partition, ion exchange and chemical reaction in batch reactors or in columns — A review

    NASA Astrophysics Data System (ADS)

    Schweich, D.; Sardin, M.

    The role of linear or non-linear adsorption, mass transfer kinetics, chemical reactions and ion exchange in column tracer experiments is qualitatively dealt with. The similarity of elution curves is emphasized even for very different phenomena. Some experimental procedures are proposed to point out the principal physico-chemical phenomenon which is responsible for the shape of the adsorption isotherm deduced from batch or column experiments.

  18. Adsorption of fluoride onto crystalline titanium dioxide: effect of pH, ionic strength, and co-existing ions.

    PubMed

    Babaeivelni, Kamel; Khodadoust, Amid P

    2013-03-15

    Adsorption of fluoride from water onto titanium dioxide (TiO(2)) powder was investigated. The sorbent was crystalline TiO(2) composed of mostly anatase with a specific surface area of 56 m(2)/g. Adsorption kinetics and isotherm experiments were performed using an aqueous solution with bicarbonate alkalinity representative of natural waters. Adsorption kinetics data showed that maximum adsorption of fluoride occurred within 3h, following a pseudo-second order kinetics model. Adsorption isotherm data followed the Langmuir equation, indicating favorable adsorption of fluoride onto TiO(2), while results from the Dubinin-Radushkevich model are indicative of physical adsorption of fluoride. Adsorption of fluoride increased with decreasing solution pH. Maximum adsorption of fluoride occurred within the pH range of 2-5, while approximately 75% of maximum adsorption was obtained in the pH range of 7-8 with rapidly declining adsorption above pH 9. The pH(pzc) data for TiO(2) indicated the preferred adsorption of fluoride onto the acidic surface of TiO(2). Higher bicarbonate concentrations in solution increased the solution pH which was conducive to a decrease in adsorption of fluoride onto the surface of TiO(2) at higher pH. Overall, the solution pH was the main factor controlling the uptake of fluoride by TiO(2).

  19. From surfactant adsorption kinetics to asymmetric nanomembrane mechanics: pendant drop experiments with subphase exchange.

    PubMed

    Ferri, James K; Kotsmar, Csaba; Miller, Reinhard

    2010-12-15

    Adsorption equilibrium is the state in which the chemical potential of each species in the interface and bulk is the same. Dynamic phenomena at fluid-fluid interfaces in the presence of surface active species are often probed by perturbing an interface or adjoining bulk phase from the equilibrium state. Many methods designed for studying kinetics at fluid-fluid interfaces focus on removing the system from equilibrium through dilation or compression of the interface. This modifies the surface excess concentration Γ(i) and allows the species distribution in the bulk C(i) to respond. There are only a few methods available for studying fluid-fluid interfaces which seek to control C(i) and allow the interface to respond with changes to Γ(i). Subphase exchange in pendant drops can be achieved by the injection and withdrawal of liquid into a drop at constant volumetric flow rate R(E) during which the interfacial area and drop volume V(D) are controlled to be approximately constant. This can be accomplished by forming a pendant drop at the tip of two coaxial capillary tubes. Although evolution of the subphase concentration C(i)(t) is dictated by extrinsic factors such as R(E) and V(D), complete subphase exchange can always be attained when a sufficient amount of liquid is used. This provides a means to tailor driving forces for adsorption and desorption in fluid-fluid systems and in some cases, fabricate interfacial materials of well-defined composition templated at these interfaces. The coaxial capillary pendant drop (CCPD) method opens a wide variety of experimental possibilities. Experiments and theoretical frameworks are reviewed for the study of surfactant exchange kinetics, macromolecular adsorption equilibrium and dynamics, as well as the fabrication of a wide range of soft surface materials and the characterization of their mechanics. Future directions for new experiments are also discussed.

  20. Bovine Serum Albumin Adsorption at a Silica Surface Explored by Simulation and Experiment.

    PubMed

    Kubiak-Ossowska, Karina; Tokarczyk, Karolina; Jachimska, Barbara; Mulheran, Paul A

    2017-03-28

    Molecular details of BSA adsorption on a silica surface are revealed by fully atomistic Molecular Dynamics (MD) simulations (with a 0.5μs trajectory), supported by Dynamic Light Scattering (DLS), Zeta Potential, Multi-Parametric Surface Plasmon Resonance (MP-SPR) and Contact Angle experiments. The experimental and theoretical methods complement one another and lead to a wider understanding of the mechanism of BSA adsorption across a range of pH 3-9. The MD results show how the negatively charged BSA at pH7 adsorbs to the negatively charged silica surface, and reveal a unique orientation with preserved secondary and tertiary structure. The experiments then show that the protein forms complete monolayers at ~pH6, just above the protein's isoelectric point (pH5.1). The surface contact angle is maximum when it is completely coated with protein, and the hydrophobicity of the surface is understood in terms of the simulated protein conformation. The adsorption behaviour at higher pH>6 is also consistently interpreted using the MD picture; both the contact angle and the adsorbed protein mass density decrease with increasing pH, in line with the increasing magnitude of negative charge on both the protein and the surface. At lower pH<5 the protein starts to unfold, and the adsorbed mass dramatically decreases. The comprehensive picture that emerges for the formation of oriented protein films with preserved native conformation will help guide efforts to create functional films for new technologies.

  1. Adsorption of clofibric acid and ketoprofen onto powdered activated carbon: effect of natural organic matter.

    PubMed

    Gao, Yaohuan; Deshusses, Marc A

    2011-12-01

    The adsorption of two acidic pharmaceutically active compounds (PhACs), clofibric acid and ketoprofen, onto powdered activated carbon (PAC) was investigated with a particular focus on the influence of natural organic matter (NOM) on the adsorption of the PhACs. Suwannee River humic acids (SRHAs) were used as a substitute for NOM. Batch adsorption experiments were conducted to obtain adsorption kinetics and adsorption isotherms with and without SRHAs in the system. The adsorption isotherms and adsorption kinetics showed that the adsorption ofclofibric acid was not significantly affected by the presence of SRHAs at a concentration of 5 mg (as carbon) L(-1). An adsorption capacity of 70 to 140 mg g(-1) was observed and equilibrium was reached within 48 h. In contrast, the adsorption of ketoprofen was markedly decreased (from about 120 mg g(-1) to 70-100 mg g(-1)) in the presence of SRHAs. Higher initial concentrations of clofibric acid than ketoprofen during testing may explain the different behaviours that were observed. Also, the more hydrophobic ketoprofen molecules may have less affinity for PAC when humic acids (which are hydrophilic) are present. The possible intermolecular forces that could account for the different behaviour of clofibric acid and ketoprofen adsorption onto PAC are discussed. In particular, the relevance of electrostatic forces, electron donor-acceptor interaction, hydrogen bonding and London dispersion forces are discussed

  2. Equilibrium modeling and kinetic studies on the adsorption of basic dye by a low-cost adsorbent: coconut (Cocos nucifera) bunch waste.

    PubMed

    Hameed, B H; Mahmoud, D K; Ahmad, A L

    2008-10-01

    In this paper, the ability of coconut bunch waste (CBW), an agricultural waste available in large quantity in Malaysia, to remove basic dye (methylene blue) from aqueous solution by adsorption was studied. Batch mode experiments were conducted at 30 degrees C to study the effects of pH and initial concentration of methylene blue (MB). Equilibrium adsorption isotherms and kinetics were investigated. The experimental data were analyzed by the Langmuir, Freundlich and Temkin models of adsorption. The adsorption isotherm data were fitted well to Langmuir isotherm and the monolayer adsorption capacity was found to be 70.92 mg/g at 30 degrees C. The kinetic data obtained at different concentrations have been analyzed using a pseudo-first-order, pseudo-second-order equation and intraparticle diffusion equation. The experimental data fitted very well the pseudo-second-order kinetic model.

  3. Effects of Humidity Swings on Adsorption Columns for Air Revitalization: Modeling and Experiments

    NASA Technical Reports Server (NTRS)

    LeVan, M. Douglas; Finn, John E.

    1997-01-01

    The goal of this research was to develop a dynamic model which can predict the effect of humidity swings on activated carbon adsorption beds used to remove trace contaminants from the atmosphere in spacecraft. Specifically, the model was to be incorporated into a computer simulation to predict contaminant concentrations exiting the bed as a function of time after a humidity swing occurs. Predicted breakthrough curves were to be compared to experimentally measured results. In all respects the research was successful. The two major aspects of this research were the mathematical model and the experiments. Experiments were conducted by Mr. Appel using a fixed-bed apparatus at NASA-Ames Research Center during the summers of 1994 and 1995 and during the first 8 months of 1996. Mr. Appel conducted most of his mathematical modeling work at the University of Virginia. The simulation code was used to predict breakthrough curves using adsorption equilibrium correlations developed previously by M. D. LeVan's research group at the University of Virginia. These predictions were compared with the experimental measurements, and this led to improvements in both the simulation code and the apparatus.

  4. Adsorption characteristics of brilliant green dye on kaolin.

    PubMed

    Nandi, B K; Goswami, A; Purkait, M K

    2009-01-15

    Experimental investigations were carried out to adsorb toxic brilliant green dye from aqueous medium using kaolin as an adsorbent. Characterization of kaolin is done by measuring: (i) particle size distribution using particle size analyzer, (ii) BET surface area using BET surface analyzer, and (iii) structural analysis using X-ray diffractometer. The effects of initial dye concentration, contact time, kaolin dose, stirring speed, pH and temperature were studied for the adsorption of brilliant green in batch mode. Adsorption experiments indicate that the extent of adsorption is strongly dependent on pH of solution. Free energy of adsorption (DeltaG0), enthalpy (DeltaH0) and entropy (DeltaS0) changes are calculated to know the nature of adsorption. The calculated values of DeltaG0 at 299K and 323K indicate that the adsorption process is spontaneous. The estimated values of DeltaH0 and DeltaS0 both show the negative sign, which indicate that the adsorption process is exothermic and the dye molecules are organized on the kaolin surface in less randomly fashion than in solution. The adsorption kinetic has been described by first-order, pseudo-second-order and intra-particle-diffusion models. It was observed that the rate of dye adsorption follows pseudo-second-order model for the dye concentration range studied in the present case. Standard adsorption isotherms were used to fit the experimental equilibrium data. It was found that the adsorption of brilliant green on kaolin follows the Langmuir adsorption isotherm.

  5. [Adsorption of acid orange II from aqueous solution onto modified peat-resin particles].

    PubMed

    Sun, Qing-Ye; Yang, Lin-Zhang

    2007-06-01

    The adsorption of acid orange II onto modified peat-resin particles was examined in aqueous solution in a batch system. The Langmuir and Freundlich adsorption models were applied to describe the equilibrium isotherms. The pseudo-first-order, pseudo-second-order kinetic and the intraparticle diffusion models were used to describe the kinetic data. The results showed that both Langmuir and Freundlich adsorption models could be used to describe the adsorption of acid orange II onto modified peat-resin particles. The maximum adsorption capacity was 71.43 mg x g(-1). The data analysis indicated that the intraparticle diffusion model could fit the results of kinetic experiment well. The adsorption rate of acid orange II onto modified peat-resin particles is affected by the initial dye concentrations, sizes and doses of modified peat-resin particles and agitation rates. The surface of modified peat-resin particle is the major adsorption area.

  6. Adsorption potential of mercury(II) from aqueous solutions onto Romanian peat moss.

    PubMed

    Bulgariu, Laura; Ratoi, Mioara; Bulgariu, Dumitru; Macoveanu, Matei

    2009-06-01

    This study was undertaken to evaluate the adsorption potential of Romanian peat moss for the removal of mercury(II) from aqueous solutions. The batch system experiments carried out showed that this natural material was effective in removing mercury(II). The analysis of FT-IR spectra indicated that the mechanism involved in the adsorption can be mainly attributed to the binding of mercury(II) with the carboxylic groups of Romanian peat moss. Adsorption equilibrium approached within 60 min. The adsorption data fitted well the Langmuir isotherm model. The maximum adsorption capacity (qmax) was 98.94 mg g(-1). Pseudo-second-order kinetic model was applicable to the adsorption data. The thermodynamic parameters indicate that the adsorption process was spontaneous as the Gibbs free energy values were found to be negative (between -17.58 and -27.25 kJ mol(-1)) at the temperature range of 6-54 degrees C.

  7. H2S adsorption onto Cu-Zn-Ni nanoparticles loaded activated carbon and Ni-Co nanoparticles loaded γ-Al2O3: Optimization and adsorption isotherms.

    PubMed

    Daneshyar, A; Ghaedi, M; Sabzehmeidani, M M; Daneshyar, A

    2017-03-15

    The nanocomposites based on copper, zinc and nickel were loaded on activated carbon (Cu-Zn-Ni-NPs-AC) and cobalt and nickel nanoparticles was loaded on γ-alumina (Ni-Co-NPs-γAl2O3) and applied for removal of hydrogen sulfide (H2S) from natural gas and their efficiency were compared. Cu-Zn-Ni/AC and Ni-Co/γ-Al2O3 was characterized using different techniques such as energy-dispersive X-ray spectroscopy (EDX), X-ray diffraction (XRD) and field emission scanning electron microscopy (FE-SEM). The effects of variables such as amount of adsorbent, flow rate, temperature, pressure and volume of gas on H2S removal were examined and optimum values were found to be 0.3g adsorbent, and flow rate of 0.15L/min and 15°C and 7Psi for both adsorbent and also 5.5 and 6.5L of sample by Cu-Zn-Ni/C and Co-Ni/γ-Al2O3, respectively. Setting conditions at the above optimum conditions lead to achievement of maximum removal of H2S (94% and 91.6%) by Cu-Zn-Ni/AC and Co-Ni/γ-Al2O3. The negative value of ΔG° and its numerical value confirm physisorption nature of adsorption. The experimental equilibrium data with high efficiency were explained and represented by Langmuir model for both adsorbents with the highest correlation coefficients.

  8. Assessment of multi-mycotoxin adsorption efficacy of grape pomace.

    PubMed

    Avantaggiato, Giuseppina; Greco, Donato; Damascelli, Anna; Solfrizzo, Michele; Visconti, Angelo

    2014-01-15

    Grape pomace (pulp and skins) was investigated as a new biosorbent for removing mycotoxins from liquid media. In vitro adsorption experiments showed that the pomace obtained from Primitivo grapes is able to sequester rapidly and simultaneously different mycotoxins. Aflatoxin B1 (AFB1) was the most adsorbed mycotoxin followed by zearalenone (ZEA), ochratoxin A (OTA), and fumonisin B1 (FB1), whereas the adsorption of deoxynivalenol (DON) was negligible. AFB1 and ZEA adsorptions were not affected by changing pH values in the pH 3-8 range, whereas OTA and FB1 adsorptions were significantly affected by pH. Equilibrium adsorption isotherms obtained at different temperatures (5-70 °C) and pH values (3 and 7) were modeled and evaluated using the Freundlich, Langmuir, Sips, and Hill models. The goodness of the fits and the parameters involved in the adsorption mechanism were calculated by the nonlinear regression analysis method. The best-fitting models to describe AFB1, ZEA, and OTA adsorption by grape pomace were the Sips, Langmuir, and Freundlich models, respectively. The Langmuir and Sips models were the best models for FB1 adsorption at pH 7 and 3, respectively. The theoretical maximum adsorption capacities (mmol/kg dried pomace) calculated at pH 7 and 3 decreased in the following order: AFB1 (15.0 and 15.1) > ZEA (8.6 and 8.3) > OTA (6.3-6.9) > FB1 (2.2 and 0.4). Single- and multi-mycotoxin adsorption isotherms showed that toxin adsorption is not affected by the simultaneous presence of different mycotoxins in the liquid medium. The profiles of adsorption isotherms obtained at different temperatures and pH and the thermodynamic parameters (ΔG°, ΔH°, ΔS°) suggest that mycotoxin adsorption is an exothermic and spontaneous process, which involves physisorption weak associations. Hydrophobic interactions may be associated with AFB1 and ZEA adsorption, whereas polar noncovalent interactions may be associated with OTA and FB1 adsorption. In conclusion, this study

  9. Bridging the gap between batch and column experiments: A case study of Cs adsorption on granite.

    PubMed

    Wang, Tsing-Hai; Li, Ming-Hsu; Teng, Shi-Ping

    2009-01-15

    Both batch and column methods are conventionally utilized to determine some critical parameters for assessing the transport of contaminants of concern. The validity of using these parameters is somewhat confusing, however, since outputs such as distribution coefficient (Kd) from these two approaches are often discrepant. To bridge this gap, all possible factors that might contribute to this discrepancy were thoroughly investigated in this report by a case study of Cs sorption to crushed granite under various conditions. Our results confirm an important finding that solid/liquid (S/L) ratio is the dominant factor responsible for this discrepancy. As long as the S/L ratio exceeds 0.25, a consistent Kd value can be reached by the two methods. Under these conditions (S/L ratios>0.25), the sorption capacity of the solid is about an order of magnitude less than that in low S/L ratios (<0.25). Although low sorption capacity is observed in the cases of high S/L ratios, the sorption usually takes place preferentially on the most favorable (thermodynamically stable) sorption sites to form a stronger binding. This is verified by our desorption experiments in which a linear isotherm feature is shown either in deionized water or in 1M of ammonium acetate solutions. It may be concluded that batch experiment with an S/L ratio exceeding 0.25 is crucial to obtain convincing Kd values for safety assessment of radioactive waste repository.

  10. Characteristics of simultaneous ammonium and phosphate adsorption from hydrolysis urine onto natural loess.

    PubMed

    Jiang, Shanqing; Wang, Xiaochang; Yang, Shengjiong; Shi, Honglei

    2016-02-01

    Nutrient recovery from human urine is a promising pretreatment of domestic wastewater and provides a sustainable recyclability of N and P. In this study, batch experiments were conducted to identify the characteristics of natural loess (NL) for the adsorption and recovery of ammonium and phosphate from hydrolysis urine (HU). The adsorption mechanisms, the adsorption kinetics and isotherms, as well as the major influencing factors, such as pH and temperature, were investigated. Results revealed that adsorption of ammonium occurred by means of ion exchange and molecule adsorption with the ≡ Si-OH groups, while phosphate adsorption was based on the calcium phosphate precipitation reaction and formation of inner-sphere complexes with ≡ M-OH groups. The adsorption processes of ammonium and phosphate were well described by the pseudo-second-order kinetic model and the Freundlich isotherm model. Adsorption of phosphate was endothermic, while ammonium adsorption was exothermic. Furthermore, the maximum ammonium and phosphate adsorption capacities of NL was 23.24 mg N g(-1) and 4.01 mg P g(-1) at an initial pH of 9 and 10, respectively. Results demonstrated that nutrient-adsorbed NL used as compound fertilizer or conventional fertilizer superaddition was feasible for its high contents of N and P as well as its environmental friendliness.

  11. Adsorptive removal of methylene blue by CuO-acid modified sepiolite as effective adsorbent and its regeneration with high-temperature gas stream.

    PubMed

    Su, Chengyuan; Wang, Liang; Chen, Menglin; Huang, Zhi; Lin, Xiangfeng

    In this study, the dynamic adsorption of methylene blue dye onto CuO-acid modified sepiolite was investigated. Meanwhile, the equilibrium and kinetic data of the adsorption process were studied to understand the adsorption mechanism. Furthermore, a high-temperature gas stream was applied to regenerate the adsorbent. The results showed that the Langmuir isotherm model was applied to describe the adsorption process. The positive value of enthalpy change indicated that the adsorption process was endothermic in nature. In the dynamic adsorption process, the best adsorption performance was achieved when the ratio of column height to diameter was 2.56 and the treatment capacity was 6 BV/h. The optimal scenario for regeneration experiments was the regeneration temperature of 550-650 °C, the space velocity of 100 min(-1) and the regeneration time of 10 min. The effective adsorption of CuO-acid modified sepiolite was kept for 12 cycles of adsorption and regeneration.

  12. Modification of a magnetic carbon composite for ciprofloxacin adsorption.

    PubMed

    Mao, Haixin; Wang, Shikui; Lin, Jian-Ying; Wang, Zengshuang; Ren, Jun

    2016-11-01

    A magnetic carbon composite, Fe3O4/C composite, was fabricated by one-step hydrothermal synthesis, modified by heat treatment under an inert atmosphere (N2), and then used as an adsorbent for ciprofloxacin (CIP) removal. Conditions for the modification were optimized according to the rate of CIP removal. The adsorbent was characterized by Fourier transform infrared spectroscopy, X-ray diffraction measurements, vibrating-sample magnetometry, scanning electron microscopy, transmission electron microscopy, and N2 adsorption/desorption isotherm measurements. The results indicate that the modified adsorbent has substantial magnetism and has a large specific area, which favor CIP adsorption. The effects of solution pH, adsorbent dose, contact time, initial CIP concentration, ion strength, humic acid and solution temperature on CIP removal were also studied. Our results show that all of the above factors influence CIP removal. The Langmuir adsorption isotherm fits the adsorption process well, with the pseudo second-order model describing the adsorption kinetics accurately. The thermodynamic parameters indicate that adsorption is mainly physical adsorption. Recycling experiments revealed that the behavior of adsorbent is maintained after recycling for five times. Overall, the modified magnetic carbon composite is an efficient adsorbent for wastewater treatment.

  13. 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.

  14. Effective surface areas of coals measured by dye adsorption

    SciTech Connect

    Spitzer, D.P.

    1988-01-01

    The primary interest has been to examine adsorption behavior especially at short contact times, ten minutes to an hour, to determine whether such measurements might give useful data on effective surface areas - i.e., the surface that would be accessible to reagents within times comparable to those typical of most coal processing. Accordingly, most of the emphasis is on the effect of time on adsorption, rather than on traditional adsorption isotherms. Although most literature on cationic dye adsorption (mostly on carbons) uses methylene blue, it happened that the authors originally used safranin O instead because this dye was reported to be useful in distinguishing oxidized coals from fresh coals. Many of their experiments were repeated using methylene blue (in water), with very similar results. It was noted early that swelling of coals in water was common, especially for more oxidized or lower rank coals, and adsorption experiments were also done in another solvent, namely methanol. This produced quite striking differences for some coals. Coal surfaces that are readily accessible to adsorption by safranin are found to correlate well with N/sub 2/ surface areas, with adsorption of 1.0 mg safranin per gram of coal corresponding to essentially a surface area of 1.0 m/sup 2//g. Highly oxidized coals were found to swell considerably in water, with correspondingly increased adsorption. Areas of such coals can be estimated by adsorption of safranin from methanol solutions.

  15. Metal adsorption on mosses: Toward a universal adsorption model.

    PubMed

    González, A G; Pokrovsky, O S

    2014-02-01

    This study quantifies the adsorption of heavy metals on 4 typical moss species used for environmental monitoring in the moss bag technique. The adsorption of Cu(2+), Cd(2+), Ni(2+), Pb(2+) and Zn(2+) onto Hypnum sp., Sphagnum sp., Pseudoscleropodium purum and Brachytecium rutabulum has been investigated using a batch reactor in a wide range of pH (1.3-11.0) and metal concentrations in solution (1.6μM-3.8mM). A Linear Programming Model (LPM) was applied for the experimental data to derive equilibrium constants and the number of surface binding sites. The surface acid-base titration performed for 4 mosses at a pH range of 3-10 in 0.1M NaNO3 demonstrated that Sphagnum sp. is the most efficient adsorbent as it has the maximal number of proton-binding sites on the surface (0.65mmol g(-1)). The pKa computed for all the moss species suggested the presence of 5 major functional groups: phosphodiester, carboxyl, phosphoryl, amine and polyphenols. The results of pH-edge experiments demonstrated that B. rutabulum exhibits the highest percentage of metal adsorption and has the highest number of available sites for most of the metals studied. However, according to the results of the constant pH "Langmuirian" isotherm, Sphagnum sp. can be considered as the strongest adsorbent, although the relative difference from other mosses is within 20%. The LPM was found to satisfactorily fit the experimental data in the full range of the studied solution parameters. The results of this study demonstrate a rather similar pattern of five metal adsorptions on mosses, both as a function of pH and as a metal concentration, which is further corroborated by similar values of adsorption constants. Therefore, despite the species and geographic differences between the mosses, a universal adsorption edge and constant pH adsorption isotherm can be recommended for 4 studied mosses. The quantitative comparison of metal adsorption with other common natural organic and inorganic materials demonstrates

  16. Extracting survival parameters from isothermal, isobaric, and "iso-concentration" inactivation experiments by the "3 end points method".

    PubMed

    Corradini, M G; Normand, M D; Newcomer, C; Schaffner, D W; Peleg, M

    2009-01-01

    Theoretically, if an organism's resistance can be characterized by 3 survival parameters, they can be found by solving 3 simultaneous equations that relate the final survival ratio to the lethal agent's intensity. (For 2 resistance parameters, 2 equations will suffice.) In practice, the inevitable experimental scatter would distort the results of such a calculation or render the method unworkable. Averaging the results obtained with more than 3 final survival ratio triplet combinations, determined in four or more treatments, can remove this impediment. This can be confirmed by the ability of a kinetic inactivation model derived from the averaged parameters to predict survival patterns under conditions not employed in their determination, as demonstrated with published isothermal survival data of Clostridium botulinum spores, isobaric data of Escherichia coli under HPP, and Pseudomonas exposed to hydrogen peroxide. Both the method and the underlying assumption that the inactivation followed a Weibull-Log logistic (WeLL) kinetics were confirmed in this way, indicating that when an appropriate survival model is available, it is possible to predict the entire inactivation curves from several experimental final survival ratios alone. Where applicable, the method could simplify the experimental procedure and lower the cost of microbial resistance determinations. In principle, the methodology can be extended to deteriorative chemical reactions if they too can be characterized by 2 or 3 kinetic parameters.

  17. [Characteristic of ammonia nitrogen adsorption on karst underground river sediments].

    PubMed

    Guo, Fang; Chen, Kun-Kun; Jiang, Guang-Hui

    2011-02-01

    Karst aquifers are one of the most important aquifers in Southwestern China. One of the characteristics of karst aquifers is the enhanced permeability permits high flow velocities are capable of transporting suspended and bedload sediments. Mobile sediment in karst may act as a vector for the transport of contaminates. 14 sediment samples were collected from two underground rivers in two typical karst areas in Liuzhou city, Guangxi Autonomous Region, China. According to simulated experiment methods, characteristic of adsorption of ammonia nitrogen on sediment was studied. The results of ammonia nitrogen adsorption dynamics on sediments showed that the maximum adsorption velocity was less than 2 h. The adsorption balance quantity in 5 h accounted for 71% - 98% of the maximum adsorption quantity. The maximum adsorption quantity of ammonia nitrogen was 385.5 mg/kg, which was sediment from a cave in the middle areas of Guancun underground river system. The study of isotherm adsorption indicated adsorption quantity of NH4+ increase followed by incremental balance concentration of NH4+ in the aquatic phase. Adsorption quantity of ammonia nitrogen in sediments has a relative linear relationship with adsorption balance concentrations. Adsorption-desorption balance concentrations were all low, indicating sediments from underground rivers have great adsorption potential. Under the condition of low and high concentrations of ammonia nitrogen in overlying water, Langmuir and Tempkin couldn't simulate or simulate results couldn't reach remarkable level, whilst Linear and Freundlich models could simulate well. Research on different type sediments, sampling times and depths from two underground rivers shows characteristic of ammonia nitrogen adsorption on karst underground river sediments doesn't have good correspondence with the type of sediments. One of the reasons is there is no big difference between sediments in the development of climate, geology, hydrological conditions

  18. Exploring the Stability of Gold Nanoparticles by Experimenting with Adsorption Interactions of Nanomaterials in an Undergraduate Lab

    ERIC Educational Resources Information Center

    Lee, Chi-Feng; You, Pei-Yun; Lin, Ying-Chiao; Hsu, Tsai-Ling; Cheng, Pi-Yun; Wu, Yu-Xuan; Tseng, Chi-Shun; Chen, Sheng-Wen; Chang, Huey-Por; Lin, Yang-Wei

    2015-01-01

    The proposed experiment can help students to understand the factors involved in the stability of gold nanoparticles (Au NPs) by exploring the adsorption interaction between Au NPs and various substances. The students in this study found that the surface plasmon resonance band of Au NP solutions underwent a red shift (i.e., from 520 to 650 nm)…

  19. Removal of Cd2+ from aqueous solution by adsorption using Fe-montmorillonite.

    PubMed

    Wu, Pingxiao; Wu, Weimin; Li, Shuzhen; Xing, Ning; Zhu, Nengwu; Li, Ping; Wu, Jinghua; Yang, Chen; Dang, Zhi

    2009-09-30

    Fe-montmorillonite (Fe-Mont.) is obtained by exchanging the original interlayer cations of montmorillonite by poly-hydroxyl ferric. In this paper, Fe-Mont. was synthesized by using Ca-montmorillonite (Ca-Mont.) directly under ultrasonic treatment with the aim to enhance the ability of removal of heavy metal ions from wastewater. The modified materials were characterized by X-ray diffraction (XRD) and Fourier transform infrared (FT-IR). Batch equilibrium experiments of Cd(II) ions (Cd(2+)) adsorption on the Fe-Mont. were performed. Effects of the initial pH of the solution and contact time on the adsorption of Cd(2+) were studied. Four types of adsorption isotherms were applied to describe the adsorption isotherms of Cd(2+) by Fe-Mont. The relationship between adsorbing capacity (q(e)) and equilibrium mass concentration (C(e)) is in accordance with the isothermal adsorption equation of Langmuir. Three kinetic models, including pseudo-first-order, pseudo-second-order and the Elovich equation model, were used to analyze the Cd(2+) adsorption process. The pseudo-second-order chemical reaction kinetics provide the best correlation of the experimental data, therefore the adsorption dynamics follows the laws of pseudo-second-order kinetics.

  20. Fixed-bed adsorption of toluene on high silica zeolites: experiments and mathematical modelling using LDF approximation and a multisite model.

    PubMed

    Brodu, Nicolas; Sochard, Sabine; Andriantsiferana, Caroline; Pic, Jean-Stéphane; Manero, Marie-Hélène

    2015-01-01

    The adsorption of toluene (TOL) as a target volatile organic compound has been studied experimentally and modelled on various hydrophobic zeolites: Faujasite (FAU), ZSM-5 (Z) and Mordenite (MOR). The influence of the nature of the compensating cation (H+ or Na+) has also been investigated for ZSM-5 zeolite, which is known to possess three kinds of adsorption sites (sinusoidal channels, straight channels and intersections). Type I isotherms observed on FAU, Na-Z and MOR fitted well with the Langmuir model. A deviation from a type I isotherm was observed for H-Z, because of the structure of this zeolite. The Successive Langmuir Model was more successful to fit the 'bump' of the experimental curve than the Double Langmuir. Classical shapes were found for MOR, FAU and Na-Z breakthrough curves that were fitted with good accuracy using the Linear Driving Force (LDF) approximation. In the case of H-Z, a change of profile was observed during the dynamic adsorption and the differences seen between the Na-Z and H-Z behaviours were explained by the strong interactions between Na+ and adsorbed TOL at the intersection sites. The Na+ cations prevented reorientation of TOL molecules at the intersection and thereby avoided the filling of the sinusoidal channel segments. Thus, a specific model was developed for fitting the breakthrough curve of H-Z. The model developed took into account these two types of adsorption sites with the overall uptake for each site being given by an LDF approximation.

  1. Isothermal vapour flow in extremely dry soils

    NASA Astrophysics Data System (ADS)

    Todman, L. C.; Ireson, A. M.; Butler, A. P.; Templeton, M. R.

    2012-04-01

    In dry soils hydraulic connectivity within the liquid water phase decreases and vapour flow becomes a significant transport mechanism for water. The temperature or solute concentration of the liquid phase affects the vapour pressure of the surrounding air, thus temperature or solute gradients can drive vapour flows. However, in extremely dry soils where water is retained by adsorptive forces rather than capillarity, vapour flows can also occur. In such soils tiny changes in water content significantly affect the equilibrium vapour pressure in the soil, and hence small differences in water content can initiate vapour pressure gradients. In many field conditions this effect may be negligible compared to vapour flows driven by other factors. However, flows of this type are particularly significant in a new type of subsurface irrigation system which uses pervaporation, via a polymer tubing, as the mechanism for water supply. In this system, water enters the soil in vapour phase. Experiments were performed in laboratory conditions using marine sand that had previously been oven dried and cooled. This dry sand was used to represent the desert conditions in which this irrigation system is intended for use. Experimental results show that isothermal vapour flows can significantly affect the performance of such irrigation systems due to the rapid transport of water through the soil via the vapour phase. When the irrigation pipe was buried at a depth of 10cm a vapour flow from the soil surface was observed in less than 2 hours. These flows therefore affect the loss of mass into the atmosphere and thus must be considered when evaluating the availability of water for the irrigated crop. The experiments also provide a rare opportunity to observe isothermal vapour flows initiating from a subsurface source. Such experiments allow the significance of these flows to be quantified and potentially applied to other areas of arid zone hydrology.

  2. Kinetic Study of Adsorption Processes in Solution: An Undergraduate Physical Chemistry Experiment.

    ERIC Educational Resources Information Center

    Casado, Julio; And Others

    1985-01-01

    Background information, apparatus needed, procedures used, and results obtained are provided for a simple kinetic method for the monitoring of adsorption processes. The method, which involved adsorption of crystal violet onto activated carbon, is suitable for classroom and/or research purposes. (JN)

  3. Simultaneous adsorption of phenol and cadmium on amphoteric modified soil.

    PubMed

    Meng, Zhao-Fu; Zhang, Yi-Ping; Zhang, Zeng-Qiang

    2008-11-30

    Surface modification is an effective way to enhance adsorption of pollutants by soil. In this study, we investigated the individual adsorption of cadmium ion (Cd(2+)) and phenol and also in combination by the clay layer of a loessial soil treated with the amphoteric modifier, duodalkylbetaine (BS-12). Three levels of BS-12 modification were compared in this experiment: (1) unmodified soil (CK), (2) modification with an amount of BS-12 equivalent to 50% of the soil's CEC (50BS) and (3) modification with an amount of BS-12 equivalent to 100% of the soil's CEC (100BS). Cd(2+) adsorption was 0.92-1.70 times higher in the amphoteric modified soil compared to unmodified soil. Adsorption isotherms for Cd(2+) displayed a L1-type shape. Phenol adsorption was 1.25-4.35 times higher in the amphoteric modified soil compared to the unmodified control. The adsorption isotherms of phenol on amphoteric modified soils were generally linear, but changed to L1-type isotherms for modified soil in the Cd(2+)+phenol treatment at 40 degrees C. The results clearly showed that amphoteric modified soil had the ability to simultaneously adsorb Cd(2+) and phenol. Cd(2+) adsorption by the amphoteric modified soil was related to the initial concentration of Cd(2+) in the supernatant. Cd(2+) adsorption in the 100BS treatment exceeded adsorption in the 50BS treatment when Cd(2+) initial concentrations were higher than approximate 200 microg mL(-1). Phenol adsorption by modified soils decreased in the order: 100BS>50BS>CK and was primarily determined by the surface hydrophobicity of the soil. For the unmodified soil, total adsorption in the Cd(2+)+phenol treatment was slightly lower compared to treatments that contained only Cd(2+) or phenol. This indicated an antagonistic effect between the adsorption of Cd(2+) and phenol, which was reduced after amphoteric modification. A comparison of temperature effects on Cd(2+) and phenol adsorption indicated that Cd(2+) was both physically and chemically

  4. Batch and column studies of adsorption of Li, Ni and Br by a reference sand for contaminant transport experiments

    SciTech Connect

    Seigel, M.D.; Ward, D.B.; Bryan, C.R.

    1995-09-01

    A processed quartz sand (Wedron 510), mined from the St. Peter sandstone, has been characterized by a variety of chemical and physical methods for use as a reference porous media in transport model validation experiments. Wedron 510 sand was used in an intermediate-scale experiment involving migration of Ni, Li and Br through a 6-m high x 3-m diameter caisson. Ni and Li adsorption/desorption, and Li/Ni site-competition experiments yielded information on the importance of the trace mineral phases to adsorption of Li and Ni by the sand. The presence of an iron hydroxide coating similar to goethite on the sand grains is suggested by visual observation and leaching experiments. Kaolinite was identified by SEM and XRD as a significant trace mineral phase in the sand and occurs as small particles coating the sand grains. Quartz, the predominant constituent of the sand by weight, does not appear to contribute significantly to the adsorption properties of the sand. Qualitatively, the adsorption properties of the sand can be adequately modeled as a two-mineral system (goethite and kaolinite). The studies described in this report should provide a basis for understanding transport of Ni, Li and Br through porous media similar to the reference sand. Techniques were developed for obtaining parameter values for surface complexation and kinetic adsorption models for the sand and its mineral components. These constants can be used directly in coupled hydrogeochemical transport codes. The techniques should be useful for characterization of other natural materials and elements in high-level nuclear waste in support of coupled hydrogeochemical transport calculations for Yucca Mountain.

  5. Applications and limits of theoretical adsorption models for predicting the adsorption properties of adsorbents.

    PubMed

    Park, Hyun Ju; Nguyen, Duc Canh; Na, Choon-Ki; Kim, Chung-il

    2015-01-01

    The objective of this study is to evaluate the applicability of adsorption models for predicting the properties of adsorbents. The kinetics of the adsorption of NO3- ions on a PP-g-AA-Am non-woven fabric have been investigated under equilibrium conditions in both batch and fixed bed column processes. The adsorption equilibrium experiments in the batch process were carried out under different adsorbate concentration and adsorbent dosage conditions and the results were analyzed using adsorption isotherm models, energy models, and kinetic models. The results of the analysis indicate that the adsorption occurring at a fixed adsorbate concentration with a varying adsorbent dosage occur more easily compared to those under a fixed adsorbent dosage with a varying adsorbate concentration. In the second part of the study, the experimental data obtained using fixed bed columns were fit to Bed Depth Service Time, Bohart-Adams, Clark, and Wolborska models, to predict the breakthrough curves and determine the column kinetic parameters. The adsorption properties of the NO3- ions on the PP-g-AA-Am non-woven fabric were differently described by different models for both the batch and fixed bed column process. Therefore, it appears reasonable to assume that the adsorption properties were dominated by multiple mechanisms, depending on the experimental conditions.

  6. Adsorption of 1,1,1,2-tetrafluoroethane by various adsorbents

    SciTech Connect

    Lin, S.H.; Lin, R.C.

    1999-11-01

    Experiments have been conducted to investigate gas-phase adsorption characteristics of 1,1,1,2-tetrafluoroethane (HFC-134a) by activated carbon fiber, extruded activated carbon, granular activated carbon, activated alumina, and molecular sieve. HGC-134a is currently regarded as an excellent replacement for chlorofluorocarbon-12, a refrigerating and cooling agent extensively used previously in all automobiles and many cooling systems. Performances of HFC-134a adsorption were characterized by the equilibrium adsorption capacity, time to reach equilibrium, and desorption efficiency of exhausted adsorbent. A simple thermal treatment process with proper operating temperature and treatment duration was found to be effective for the regeneration of exhausted absorbents. Adsorption isotherms of the empirical Freundlich and Hossens types were observed to adequately represent the equilibrium adsorption data. A mass transfer model based on the pseudo steady state squared driving force was adopted to describe the mass transfer process of HFC-134a adsorption.

  7. [Adsorption-desorption Characteristics of Fermented Rice Husk for Ferrous and Sulfur Ions].

    PubMed

    Xie, Xiao-mei; Liao, Min; Hua, Jia-yuan; Chen, Na; Zhang, Nan; Xu, Pei-zhi; Xie Kai-zhi; XU, Chang-xu; Liu, Guang-rong

    2015-10-01

    To understand the potential of rice husk to fix Fe2+ and S2- ions, the sorption of Fe2+ and S2- by fermented rice husk was studied by using batch incubation experiments in the present study. The effects of adsorption time, Fe2+ and S2- concentration, pH, the temperature and ionic strength in adsorption reaction solution on the sorption were investigated. Therefore, the stability of Fe2+ and S2- adsorbed by fermented rice husk was further validated by desorption experiments performed under similar conditions as adsorption. The results showed that, the adsorption kinetics of Fe2+ (r = 0.912 1) and S2- (r = 0.901 1) by fermented rice husk fits the Elovich kinetics equation, and Freundlich isotherm model could simulate the isotherm adsorption processes of Fe2+ (R2 = 0.965 1) and S2- (R2 = 0.936 6) on fermented rice husk was better than other models. The adsorption processes on fermented rice husk were non- preferential adsorption for Fe2+ and S2, while the adsorption process of Fe2+ on fermented rice husk was spontaneous reaction and the adsorption process of S2- was non-spontaneous reaction. The adsorption processes of Fe2+ and S2- on fermented rice husk were endothermic process since high temperature could benefit to the adsorption. The adsorption mechanism of Fe2+ on fermented rice husk was mainly controlled by coordination adsorption, the adsorption mechanism of S2- on fermented rice husk was mainly controlled by ligand exchange adsorption. The adsorption processes of Fe2+ and S2- on fermented rice husk showed greater pH adaptability which ranged from 1.50 to 11.50. With the increasing of ionic strength, the amount of adsorbed Fe2+ on fermented rice husk wasincreased in some extent, the amount of adsorbed S2- on fermented rice husk was slightly decreased, which further proved the adsorption of Fe2+ was major in inner sphere complexation and the adsorption of S2- was major in outer complexation. The desorption rates of Fe2+ and S2- which was adsorbed by fermented

  8. BTEX and MTBE adsorption onto raw and thermally modified diatomite.

    PubMed

    Aivalioti, Maria; Vamvasakis, Ioannis; Gidarakos, Evangelos

    2010-06-15

    The removal of BTEX (benzene, toluene, ethyl-benzene and xylenes) and MTBE (methyl tertiary butyl ether) from aqueous solution by raw (D(R)) and thermally modified diatomite at 550, 750 and 950 degrees C (D(550), D(750) and D(950) respectively) was studied. Physical characteristics of both raw and modified diatomite such as specific surface, pore volume distribution, porosity and pH(solution) were determined, indicating important structural changes in the modified diatomite, due to exposure to high temperatures. Both adsorption kinetic and isotherm experiments were carried out. The kinetics data proved a closer fit to the pseudo-second order model. Maximum values for the rate constant, k(2), were obtained for MTBE and benzene (48.9326 and 18.0996 g mg(-1)h(-1), respectively) in sample D(550). The isotherm data proved to fit the Freundlich model more closely, which produced values of the isotherm constant 1/n higher than one, indicating unfavorable adsorption. The highest adsorption capacity, calculated through the values of the isotherm constant k(F), was obtained for MTBE (48.42 mg kg(-1) (mg/L)(n)) in sample D(950).

  9. Batch adsorption of phenol onto physiochemical-activated coconut shell.

    PubMed

    Mohd Din, Azam T; Hameed, B H; Ahmad, Abdul L

    2009-01-30

    The liquid-phase adsorption of phenol onto coconut shell-based activated carbon, CS850A was investigated for its equilibrium studies and kinetic modeling. Coconut shell was converted into high quality activated carbon through physiochemical activation at 850 degrees C under the influence of CO(2) flow. Beforehand, the coconut shell was carbonized at 700 degrees C and the resulted char was impregnated with KOH at 1:1 weight ratio. In order to evaluate the performance of CS850A, a series of batch adsorption experiments were conducted with initial phenol concentrations ranging from 100 to 500 mg l(-1), adsorbent loading of 0.2g and the adsorption process was maintained at 30+/-1 degrees C. The adsorption isotherms were in conformation to both Langmuir and Freundlich isotherm models. Chemical reaction was found to be a rate-controlling parameter to this phenol-CS850A batch adsorption system due to strong agreement with the pseudo-second-order kinetic model. Adsorption capacity for CS850A was found to be 205.8 mg g(-1).

  10. Comparative evaluation of adsorption kinetics of diclofenac and isoproturon by activated carbon.

    PubMed

    Torrellas, Silvia A; Rodriguez, Araceli R; Escudero, Gabriel O; Martín, José María G; Rodriguez, Juan G

    2015-01-01

    Adsorption mechanism of diclofenac and isoproturon onto activated carbon has been proposed using Langmuir and Freundlich isotherms. Adsorption capacity and optimum adsorption isotherms were predicted by nonlinear regression method. Different kinetic equations, pseudo-first-order, pseudo-second-order, intraparticle diffusion model and Bangham kinetic model, were applied to study the adsorption kinetics of emerging contaminants on activated carbon in two aqueous matrices.

  11. Equilibrium sorption isotherms for nitrate on resin Amberlite IRA 400.

    PubMed

    Chabani, M; Amrane, A; Bensmaili, A

    2009-06-15

    The adsorption isotherms of nitrate on resin Amberlite IRA 400 at various pH, in the range 2-12, were experimentally determined by batch tests. The experimental data have been analysed using the Langmuir, Freundlich, Redlich-Peterson and Sips isotherms models. In order to determine the best fit isotherm, two error analysis methods were used to evaluate the data: the regression correlation coefficient, and the statistic Chi-square test. In the range of pH tested, the Sips model was found to give the best fit of the adsorption isotherm data. The maximum adsorption capacity can be deduced from the obtained correlation coefficients and was found to decrease for increasing pH.

  12. Comparison of batch, stirred flow chamber, and column experiments to study adsorption, desorption and transport of carbofuran within two acidic soils.

    PubMed

    Bermúdez-Couso, Alipio; Fernández-Calviño, David; Rodríguez-Salgado, Isabel; Nóvoa-Muñoz, Juan Carlos; Arias-Estévez, Manuel

    2012-06-01

    Different methods (batch, column and stirred flow chamber experiments) used for adsorption and desorption of carbofuran studies were compared. All tested methods showed that the carbofuran adsorption was higher in the soil with the higher organic matter content, whereas the opposite behaviour was observed for the percentage of carbofuran desorbed. However, different methods have revealed some discrepancies in carbofuran adsorption/desorption kinetics. Although batch method showed interesting data on equilibrium experiments, such as a low heterogeneity for the carbofuran adsorption sites independent of soil organic matter content, it had some disadvantages for carbofuran adsorption/desorption kinetic studies. The disadvantages were related with the excessive limitations of this method on kinetics, i.e., no difference could be detected between different soils. However, with column and stirred flow chamber methods the carbofuran adsorption/desorption kinetics of different soils could be compared. Moreover, the absolute values of carbofuran adsorption/desorption and its rate were higher in the stirred flow chamber than in the batch and column experiments. Using stirred flow chamber experiments the carbofuran desorption was significantly faster than its adsorption, whereas carbofuran using column experiments they were similar. These discrepancies should be considered when the results obtained only with one method is discussed.

  13. Optimization of lead adsorption of mordenite by response surface methodology: characterization and modification

    PubMed Central

    2014-01-01

    Background In order to remove heavy metals, water treatment by adsorption of zeolite is gaining momentum due to low cost and good performance. In this research, the natural mordenite was used as an adsorbent to remove lead ions in an aqueous solution. Methods The effects of adsorption temperature, time and initial concentration of lead on the adsorption yield were investigated. Response surface methodology based on Box-Behnken design was applied for optimization. Adsorption data were analyzed by isotherm models. The process was investigated by batch experiments; kinetic and thermodynamic studies were carried out. Adsorption yields of natural and hexadecyltrimethylammonium-bromide-modified mordenite were compared. Results The optimum conditions of maximum adsorption (nearly 84 percent) were found as follows: adsorption time of 85-90 min, adsorption temperature of 50°C, and initial lead concentration of 10 mg/L. At the same optimum conditions, modification of mordenite produced 97 percent adsorption yield. The most appropriate isotherm for the process was the Freundlich. Adsorption rate was found as 4.4. Thermodynamic calculations showed that the adsorption was a spontaneous and an exothermic process. Conclusions Quadratic model and reduced cubic model were developed to correlate the variables with the adsorption yield of mordenite. From the analysis of variance, the most influential factor was identified as initial lead concentration. At the optimum conditions modification increased the adsorption yield up to nearly 100 percent. Mordenite was found an applicable adsorbent for lead ions especially in dilute solutions and may also be applicable in more concentrated ones with lower yields. PMID:24393442

  14. Studies on adsorption of phenol from wastewater by agricultural waste.

    PubMed

    Girish, C R; Ramachandramurty, V

    2013-07-01

    In this paper, preliminary investigation of various agricultural wastes-Rice mill residue (RM), Wheat mill reside (WM), Dall mill residue (DM) and the Banana peels (BM) was carried out to study their ability to be used as adsorbents for phenol-removal from wastewater. This study reports the feasibility of employing dal mill residue waste (DM) as an adsorbent for removing phenol from wastewater. The performance of DM was compared with the commercially available activated carbon (CAC). Batch mode experiments were conducted with activated DM to study the effects of initial concentration of phenol, pH and the temperature of aqueous solution on adsorption. Equilibrium adsorption isotherms and kinetics were investigated. The experimental data were analyzed by the Langmuir, Freundlich and Temkin models and the isotherm data fitted well to the Freundlich isotherm with monolayer adsorption capacity of 6.189 mg/g. The kinetic data obtained at different concentrations were analyzed using a pseudo-first order and pseudo-second- order equation. The experimental data fitted very well with the pseudo-first-order kinetic model. The FTIR analysis revealed that carboxyl and hydroxyl functional groups were mainly responsible for the sorption of phenol. Finally, the DM was found to be a promising adsorbent for phenol adsorption as compared to activated carbon.

  15. Irreversible adsorption/desorption of PAHs in sediment/water

    SciTech Connect

    Fu, G.; Kan, A.T.; Tomson, M.B.

    1996-10-01

    Successive adsorption isotherm of phenanthrene on soil corresponds to a constant partition of phenanthrene between the bulk solution and solid phase. This shows that the hydrophobic reaction is a dominant mechanism in adsorption process. However, desorption of PAHs appears irreversibility. Cyclic and multiple adsorption and desorption experiments indicated that there is an irreversibly adsorbed intrinsic capacity in the interaction of PAHs (naphthalene and phenanthrene) and soil in aqueous solution. This irreversible fraction for PAHs (naphthalene and phenanthrene) is about 1000-5000 {mu}g/g normalized on the basis of soil organic carbon. The desorption of PAHs from soil appears biphasic when the total adsorbed capacity is greater than the intrinsic irreversibly adsorbed value. In phase, the partitioning coefficient of desorption of PAHs is similar to that of adsorption. However, the other mechanism may be responsible to control the release of PAHs in phase 2.

  16. Adsorption behaviour of dibutyl phthalate on marine sediments.

    PubMed

    Xu, Xiang-Rong; Li, Xiao-Yan

    2008-01-01

    Laboratory experiments were carried out to investigate the adsorption behaviour of dibutyl phthalate (DBP) on marine sediments collected from five different sites in Victoria Harbour, Hong Kong. DBP adsorption can be well described by the Langmuir isotherm. The maximum DBP adsorption capacity (Q(max)) of the marine sediments ranges from 53 to 79 mg g(-1), which has a positive correlation with their organic content. Around 90% of the organic can be removed from the sediments with treatment by H(2)O(2) oxidation, and the Q(max) then decreases to a range between 13 and 22 mg g(-1). The black carbon content of the sediments has a much greater DBP adsorption capacity than does the natural organic matter of the sediments. The amount of DBP adsorbed on the sediments increases as the salinity of the marine water increases.

  17. Radiation synthesis of spherical cellulose-based adsorbent for efficient adsorption and detoxification of Cr(VI)

    NASA Astrophysics Data System (ADS)

    Dong, Zhen; Zhao, Jing; Du, Jifu; Li, Cancan; Zhao, Long

    2016-09-01

    Spherical cellulose-based adsorbent (2-AMPR) with 2-aminomethyl pyridine was synthesized by radiation method. The adsorption behaviors of 2-AMPR for Cr(VI) removal were evaluated through batch and column experiments. The results presented that the adsorption kinetics well obeyed pseudo-second-order mode and the adsorption isotherm of Cr(VI) followed the Langmuir model with adsorption capacity of 209.6 mg/g at optimal pH 2.0. Dynamical experiments revealed that the 2-AMPR could selectively and simultaneously separate and detoxify trace amount of Cr(VI) even from simulated electroplating wastewater including high concentration of Cu(II), Ni(II) and Zn(II) ions. Additionally, FTIR and XPS analysis verified that part of Cr(VI) was reduced to Cr(III) during adsorption process by adsorption-reduction mechanism.

  18. Electrostatically-controlled protein adsorption onto lipid bilayer: modeling adsorbate aggregation behavior.

    PubMed

    Trusova, Valeriya M; Gorbenko, Galyna P

    2008-03-01

    Using adsorption models based on scaled particle (SPT) and double layer theories the electrostatically-controlled protein adsorption onto membrane surface has been simulated for non-associating and self-associating ligands. The binding isotherms of monomeric and oligomeric protein species have been calculated over a range of variable parameters including lipid and protein concentrations, protein and membrane charges, pH and ionic strength. Adsorption behavior of monomers appeared to be the most sensitive to the changes in the protein aggregation state. The hallmarks of the protein oligomerization are identified. The practical guides for optimal design of binding experiments focused on obtaining proofs of protein self-association are suggested.

  19. Avidity of influenza virus: model-based identification of adsorption kinetics from surface plasmon resonance experiments.

    PubMed

    Wang, Wenjing; Wolff, Michael W; Reichl, Udo; Sundmacher, Kai

    2014-01-24

    Affinity chromatography and membrane adsorption are highly promising methods for the downstream processing of cell culture-derived influenza virus. For the optimization of this separation process, it is desirable to quantify the kinetics of virus adsorption. For this reason, the adsorption kinetics of the influenza A virus (Puerto Rico/8/34 (H1N1)) on a surface with the immobilized ligand Euronymus europaeus lectin (EEL) was investigated. The adsorption kinetics was experimentally monitored in a microfluidic flow cell by surface plasmon resonance (SPR) spectroscopy. The boundary layer theory was applied to analyze the convective and diffusive mass transport of the virus particles in the SPR flow cell. A multi-site kinetic adsorption model was found to describe the experimentally recorded adsorption curves adequately. According to the proposed model, under the applied experimental conditions, the number of sites (galactose residuals) binding one single virus particle to the EEL surface is in the range of 300 to 460, which is in average about 4% of the total number of sites available on the virus surface. The avidity of individual virus particles to the EEL surface was estimated to be in the order of magnitude of 10(6)M(-1)s(-1).

  20. Pollutant dispersion in a large indoor space: Part 2 -Computational Fluid Dynamics (CFD) predictions and comparison with ascale model experiment for isothermal flow

    SciTech Connect

    Finlayson, Elizabeth U.; Gadgil, Ashok J.; Thatcher, Tracy L.; Sextro, Richard G.

    2002-10-01

    This paper reports on an investigation of the adequacy of Computational fluid dynamics (CFD), using a standard Reynolds Averaged Navier Stokes (RANS) model, for predicting dispersion of neutrally buoyant gas in a large indoor space. We used CFD to predict pollutant (dye) concentration profiles in a water filled scale model of an atrium with a continuous pollutant source. Predictions from the RANS formulation are comparable to an ensemble average of independent identical experiments. Model results were compared to pollutant concentration data in a horizontal plane from experiments in a scale model atrium. Predictions were made for steady-state (fully developed) and transient (developing) pollutant concentrations. Agreement between CFD predictions and ensemble averaged experimental measurements is quantified using the ratios of CFD-predicted and experimentally measured dye concentration at a large number of points in the measurement plane. Agreement is considered good if these ratios fall between 0.5 and 2.0 at all points in the plane. The standard k-epsilon two equation turbulence model obtains this level of agreement and predicts pollutant arrival time to the measurement plane within a few seconds. These results suggest that this modeling approach is adequate for predicting isothermal pollutant transport in a large room with simple geometry.

  1. Adsorption of Gemini surfactants onto clathrate hydrates.

    PubMed

    Salako, O; Lo, C; Couzis, A; Somasundaran, P; Lee, J W

    2013-12-15

    This work addresses the adsorption of two Gemini surfactants at the cyclopentane (CP) hydrate-water interface. The Gemini surfactants investigated here are Dowfax C6L and Dowfax 2A1 that have two anionic head groups and one hydrophobic tail group. The adsorption of these surfactants was quantified using adsorption isotherms and the adsorption isotherms were determined using liquid-liquid titrations. Even if the Gemini surfactant adsorption isotherms show multi-layer adsorption, they possess the first Langmuir layer with the second adsorption layer only evident in the 2A1 adsorption isotherm. Zeta potentials of CP hydrate particles in the surfactant solution of various concentrations of Dowfax C6L and Dowfax 2A1 were measured to further explain their adsorption behavior at the CP hydrate-water interface. Zeta potentials of alumina particles as a model particle system in different concentrations of sodium dodecyl sulfate (SDS), Dowfax C6L and Dowfax 2A1 were also measured to confirm the configuration of all the surfactants at the interface. The determination of the isotherms and zeta-potentials provides an understanding framework for the adsorption behavior of the two Gemini surfactants at the hydrate-water interface.

  2. Phosphorus recovery using pelletized adsorptive materials ...

    EPA Pesticide Factsheets

    Phosphorous (P) is one of the essential nutrients for growth and is generally the most limiting nutrient since, it cannot be fixed from the atmosphere. Methods for recovering phosphorous from water systems already exist, but advances are being made to find a more economic, efficient, effective and easy to use method that can allow for reuse of the recovered P. One area of study is in adsorption, which involves finding the best material for adsorption of phosphorous from water and for releasing it back into the environment through desorption or leaching. The goal of this research was to first optimize the capacity for a pelletized adsorptive material that was synthesized with varying amounts of a binder material from 0-20 % and then to study recovering the phosphate for reuse. The pelletized materials were studied through kinetics experiments as well as isotherm experiments to gain insight into the adsorption capacity and mechanism. Following successful adsorption, a simple leaching study was conducted to see how much phosphate would be released back into water without any added desorption aid. Desorption was then studied by changing the pH of solution. Presenting my thesis work with a poster at ACS.

  3. Removal of Pb(II) by adsorption onto Chinese walnut shell activated carbon.

    PubMed

    Yi, Zheng-ji; Yao, Jun; Kuang, Yun-fei; Chen, Hui-lun; Wang, Fei; Yuan, Zhi-min

    2015-01-01

    The excessive discharge of Pb(II) into the environment has increasingly aroused great concern. Adsorption is considered as the most effective method for heavy metal removal. Chinese walnut shell activated carbon (CWSAC) was used as an adsorbent for the removal of Pb(II) from aqueous solution. Batch experiments were conducted by varying contact time, temperature, pH, adsorbent dose and initial Pb(II) concentration. Adsorption equilibrium was established within 150 min. Although temperature effect was insignificant, the Pb(II) adsorption was strongly pH dependent and the maximum removal was observed at pH 5.5. The Pb(II) removal efficiency increased with increasing CWSAC dosage up to 2.0 g/L and reached a maximum of 94.12%. Langmuir and Freundlich adsorption isotherms were employed to fit the adsorption data. The results suggested that the equilibrium data could be well described by the Langmuir isotherm model, with a maximum adsorption capacity of 81.96 mg/g. Adsorption kinetics data were fitted by pseudo-first- and pseudo-second-order models. The result indicated that the pseudo-first-order model best describes the adsorption kinetic data. In summary, CWSAC could be a promising material for the removal of Pb(II) from wastewater.

  4. Adsorption of cadmium from aqueous solution onto untreated coffee grounds: equilibrium, kinetics and thermodynamics.

    PubMed

    Azouaou, N; Sadaoui, Z; Djaafri, A; Mokaddem, H

    2010-12-15

    Adsorption can be used as a cost effective and efficient technique for the removal of toxic heavy metals from wastewater. Waste materials with no further treatment such as coffee grounds from cafeterias may act as adsorbents for the removal of cadmium. Batch kinetic and equilibrium experiments were conducted to study the effects of contact time, adsorbent dose, initial pH, particle size, initial concentration of cadmium and temperature. Three adsorption isotherm models namely, Langmuir, Freundlich and Dubinin-Radushkevich were used to analyse the equilibrium data. The Langmuir isotherm which provided the best correlation for Cd(2+) adsorption onto coffee grounds, shows that the adsorption was favourable and the adsorption capacity found was equal to 15.65 mg g(-1). Thermodynamic parameters were evaluated and the adsorption was exothermic. The equilibrium was achieved less than 120 min. The adsorption kinetic data was fitted with first and second order kinetic models. Finally it was concluded that the cadmium adsorption kinetic onto coffee grounds was well fitted by second order kinetic model rather than first order model. The results suggest that coffee grounds have high possibility to be used as effective and economical adsorbent for Cd(2+) removal.

  5. Arsenate adsorption mechanisms at the allophane - Water interface

    USGS Publications Warehouse

    Arai, Y.; Sparks, D.L.; Davis, J.A.

    2005-01-01

    We investigated arsenate (As(V)) reactivity and surface speciation on amorphous aluminosilicate mineral (synthetic allophane) surfaces using batch adsorption experiments, powder X-ray diffraction (XRD), and X-ray absorption spectroscopy (XAS). The adsorption isotherm experiments indicated that As(V) uptake increased with increasing [As(V)]0 from 50 to 1000 ??M (i.e., Langmuir type adsorption isotherm) and that the total As adsorption slightly decreased with increasing NaCl concentrations from 0.01 to 0.1 M. Arsenate adsorption was initially (0-10 h) rapid followed by a slow continuum uptake, and the adsorption processes reached the steady state after 720 h. X-ray absorption spectroscopic analyses suggest that As(V) predominantly forms bidentate binuclear surface species on aluminum octahedral structures, and these species are stable up to 11 months. Solubility calculations and powder XRD analyses indicate no evidence of crystalline AI-As(V) precipitates in the experimental systems. Overall, macroscopic and spectroscopic evidence suggest that the As(V) adsorption mechanisms at the allophane-water interface are attributable to ligand exchange reactions between As(V) and surface-coordinated water molecules and hydroxyl and silicate ions. The research findings imply that dissolved tetrahedral oxyanions (e.g., H2PO42- and H2AsO42-) are readily retained on amorphous aluminosilicate minerals in aquifer and soils at near neutral pH. The innersphere adsorption mechanisms might be important in controlling dissolved arsenate and phosphate in amorphous aluminosilicate-rich low-temperature geochemical environments. ?? 2005 American Chemical Society.

  6. [Adsorption of Congo red from aqueous solution on hydroxyapatite].

    PubMed

    Zhan, Yan-Hui; Lin, Jian-Wei

    2013-08-01

    The adsorption of Congo red (CR) from aqueous solution on hydroxyapatite was investigated using batch experiments. The hydroxyapatite was effective for CR removal from aqueous solution. The adsorption kinetics of CR on hydroxyapatite well followed a pseudo-second-order model. The equilibrium adsorption data of CR on hydroxyapatite could be described by the Langmuir, Freundlich and Dubinin-Radushkevich (D-R) isotherm models. Thermodynamic parameters such as Gibbs free energy change, enthalpy change and entropy change were calculated and showed that the adsorption of CR on hydroxyapatite was spontaneous and exothermic in nature. The CR adsorption capacity for hydroxyapatite decreased significantly with increasing pH from 8 to 10. Thermal regeneration showed that hydroxyapatite could be used for six desorption-adsorption cycles with high removal efficiency for CR in each cycle. The mechanisms for CR adsorption on hydroxyapatite with pH value below the pH at point of zero charge (pH(PZC)) include electrostatic attraction, hydrogen bonding and Lewis acid-base interaction. The mechanisms for CR adsorption on hydroxyapatite with pH value above its pH(PZC) include hydrogen bonding and Lewis acid-base interaction. Results of this work indicate that hydroxyapatite is a promising adsorbent for CR removal from aqueous solution.

  7. Adsorption behavior of some radionuclides on the Chinese weathered coal.

    PubMed

    Wu, Jianfeng; Xu, Qichu; Bai, Tao

    2007-08-01

    The equilibrium and kinetic properties of Am(III), Eu(III) and Cs(I) ions adsorption by three weathered coals (WCs) from China, have been investigated in batch stirred-tank experiments. The effects of contact time, solution acidity and initial sorbate concentration on the adsorption of Am(III), Eu(III) and Cs(I) by Yuxian(YX) Tongchuan (TC) and Pingxiang (PX) WC were evaluated. The radionuclide ions are able to form complex compounds with carboxylic and phenolic groups of WCs and they are also bounded with phenolic groups even at high acidity reaction solution (>0.1 mol/L). Mechanisms including ion exchange, complexation and adsorption to the coal surface are possible in the sorption process. The acidity of the solution played an important role in the adsorption. Even acidity as high as 0.1 mol/L, 60% of Am(III) or Eu(III), 40% of Cs(I) were found to be sorbed on the YX WC, which had the best adsorption capacity for Am(III) and Eu(III). Our batch adsorption studies showed the equilibrium adsorption data fit the linear Langmuir and Freundlich adsorption isotherm. The maximum equilibrium uptake of Eu(III) were 0.412, 3.701, 5.446 mmol/g for JXWC, TCWC and YXWC, respectively.

  8. Adsorption of soluble oil from water to graphene.

    PubMed

    Wang, Na; Zhang, Yuchang; Zhu, Fuzhen; Li, Jingyi; Liu, Shuaishuai; Na, Ping

    2014-05-01

    The toxicity of soluble oil to the aquatic environment has started to attract wide attention in recent years. In the present work, we prepare graphene according to oxidation and thermal reduction methods for the removal of soluble oil from the solution. Characterization of the as-prepared graphene are performed by scanning electron microscopy, transmission electron microscopy, X-ray diffraction, Raman spectra, Brunauer-Emmett-Teller, X-ray photoelectron spectroscopy, and contact angle analysis. The adsorption behavior of soluble oil on graphene is examined, and the obtained adsorption data are modeled using conventional theoretical models. Adsorption experiments reveal that the adsorption rate of soluble oil on graphene is notably fast, especially for the soluble diesel oil, which could reach equilibrium within 30 min, and the kinetics of adsorption is perfectly consistent with a pseudo-second-order model. Furthermore, it is determined that the adsorption isotherm of soluble diesel oil with graphene fit the Freundlich model best, and graphene has a very strong adsorption capacity for soluble diesel oil in the solution. These results demonstrate that graphene is the material that provided both good adsorptive capacity and good kinetics, implying that it could be used as a promising sorbent for soluble oil removal from wastewater.

  9. Batch studies of adsorption of copper and lead on activated carbon from Eucalyptus camaldulensis dehn. bark.

    PubMed

    Patnukao, Phussadee; Kongsuwan, Apipreeya; Pavasant, Prasert

    2008-01-01

    Powdered activated carbon (PAC) prepared from Eucalyptus camaldulensis Dehn. bark was tested for its adsorption capacity for Cu(II) and Pb(II). The experiment was conducted to investigate the effects of pH, contact time, initial metal concentration, and temperature. The best adsorption of both Cu(II) and Pb(II) occurred at pH 5, where the adsorption reached equilibrium within 45 min for the whole range of initial heavy metal concentrations (0.1-10 mmol/L). The adsorption kinetics was found to follow the pseudo-second order model where equilibrium adsorption capacities and adsorption rate constants increased with initial heavy metal concentrations. The adsorption isotherm followed Langmuir better than Freundlich models within the temperature range (25-60 degrees C). The maximum adsorption capacities (qm) occurred at 60 degrees C, where qm for Cu(II) and Pb(II) were 0.85 and 0.89 mmol/g, respectively. The enthalpies of Cu(II) and Pb(II) adsorption were 43.26 and 58.77 kJ/mol, respectively. The positive enthalpy of adsorption indicated an endothermic nature of the adsorption.

  10. Measurement and modelling of adsorption equilibrium, adsorption kinetics and breakthrough curve of toluene at very low concentrations on to activated carbon.

    PubMed

    Réguer, Anne; Sochard, Sabine; Hort, Cécile; Platel, Vincent

    2011-01-01

    Indoor air pollution, characterized by many pollutants at very low concentrations, is nowadays known as a worrying problem for human health. Among physical treatments, adsorption is a widely used process, since porous materials offer high capacity for volatile organic chemicals. However, there are few studies in the literature that deal with adsorption as an indoor air pollution treatment. The aim of this study was to investigate the adsorption of toluene on to activated carbon at characteristic indoor air concentrations. Firstly, global kinetic parameters were determined by fitting Thomas's model to experimental data obtained with batch experiments. Then, these kinetic parameters led to the determination of Henry's coefficient, which was checked with experimental data of the adsorption isotherm. Secondly, we simulated a breakthrough curve made at an inlet concentration 10 times higher than the indoor air level. Even if the kinetic parameters in this experiment are different from those in batch experiments, it can be emphasized that the Henry coefficient stays the same.

  11. Unified water isotherms for clayey porous materials

    NASA Astrophysics Data System (ADS)

    Revil, A.; Lu, N.

    2013-09-01

    We provide a unified model for the soil-water retention function, including the effect of bound and capillary waters for all types of soils, including clayey media. The model combines a CEC-normalized isotherm describing the sorption of the bound water (and the filling of the trapped porosity) and the van Genuchten model to describe the capillary water sorption retention but ignore capillary condensation. For the CEC-normalized isotherm, we tested both the BET and Freundlich isotherms, and we found that the Freundlich is more suitable than the BET isotherm in fitting the data. It is also easier to combine the Freundlich isotherm with the van Genuchten model. The new model accounts for (1) the different types of clay minerals, (2) the different types of ions sorbed in the Stern layer and on the basal planes of 2:1 clays, and (3) the pore size distribution. The model is validated with different data sets, including mixtures of kaolinite and bentonite. The model parameters include two exponents (the pore size exponent of the van Genuchten model and the exponent of the Freundlich isotherm), the capillary entry pressure, and two critical water contents. The first critical water content is the water content at saturation (porosity), and the second is the maximum water content associated with adsorption forces, including the trapped nonbound water.

  12. Adsorption characteristics and preparative separation of chaetominine from Aspergillus fumigatus mycelia by macroporous resin.

    PubMed

    Liu, Changqing; Jiao, Ruihua; Yao, Lingyun; Zhang, Yupeng; Lu, Yanhua; Tan, Renxiang

    2016-03-15

    Chaetominine (CHA) is a quinazolinone alkaloid with strong anti-cancer activity produced by Aspergillus fumigatus CY018. For recovering CHA from A. fumigates efficiently, adsorption and desorption capacities of eight macroporous resins were tested in this work. Based on batch experiments, XAD-16 resin was revealed the best adsorption and desorption performance among all the tested resins. Then, adsorption kinetics and adsorption isotherms were constructed on XAD-16 resin, and the experimental data were fitted well to the pseudo first-order kinetics and Freundlick isotherm model. In the dynamic adsorption and desorption, the purity of CHA increased from 0.0314% (w/w) in the crude extract to 57.86% in the final product with recovery yield of 70.56% by a one-step treatment. Moreover, the experiments were also performed in a lab scale-up scale, in which the purity and recovery of CHA were 56.12% (w/w) and 68.02%, respectively. In addition, XAD-16 resin could be recycled 3 times for CHA separation after regeneration without adverse effects on adsorption/desorption performance. These results suggested that XAD-16 resin adsorption could act as a useful and economic method for recovering CHA from A. fumigatus.

  13. Adsorptive characterization of the ZIF-68 metal-organic framework: a complex structure with amphiphilic properties.

    PubMed

    Van der Perre, Stijn; Van Assche, Tom; Bozbiyik, Belgin; Lannoeye, Jeroen; De Vos, Dirk E; Baron, Gino V; Denayer, Joeri F M

    2014-07-22

    In this experimental study, the adsorption behavior of the ZIF-68 heterolinked zeolitic imidazolate framework has been explored. Vapor phase adsorption isotherms of linear C1-C6 alcohols, C6 alkane isomers, aromatics (benzene, toluene, xylene isomers, 1,3,5-trimethylbenzene, and 1,3,5-triisopropylbenzene), and polar adsorbates (water, acetonitrile, and acetone) are reported and discussed. The complex pore structure of ZIF-68, with two one-dimensional channels, each with a different polarity, displays an overall hydrophobic character. Its two-pore system results in S-shaped isotherms for small polar adsorbates (small alcohols, acetone, and acetonitrile), while longer alcohols and nonpolar molecules, such as aromatics and C6 alkane isomers, lead to type I adsorption isotherms. Bulky molecules, with a kinetic diameter significantly larger than the pore windows, are adsorbed in large amounts, which gave reason to think that this ZIF-68 material has a certain degree of framework flexibility to enlarge the free aperture of the channels. Besides, diffusion coefficients from vapor phase uptake and infrared experiments point to a different adsorption mechanism for polar and nonpolar adsorbates. Liquid phase adsorption experiments demonstrated the separation of alcohol mixtures (ethanol/1-butanol) at low concentration from water, with a clear preference for 1-butanol.

  14. Models of pure CO2 and pure CH4 adsorption on the late paleozoic coals from the Kailuan Coalfield, Hebei, China

    USGS Publications Warehouse

    Dai, S.; Zhang, B.; Peng, S.; Zhang, X.; Chou, C.

    2009-01-01

    Isothermal adsorption experiments of pure CO2 and CH4 on different coals in rank (the No. 11 Coal from the Linnancang Mine and the No. 9 Coal from the Majiagou Mine) from the Kailuan Coalfield of Hebei Province, China, have been studied. Four different models (Langmuir, BET, D-R, and D-A) were used to fit the experimental data of CO2 and CH4 adsorption and their fitting degree were investigated. The results showed that the adsorption capacity of the Majiagou coal(Ro, ran = 1. 21%) is higher than that of the Linnancang coal (Ro, ran = 0. 58%). The adsorption capacity of CO2 is higher than that of CH4 on the same coal under the same pressure. The adsorption isotherms of pure CO 2 and pure CH4 on the Majiagou coal can be classified as Type I and their fitting errors of curves are very weak; thus the experimental data can be presented using the Langmuir isotherm. However, the adsorption of Linnancang coal is more complicated, and can be presented using D-A model because of its minimum error. Monolayer adsorption occurs during the adsorption of pure CO2 and pure CH4 on the No. 11 Coal and that of pure CH4 on the No. 9 Coal.

  15. Impact of biochar produced from post-harvest residue on the adsorption behavior of diesel oil on loess soil.

    PubMed

    Jiang, Yu Feng; Sun, Hang; Yves, Uwamungu J; Li, Hong; Hu, Xue Fei

    2016-02-01

    The primary objective of this study was to investigate the effect of biochar, produced from wheat residue at different temperatures, on the adsorption of diesel oil by loess soil. Kinetic and equilibrium data were processed to understand the adsorption mechanism of diesel by biochar-affected loess soil; dynamic and thermodynamic adsorption experiments were conducted to characterize this adsorption. The surface features and chemical structure of biochar, modified at varying pyrolytic temperatures, were investigated using surface scanning electron microscopy and Fourier transform infrared analysis. The kinetic data showed that the adsorption of diesel oil onto loess soil could be described by a pseudo-second-order kinetic model, with the rate-controlling step being intraparticle diffusion. However, in the presence of biochar, boundary layer control and intraparticle diffusion were both involved in the adsorption. Besides, the adsorption equilibrium data were well described by the Freundlich isothermal model. The saturated adsorption capacity weakened as temperature increased, suggesting a spontaneous exothermic process. Thermodynamic parameter analysis showed that adsorption was mainly a physical process and was enhanced by chemical adsorption. The adsorption capacity of loess soil for diesel oil was weakened with increasing pH. The biochar produced by pyrolytic wheat residue increased the adsorption behavior of petroleum pollutants in loess soil.

  16. A comparative adsorption study: 17β-estradiol onto aerobic granular sludge and activated sludge.

    PubMed

    Zheng, Xiao-ying; He, Yu-jie; Chen, Wei; Wang, Ming-yang; Cao, Su-lan; Ni, Ming; Chen, Yu

    2016-01-01

    Adsorption plays a significant role in removing hydrophobic 17β-estradiol (E2) from wastewater. Batch experiments were conducted to compare the adsorption of E2 onto activated aerobic granular sludge (AGS) and activated sludge (AS), and features evaluated included the adsorption kinetics, thermodynamics, and influence of other environmental factors. By using a non-chemical wet-heat technique, both AGS and AS were treated to inactivated status. Then, after loading E2, the adsorption equilibrium capacity of the AGS was found to be greater than that of the AS at the same initial concentration of E2. Moreover, both the adsorption processes corresponded to a pseudo-second-order kinetic model; the adsorption rate constant of AGS was found to be higher and the half-adsorption time was shorter than that of AS. Next, evaluations of adsorption isotherms and thermodynamics indicated that the adsorption process was mainly a physical process. Lower temperatures facilitated a higher equilibrium adsorption capacity. However, the adsorption binding sites of AGS were distributed more uniformly at higher temperature, in contrast to the distribution found for AS. Finally, acidic conditions and an appropriate ionic strength (0.4 mol/L) were found to be particularly conducive to the adsorption process. Overall, the results showed that AGS has the potential to adsorb E2 with significant efficiency, thereby offering a new and more efficient means of treating E2 and trace oestrogens in wastewater.

  17. Adsorption of precious metals in water by dendrimer modified magnetic nanoparticles.

    PubMed

    Yen, Chia-Hsin; Lien, Hsing-Lung; Chung, Jung-Shing; Yeh, Hund-Der

    2017-01-15

    Magnetic nanoparticles modified by third-generation dendrimers (MNP-G3) and MNP-G3 further modified by ethylenediaminetetraacetic acid (EDTA) (MNP-G3-EDTA) were conducted to investigate their ability for recovery of precious metals (Pd(IV), Au(III), Pd(II) and Ag(I)) in water. Experiments were carried out using batch reactors for the studies of adsorption kinetics, adsorption isotherms, competitive adsorption and regeneration. The pseudo second-order model is the best-fit model among others suggesting that the adsorption of precious metals by MNP-G3 in water is a chemisorption process. Three adsorption isotherms namely Langmuir, Freundlich and Dubinin-Radushkevich isotherm were examined and the results showed the similarities and consistency of both linear and nonlinear analyses. Pd(IV) and Au(III) with higher valence exhibited relatively better adsorption efficiency than Pd(II) and Ag(I) with lower valence suggesting that the adsorption of precious metals by MNP-G3 is a function of valence. In the presence of the competing ion Zn(II), the adsorption efficiency of MNP-G3 for all four precious metals was declined significantly. The use of MNP-G3-EDTA revealed an increase in the adsorption efficiency for all four precious metals. However, the low selectivity of MNP-G3 towards precious metals was not enhanced by the modification of EDTA onto the MNP-G3. The regeneration of metal-laden MNP-G3 can be readily performed by using 1.0% HCl solution as a desorbent solution.

  18. Physico-chemical processes for landfill leachate treatment: Experiments and mathematical models

    SciTech Connect

    Xing, W.; Ngo, H.H.; Kim, S.H.; Guo, W.S.; Hagare, P.

    2008-07-01

    In this study, the adsorption of synthetic landfill leachate onto four kinds of activated carbon has been investigated. From the equilibrium and kinetics experiments, it was observed that coal based PAC presented the highest organic pollutants removal efficiency (54%), followed by coal based GAC (50%), wood based GAC (33%) and wood based PAC (14%). The adsorption equilibrium of PAC and GAC was successfully predicted by Henry-Freundlich adsorption model whilst LDFA + Dual isotherm Kinetics model could describe well the batch adsorption kinetics. The flocculation and flocculation-adsorption experiments were also conducted. The results indicated that flocculation did not perform well on organics removal because of the dominance of low molecular weight organic compounds in synthetic landfill leachate. Consequently, flocculation as pretreatment to adsorption and a combination of flocculation-adsorption could not improve much the organic removal efficiency for the single adsorption process.

  19. A Prebiotic Chemistry Experiment on the Adsorption of Nucleic Acids Bases onto a Natural Zeolite

    NASA Astrophysics Data System (ADS)

    Anizelli, Pedro R.; Baú, João Paulo T.; Gomes, Frederico P.; da Costa, Antonio Carlos S.; Carneiro, Cristine E. A.; Zaia, Cássia Thaïs B. V.; Zaia, Dimas A. M.

    2015-09-01

    There are currently few mechanisms that can explain how nucleic acid bases were synthesized, concentrated from dilute solutions, and/or protected against degradation by UV radiation or hydrolysis on the prebiotic Earth. A natural zeolite exhibited the potential to adsorb adenine, cytosine, thymine, and uracil over a range of pH, with greater adsorption of adenine and cytosine at acidic pH. Adsorption of all nucleic acid bases was decreased in artificial seawater compared to water, likely due to cation complexation. Furthermore, adsorption of adenine appeared to protect natural zeolite from thermal degradation. The C=O groups from thymine, cytosine and uracil appeared to assist the dissolution of the mineral while the NH2 group from adenine had no effect. As shown by FT-IR spectroscopy, adenine interacted with a natural zeolite through the NH2 group, and cytosine through the C=O group. A pseudo-second-order model best described the kinetics of adenine adsorption, which occurred faster in artificial seawaters.

  20. A Prebiotic Chemistry Experiment on the Adsorption of Nucleic Acids Bases onto a Natural Zeolite.

    PubMed

    Anizelli, Pedro R; Baú, João Paulo T; Gomes, Frederico P; da Costa, Antonio Carlos S; Carneiro, Cristine E A; Zaia, Cássia Thaïs B V; Zaia, Dimas A M

    2015-09-01

    There are currently few mechanisms that can explain how nucleic acid bases were synthesized, concentrated from dilute solutions, and/or protected against degradation by UV radiation or hydrolysis on the prebiotic Earth. A natural zeolite exhibited the potential to adsorb adenine, cytosine, thymine, and uracil over a range of pH, with greater adsorption of adenine and cytosine at acidic pH. Adsorption of all nucleic acid bases was decreased in artificial seawater compared to water, likely due to cation complexation. Furthermore, adsorption of adenine appeared to protect natural zeolite from thermal degradation. The C=O groups from thymine, cytosine and uracil appeared to assist the dissolution of the mineral while the NH2 group from adenine had no effect. As shown by FT-IR spectroscopy, adenine interacted with a natural zeolite through the NH2 group, and cytosine through the C=O group. A pseudo-second-order model best described the kinetics of adenine adsorption, which occurred faster in artificial seawaters.

  1. Adsorption and desorption of phosphate on limestone in experiments simulating seawater intrusion

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The absorption and desorption of phosphorus on a large block of limestone was investigated using deionized water (DIW) and seawater. The limestone had a high affinity to adsorb phosphorus in DIW. Phosphate adsorption was significantly less in seawater, and more phosphorus was desorbed in the seawate...

  2. Insight into the adsorption mechanisms of vanadium(V) on a high-efficiency biosorbent (Ti-doped chitosan bead).

    PubMed

    Liu, Xin; Zhang, Lingfan

    2015-08-01

    In this present study, a new chitosan bead modified with titanium ions (TiCB) was prepared and employed for the adsorption of vanadium ions from aqueous solutions. Batch adsorption experiments were performed to research the effect of various factors, including pH, temperature, contact time and initial concentration of vanadium(V) ions. The adsorption of vanadium was followed by the pseudo second-order kinetic and the Langmuir isotherm model, with a remarkable maximum adsorption capacity of 210 mg/g. The analysis of thermodynamic parameters (ΔG°, ΔH° and ΔS°) revealed that the nature of adsorption was feasible, spontaneous (ΔG°<0) and endothermic (ΔH°>0) process. FTIR, EDS, EMI and XPS studies suggested that the mechanisms of adsorption were possibly attributed to electrostatic attraction, ligand-exchange and redox reaction between TiCB and vanadium ions.

  3. Adsorption and transport of polymaleic acid on Callovo-Oxfordian clay stone: batch and transport experiments.

    PubMed

    Durce, Delphine; Landesman, Catherine; Grambow, Bernd; Ribet, Solange; Giffaut, Eric

    2014-08-01

    Dissolved Organic Matter (DOM) can affect the mobility of radionuclides in pore water of clay-rich geological formations, such as those intended to be used for nuclear waste disposal. The present work studies the adsorption and transport properties of a polycarboxylic acid, polymaleic acid (PMA, Mw=1.9kDa), on Callovo-Oxfordian argillite samples (COx). Even though this molecule is rather different from the natural organic matter found in clay rock, the study of its retention properties on both dispersed and intact samples allows assessing to which extent organic acids may undergo sorption under natural conditions (pH7) and what could be the impact on their mobility. PMA sorption and desorption were investigated in dispersed systems. The degree of sorption was measured after 1, 8 and 21days and for a range of PMA initial concentrations from 4.5×10(-7) to 1.4×10(-3)mol.L(-1). The reversibility of the sorption process was estimated by desorption experiments performed after the sorption experiments. At the sorption steady state, the sorption was described by a two-site Langmuir model. A total sorption capacity of COx for PMA was found to be 1.01×10(-2) mol.kg(-1) distributed on two sorption sites, one weak and one strong. The desorption of PMA was incomplete, independently of the duration of the sorption phase. The amount of desorbable PMA even appeared to decrease for sorption phases from 1 to 21days. To describe the apparent desorption hysteresis, two conceptual models were applied. The two-box diffusion model accounted for intraparticle diffusion and more generally for nonequilibrium processes. The two-box first-order non-reversible model accounted for a first-order non-reversible sorption and more generally for kinetically-controlled irreversible sorption processes. The use of the two models revealed that desorption hysteresis was not the result of nonequilibrium processes but was due to irreversible sorption. Irreversible sorption on the strong site was

  4. Adsorption and transport of polymaleic acid on Callovo-Oxfordian clay stone: Batch and transport experiments

    NASA Astrophysics Data System (ADS)

    Durce, Delphine; Landesman, Catherine; Grambow, Bernd; Ribet, Solange; Giffaut, Eric

    2014-08-01

    Dissolved Organic Matter (DOM) can affect the mobility of radionuclides in pore water of clay-rich geological formations, such as those intended to be used for nuclear waste disposal. The present work studies the adsorption and transport properties of a polycarboxylic acid, polymaleic acid (PMA, Mw = 1.9 kDa), on Callovo-Oxfordian argillite samples (COx). Even though this molecule is rather different from the natural organic matter found in clay rock, the study of its retention properties on both dispersed and intact samples allows assessing to which extent organic acids may undergo sorption under natural conditions (pH 7) and what could be the impact on their mobility. PMA sorption and desorption were investigated in dispersed systems. The degree of sorption was measured after 1, 8 and 21 days and for a range of PMA initial concentrations from 4.5 × 10- 7 to 1.4 × 10- 3 mol.L- 1. The reversibility of the sorption process was estimated by desorption experiments performed after the sorption experiments. At the sorption steady state, the sorption was described by a two-site Langmuir model. A total sorption capacity of COx for PMA was found to be 1.01×10- 2 mol.kg- 1 distributed on two sorption sites, one weak and one strong. The desorption of PMA was incomplete, independently of the duration of the sorption phase. The amount of desorbable PMA even appeared to decrease for sorption phases from 1 to 21 days. To describe the apparent desorption hysteresis, two conceptual models were applied. The two-box diffusion model accounted for intraparticle diffusion and more generally for nonequilibrium processes. The two-box first-order non-reversible model accounted for a first-order non-reversible sorption and more generally for kinetically-controlled irreversible sorption processes. The use of the two models revealed that desorption hysteresis was not the result of nonequilibrium processes but was due to irreversible sorption. Irreversible sorption on the strong site was

  5. Adsorption behaviors of fungicide-derived copper onto various size fractions of aggregates from orchard soil.

    PubMed

    Wang, Quan-Ying; Hu, Bo; Yu, Hong-Wen

    2016-12-01

    Although the gradual accumulations of Cu in orchard soils due to the application of Cu-based fungicides have been widely reported, limited information is available about the retention characteristics of fungicide-derived Cu in soil, especially in various size soil aggregates. This study described the adsorption characteristics of Cu from commonly used fungicide, Bordeaux mixture (CuSO4 + Ca(OH)2), onto various aggregate fractions (2000-1000, 1000-500, 500-250, 250-106, and <106 μm) of orchard soil. The Cu(NO3)2 was selected as a comparison. Two different types of adsorption experiments were conducted as follows: variable pH and variable Cu concentration experiments. The adsorption processes of Bordeaux mixture and Cu(NO3)2 onto the studied soil samples followed well with the Freundlich isotherm, and the adsorption isotherms were the S shaped. The adsorption amounts of Cu from different Cu compounds differed, and Bordeaux mixture can result in more Cu retention in soil than Cu(NO3)2. The adsorption ability of different size soil aggregates varied, and it was mainly governed by soil properties. The findings of this study suggested that both the chemical compositions of Cu compounds and the soil physical structure should be taken into account when performing soil Cu retention experiments with fungicide-derived Cu.

  6. Adsorptive removal of patulin from aqueous solution using thiourea modified chitosan resin.

    PubMed

    Liu, Bingjie; Peng, Xiaoning; Chen, Wei; Li, Yang; Meng, Xianghong; Wang, Dongfeng; Yu, Guangli

    2015-09-01

    In the present paper, thiourea modified chitosan resin (TMCR) was firstly prepared through converting hydroxyl groups of chitosan resin into thiol groups, using glutaraldehyde as cross-linking agent and thiourea as modification agent. TMCR was characterized by FTIR, EDXS, SEM, XRD and AFM technologies. Batch adsorption experiments were performed to study the adsorption capacity of TMCR for patulin at different pH, temperature, contact time and patulin concentration. The result showed that TMCR was effective in removal of patulin from aqueous solution. The adsorption capacity of TMCR for patulin was 1.0 mg/g at pH 4.0, 25 °C for 24 h. Adsorption process could be well described by pseudo-first order model, Freundlich isotherm model and intraparticle diffusion model. It indicated that TMCR is expected to be a new material for patulin adsorption from aqueous solutions.

  7. Surface modification of activated carbon for enhanced adsorption of perfluoroalkyl acids from aqueous solutions.

    PubMed

    Zhi, Yue; Liu, Jinxia

    2016-02-01

    The objective of the research was to examine the effect of increasing carbon surface basicity on uptake of perfluorooctane sulfonic (PFOS) and carboxylic acids (PFOA) by activated carbon. Granular activated carbons made from coal, coconut shell, wood, and phenolic-polymer-based activated carbon fibers were modified through high-temperature and ammonia gas treatments to facilitate systematical evaluation of the impact of basicity of different origins. Comparison of adsorption isotherms and adsorption distribution coefficients showed that the ammonia gas treatment was more effective than the high-temperature treatment in enhancing surface basicity. The resultant higher point of zero charges and total basicity (measured by total HCl uptake) correlated with improved adsorption affinity for PFOS and PFOA. The effectiveness of surface modification to enhance adsorption varied with carbon raw material. Wood-based carbons and activated carbon fibers showed enhancement by one to three orders of magnitudes while other materials could experience reduction in adsorption towards either PFOS or PFOA.

  8. Photocatalytic degradation of phenol and phenolic compounds Part I. Adsorption and FTIR study.

    PubMed

    Araña, J; Pulido Melián, E; Rodríguez López, V M; Peña Alonso, A; Doña Rodríguez, J M; González Díaz, O; Pérez Peña, J

    2007-07-31

    With the goal of predicting the photocatalytic behaviour of different phenolic compounds (catechol, resorcinol, phenol, m-cresol and o-cresol), their adsorption and interaction types with the TiO(2) Degussa P-25 surface were studied. Langmuir and Freundlich isotherms were applied in the adsorption studies. The obtained results indicated that catechol adsorption is much higher than those of the other phenolics and its interaction occurs preferentially through the formation of a catecholate monodentate. Resorcinol and the cresols interact by means of hydrogen bonds through the hydroxyl group, and their adsorption is much lower than that of catechol. Finally, phenol showed an intermediate behaviour, with a Langmuir adsorption constant, K(L), much lower than that of catechol, but a similar interaction. The interaction of the selected molecules with the catalyst surface was evaluated by means of FTIR experiments, which allowed us to determine the probability of OH radical attack to the aromatic ring.

  9. Removal of 8-quinolinecarboxylic acid pesticide from aqueous solution by adsorption on activated montmorillonites.

    PubMed

    Mekhloufi, M; Zehhaf, A; Benyoucef, A; Quijada, C; Morallon, E

    2013-12-01

    Sodium montmorillonite (Na-M), acidic montmorillonite (H-M), and organo-acidic montmorillonite (Org-H-M) were applied to remove the herbicide 8-quinolinecarboxylic acid (8-QCA). The montmorillonites containing adsorbed 8-QCA were investigated by transmission electron microscopy, FT-IR spectroscopy, X-ray diffraction analysis, X-ray fluorescence thermogravimetric analysis, and physical adsorption of gases. Experiments showed that the amount of adsorbed 8-QCA increased at lower pH, reaching a maximum at pH 2. The adsorption kinetics was found to follow the pseudo-second-order kinetic model. The Langmuir model provided the best correlation of experimental data for adsorption equilibria. The adsorption of 8-QCA decreased in the order Org-H-M > H-M > Na-M. Isotherms were also used to obtain the thermodynamic parameters. The negative values of ΔG indicated the spontaneous nature of the adsorption process.

  10. Adsorption of acid dye onto organobentonite.

    PubMed

    Baskaralingam, P; Pulikesi, M; Elango, D; Ramamurthi, V; Sivanesan, S

    2006-02-06

    Removal of Acid Red 151 from aqueous solution at different dye concentrations, adsorbent doses and pH has been studied. The bentonite clay has been modified using cationic surfactants, which has been confirmed using XRD and FT-IR analyses. Experimental result has shown that the acidic pH favours the adsorption. The adsorption isotherms are described by means of Langmuir and Freundlich isotherms. The adsorption capacity has been found to be 357.14 and 416.66 mg g(-1) for the cetyldimethylbenzylammonium chloride-bentonite (CDBA-bent) and cetylpyridinium chloride-bentonite (CP-bent), respectively. Kinetic studies show that the adsorption followed second-order kinetics.

  11. Kinetics and equilibrium adsorption study of lead(II) onto activated carbon prepared from coconut shell.

    PubMed

    Sekar, M; Sakthi, V; Rengaraj, S

    2004-11-15

    Removal of lead from aqueous solutions by adsorption onto coconut-shell carbon was investigated. Batch adsorption experiments were performed to find out the effective lead removal at different metal ion concentrations. Adsorption of Pb2+ ion was strongly affected by pH. The coconut-shell carbon (CSC) exhibited the highest lead adsorption capacity at pH 4.5. Isotherms for the adsorption of lead on CSC were developed and the equilibrium data fitted well to the Langmuir, Freundlich, and Tempkin isotherm models. At pH 4.5, the maximum lead adsorption capacity of CSC estimated with the Langmuir model was 26.50 mg g(-1) adsorbent. Energy of activation (Ea) and thermodynamic parameters such as DeltaG, DeltaH, and DeltaS were evaluated by applying the Arrhenius and van't Hoff equations. The thermodynamics of Pb(II) on CSC indicates the spontaneous and endothermic nature of adsorption. Quantitative desorption of Pb(II) from CSC was found to be 75% which facilitates the sorption of metal by ion exchange.

  12. Negligible effects of tryptophan on the aflatoxin adsorption of sodium bentonite.

    PubMed

    Magnoli, A P; Copia, P; Monge, M P; Magnoli, C E; Dalcero, A M; Chiacchiera, S M

    2014-01-01

    The main objective of this study was to determine if the competitive adsorption of tryptophan (Trp) and aflatoxin B₁ (AFB₁) could potentially affect the ability of a sodium bentonite (NaB) to prevent aflatoxicosis in monogastric animals. The adsorption of Trp and AFB₁ on this adsorbent is fast and could be operating on the same time-scale making competition feasible. In vitro competitive adsorption experiments under simulated gastrointestinal conditions were performed. A high affinity of the clay for Trp and NaB was observed. The effect of an excess of KCl to mimic the ionic strength of the physiological conditions were also investigated. A six-times decrease in the Trp surface excess at saturation was observed. A similar behaviour was previously found for AFB₁ adsorption. Taking into account the amount of Trp adsorbed by the clay and the usual adsorbent supplementation level in diets, a decrease in Trp bioavailability is not expected to occur. Tryptophan adsorption isotherms on NaB were 'S'-shaped and were adjusted by the Frumkin-Fowler-Guggenheim model. The reversibility of the adsorption processes was investigated in order to check a potential decrease in the ability of NaB to protect birds against chronic aflatoxicoses. Adsorption processes were completely reversible for Trp, while almost irreversible for AFB₁. In spite of the high affinity of the NaB for Trp, probably due to the reversible character of Trp adsorption, no changes in the AFB₁ adsorption isotherm were observed when an excess of the amino acid was added to the adsorption medium. As a consequence of the preferential and irreversible AFB₁ adsorption and the reversible weak binding of Trp to the NaB, no changes in the aflatoxin sorption ability of the clay are expected to occur in the gastrointestinal tract of birds.

  13. Modeling Langmuir isotherms with the Gillespie stochastic algorithm.

    PubMed

    Epstein, J; Michael, J; Mandona, C; Marques, F; Dias-Cabral, A C; Thrash, M

    2015-02-06

    The overall goal of this work is to develop a robust modeling approach that is capable of simulating single and multicomponent isotherms for biological molecules interacting with a variety of adsorbents. Provided the ratio between the forward and reverse adsorption/desorption constants is known, the Gillespie stochastic algorithm has been shown to be effective in modeling isotherms consistent with the Langmuir theory and uptake curves that fall outside this traditional approach. We have used this method to model protein adsorption on ion-exchange adsorbents, hydrophobic interactive adsorbents and ice crystals. In our latest efforts we have applied the Gillespie approach to simulate binary and ternary isotherms from the literature involving gas-solid adsorption applications. In each case the model is consistent with the experimental results presented.

  14. Hydrogen adsorption in the NaA zeolite: A comparison between numerical simulations and experiments

    NASA Astrophysics Data System (ADS)

    Darkrim, Farida; Aoufi, Asdin; Malbrunot, Pierre; Levesque, Dominique

    2000-04-01

    At room temperature and high pressures between 10 MPa and 140 MPa, hydrogen adsorption in the NaA zeolite was studied by grand canonical Monte Carlo simulation. The computed values of the average number of hydrogen molecules adsorbed in a crystal unit were compared to those measured at the same temperature and pressures between 10 MPa and 70 MPa. A quantitative agreement between the two sets of values was obtained by using, in the simulations, a model of zeolite crystal where the Al, Si, O, and Na atoms, disposed in accordance with the crystallographic structure of the NaA zeolite determined by x-ray diffraction, had effective electric charges and were sources of a van der Waals interaction. The adsorption of hydrogen molecules in the NaA zeolite resulted from the combined effects of van der Waals interactions and polarization of hydrogen molecules induced by the electric field of the effective charges.

  15. Isothermal solidification in a binary alloy melt

    NASA Technical Reports Server (NTRS)

    Laxmanan, V.

    1988-01-01

    A space shuttle experiment employing the General Purpose (Rocket) Furnace (GPF) in its isothermal mode of operation is manifested on MSL-3, circa 1989. The central aim of this experiment is to investigate the effect of reduced gravity levels on the segregation behavior in a slowly, and isothermally, cooled sample of a binary Pb-15 wt percent Sn alloy. This experiment would thus be able to simulate, in a small laboratory sample, about 20 mm dia 60 mm high and weighing about 150 grams, some aspects of the segregation phenomena occurring in large industrial ingots. Ground-based experiments conducted in the single-cavity simulator of the GPF, located at Marshall Space Flight Center (MSFC), in support of the microgravity experiment are described in detail. The results of the MSFC experiments are compared with other related experiments conducted at Case Western Reserve University (CWRU), wherein the isothermal constraints were relaxed.

  16. Synthesis of Large-Pore Stabilized MIL-53(Al) Compounds with Increased CO2 Adsorption and Decreased Water Adsorption

    DTIC Science & Technology

    2014-01-01

    isotherms showed typical Type I behaviour as per the IUPAC classification. Gas adsorption An Intelligent Gravimetric Analyzer ( IGA -1 series, Hiden...40 min was used for each point in the isotherm. Water adsorption An Intelligent Gravimetric Analyzer ( IGA -3 series, Hiden Analytical Ltd.) was used

  17. Adsorption of nicotine from aqueous solution onto hydrophobic zeolite type USY

    NASA Astrophysics Data System (ADS)

    Lazarevic, Natasa; Adnadjevic, Borivoj; Jovanovic, Jelena

    2011-07-01

    The isothermal adsorption of nicotine from an aqueous solution onto zeolite type USY was investigated. The adsorption isotherms of nicotine onto the zeolite at different temperatures ranging from 298 to 322 K were determined. It was found that the adsorption isotherms can be described by the model of Freundlich adsorption isotherm. Based on the adsorption isotherms the changes of adsorption heat, free energy and entropy with adsorption degree were determined. The determined decrease of adsorption heat with adsorption degree can be explained by the presence of the adsorption centers of different energy and concentration on interface of zeolite-nicotine solution. It was found that the probability function of density distribution of the heat of adsorption (DDF) has exponential form. It was concluded that the possibility of fitting the adsorption isotherms of nicotine onto the zeolite by Freundlich adsorption isotherm was a direct consequence of that. The determined increase in entropy with the increase in adsorption degree can be explained with the change of phase state of adsorbed nicotine.

  18. Adsorption of globular proteins on locally planar surfaces. II. Models for the effect of multiple adsorbate conformations on adsorption equilibria and kinetics.

    PubMed Central

    Minton, A P

    1999-01-01

    Equilibrium and kinetic models for nonspecific adsorption of proteins to planar surfaces are presented. These models allow for the possibility of multiple interconvertible surface conformations of adsorbed protein. Steric repulsion resulting in area exclusion by adsorbed molecules is taken into account by treating the adsorbate as a thermodynamically nonideal two-dimensional fluid. In the equilibrium model, the possibility of attractive interactions between adsorbed molecules is taken into account in a limited fashion by permitting one of the adsorbed species to self-associate. Calculated equilibrium adsorption isotherms exhibit apparent high-affinity and low-affinity binding regions, corresponding respectively to adsorption of ligand at low fractional area occupancy in an energetically favorable side-on conformation and conversion at higher fractional area occupancy of the side-on conformation to an entropically favored end-on conformation. Adsorbate self-association may lead to considerable steepening of the adsorption isotherm, compensating to a variable extent for the broadening effect of steric repulsion. Kinetic calculations suggest that in the absence of attractive interactions between adsorbate molecules, the process of adsorption may be highly "stretched" along the time axis, rendering the attainment of adsorption equilibrium in the context of conventional experiments problematic. PMID:9876132

  19. Adsorption and transformation of ammonium ion in a loose-pore geothermal reservoir: Batch and column experiments.

    PubMed

    Zhao, Li; Li, Yanli; Wang, Shidong; Wang, Xinyi; Meng, Hongqi; Luo, Shaohe

    2016-09-01

    Adsorption kinetics and transformation process of ammonium ion (NH4(+)) were investigated to advance the understanding of N cycle in a low-temperature loose-pore geothermal reservoir. Firstly, batch experiments were performed in order to determine the sorption capacity and the kinetic mechanism of NH4(+) onto a loose-pore geothermal reservoir matrix. Then column experiments were carried out at temperatures from 20°C to 60°C in order to determine the transport parameters and transformation mechanism of NH4(+) in the studied matrix. The results showed that the adsorption process of NH4(+) onto the porous media well followed the pseudo-second-order model. No obvious variation of hydrodynamic dispersion coefficient (D) and retardation factor (R) was observed at different transport distances at a Darcy's flux of 2.27cm/h, at which nitrification could be neglected. The simulated D obtained by the CDE model in CXTFIT2.1 increased with temperature while R decreased with temperature, indicating that the adsorption capacity of NH4(+) onto the matrix decreased with the increasing of temperature. When the Darcy's flux was decreased to 0.014cm/h, only a little part of NH4(+) could be transformed to nitrate, suggesting that low density of nitrifiers existed in the simulated loose-pore geothermal reservoir. Although nitrification rate increased with temperature in the range of 20°C to 60°C, it was extremely low and no accumulation of nitrite was observed under the simulated low-temperature geothermal conditions without addition of biomass and oxygen.

  20. Adsorption and transformation of ammonium ion in a loose-pore geothermal reservoir: Batch and column experiments

    NASA Astrophysics Data System (ADS)

    Zhao, Li; Li, Yanli; Wang, Shidong; Wang, Xinyi; Meng, Hongqi; Luo, Shaohe

    2016-09-01

    Adsorption kinetics and transformation process of ammonium ion (NH4+) were investigated to advance the understanding of N cycle in a low-temperature loose-pore geothermal reservoir. Firstly, batch experiments were performed in order to determine the sorption capacity and the kinetic mechanism of NH4+ onto a loose-pore geothermal reservoir matrix. Then column experiments were carried out at temperatures from 20 °C to 60 °C in order to determine the transport parameters and transformation mechanism of NH4+ in the studied matrix. The results showed that the adsorption process of NH4+ onto the porous media well followed the pseudo-second-order model. No obvious variation of hydrodynamic dispersion coefficient (D) and retardation factor (R) was observed at different transport distances at a Darcy's flux of 2.27 cm/h, at which nitrification could be neglected. The simulated D obtained by the CDE model in CXTFIT2.1 increased with temperature while R decreased with temperature, indicating that the adsorption capacity of NH4+ onto the matrix decreased with the increasing of temperature. When the Darcy's flux was decreased to 0.014 cm/h, only a little part of NH4+ could be transformed to nitrate, suggesting that low density of nitrifiers existed in the simulated loose-pore geothermal reservoir. Although nitrification rate increased with temperature in the range of 20 °C to 60 °C, it was extremely low and no accumulation of nitrite was observed under the simulated low-temperature geothermal conditions without addition of biomass and oxygen.

  1. Thermodynamic features of dioxins' adsorption.

    PubMed

    Prisciandaro, Marina; Piemonte, Vincenzo; di Celso, Giuseppe Mazziotti; Ronconi, Silvia; Capocelli, Mauro

    2017-02-15

    In this paper, the six more poisonous species among all congeners of dioxin group are taken into account, and the P-T diagram for each of them is developed. Starting from the knowledge of vapour tensions and thermodynamic parameters, the theoretical adsorption isotherms are calculated according to the Langmuir's model. In particular, the Langmuir isotherm parameters (K and wmax) have been validated through the estimation of the adsorption heat (ΔHads), which varies in the range 20-24kJ/mol, in agreement with literature values. This result will allow to put the thermodynamical basis for a rational design of different process units devoted to dioxins removal.

  2. Gibbs adsorption and the compressibility equation

    SciTech Connect

    Aranovich, G.L.; Donohue, M.D.

    1995-08-08

    A new approach for deriving the equation of state is developed. It is shown that the integral in the compressibility equation is identical to the isotherm for Gibbs adsorption in radial coordinates. The Henry, Langmuir, and Frumkin adsorption isotherms are converted into equations of state. It is shown that using Henry`s law gives an expression for the second virial coefficient that is identical to the result from statistical mechanics. Using the Langmuir isotherm leads to a new analytic expression for the hard-sphere equation of state which can be explicit in either pressure or density. The Frumkin isotherm results in a new equation of state for the square-well potential fluid. Conversely, new adsorption isotherms can be derived from equations of state using the compressibility equation. It is shown that the van der Waals equation gives an adsorption isotherm equation that describes both polymolecular adsorption and the unusual adsorption behavior observed for supercritical fluids. {copyright} {ital 1995} {ital American} {ital Institute} {ital of} {ital Physics}.

  3. Adsorption of Ar on individual carbon nanotubes, graphene, and graphite

    NASA Astrophysics Data System (ADS)

    Dzyubenko, Boris; Kahn, Joshua; Vilches, Oscar; Cobden, David

    2015-03-01

    We compare and contrast results of adsorption measurements of Ar on single-walled carbon nanotubes, graphene, and graphite. Adsorption isotherms on individual suspended nanotubes were obtained using both the mechanical resonance frequency shift (sensitive to mass adsorption) and the electrical conductance. Isotherms on graphene mounted on hexagonal boron nitride were obtained using only the conductance. New volumetric adsorption isotherms on bulk exfoliated graphite were also obtained, paying special attention to the very low coverage region (less than 2% of a monolayer). This allowed us to compare the degree of heterogeneity on the three substrate types, the binding energies, and the van der Waals 2D parameters. Research supported by NSF DMR 1206208.

  4. Modeling experimental stable isotope results from CO2 adsorption and diffusion experiments

    NASA Astrophysics Data System (ADS)

    Larson, T. E.

    2012-12-01

    Transport of carbon dioxide through porous media can be affected by diffusion, advection and adsorption processes. Developing new tools to understand which of these processes dominates migration of CO2 or other gases in the subsurface is important to a wide range of applications including CO2 storage. Whereas advection rates are not affected by isotope substitution in CO2, adsorption and diffusion constants are. For example, differences in the binary diffusion constant calculated between C12O2-He and C13O2-He results in a carbon isotope fractionation whereby the front of the chromatographic peak is enriched in carbon-12 and the tail of the peak is enriched in carbon-13. Interestingly, adsorption is shown to have an opposite, apparent inverse affect whereby the lighter isotopologues of CO2 are preferentially retained by the chromatographic column and the heavier isotopologues are eluted first. This apparent inverse chromatographic effect has been ascribed to Van der Waals dispersion forces. Smaller molar volumes of the heavier isotopologues resulting from increased bond strength (shorter bond length) effectively decreases Van der Waals forces in heavier isotopologues compared to lighter isotopologues. Here we discuss the possible application of stable isotope values measured across chromatographic peaks to differentiate diffusion-dominated from adsorption-dominated transport processes for CO2. Separate 1-dimensional flow-through columns were packed with quartz and illite, and one remained empty. Dry helium was used as a carrier gas. Constant flow rate, temperature and column pressure were maintained. After background CO2 concentrations were minimized and constant, a sustained pulse of CO2 was injected at the head of the column and the effluent was sampled at 4 minute intervals for CO2 concentration, and carbon and oxygen isotope ratios. The quartz-sand packed and empty columns resulted in similar trends in concentration and isotope ratios whereby CO2 concentrations

  5. Adsorptive removal of anionic dyes by modified nanoporous silica SBA-3

    NASA Astrophysics Data System (ADS)

    Anbia, Mansoor; Hariri, Saba Asl; Ashrafizadeh, S. N.

    2010-03-01

    Batch sorption experiments were carried out to remove dyes, methyl orange (MO), orange G (OG) and brilliant red X-3B (X-3B), from their aqueous solutions using a mesoporous silica SBA-3 as an adsorbent. The effect of surfactant template in SBA-3 on the removal of OG, MO and X-3B was investigated. Experiments were carried out to investigate the influence of contact time, initial concentration, pH, and adsorbent dosage on the adsorption performance. The adsorption results of anionic dyes on the uncalcined SBA-3 (noted as SBA-3) were compared with those of the calcined SBA-3 (noted as C-SBA-3). The uncalcined SBA-3 adsorbent has a large adsorption capacity and a strong affinity for the anionic dyes. Langmuir, Freundlich and Temkin isotherms were employed to model the experimental results, from which the Freundlich isotherm exhibited the most appropriate to predict the same. Freundlich isotherm exhibited the most appropriate to predict the experimental results. The kinetic data were also analyzed through pseudo-first-order and pseudo-second-order models. The pseudo-second-order kinetic model well depicted the kinetics of dyes adsorption on mesoporous SBA-3.

  6. Extended random sequential adsorption model of irreversible deposition processes: From simulations to experiments

    PubMed Central

    Lavalle, P.; Schaaf, P.; Ostafin, M.; Voegel, J.-C.; Senger, B.

    1999-01-01

    An experimental study of the irreversible deposition of colloidal particles of various radii R on a solid surface is presented over a wide range of the Péclet number, Pe, or reduced radius R* (Pe = R*4). The experimental data are analyzed by means of a new generalized random sequential adsorption model that takes explicitly the diffusion of the particles during the deposition into account. It allows description of the continuous transition from a random sequential adsorption-like to a ballistic-like deposition behavior. It depends on three parameters: ds, related to the diffusion of the particles before adhesion; ns, related to the number of allowed adhesion trials of a particle; and Re, representing the effective particle radius. The model allows accounting for all of the experimental observations relative to the radial distribution functions and the number density fluctuations over the whole coverage range and all investigated values of R*. In addition, it is found that ds/R is proportional to R*−2 as expected for a diffusional process. Moreover, the parameters ds and ns appear to be connected through the empirical relation (ds/R)ns2/3 = C, where C is found to be of the order of 50. This unique statistical model allows an accurate description of the irreversible deposition process, whatever the influence of gravity with respect to diffusion. PMID:10500136

  7. Studies on adsorption characteristics and mechanism of adsorption of chlorhexidine mainly by carbon black.

    PubMed

    Akaho, E; Fukumori, Y

    2001-09-01

    The extent of adsorption of chlorhexidine to carbon black and sanitary cotton was determined by measuring the amounts of chlorhexidine adsorbed to carbon black or sanitary cotton from the chlorhexidine solution containing specific amount of carbon black or sanitary cotton. As another comparative antiseptic example of adsorption phenomena, adsorption of acrinol to sanitary cotton was also studied. The specific surface area of carbon black was measured by the BET method of adsorption isotherm. The pattern of adsorption of chlorhexidine to carbon black was temperature-dependent Langmuir isotherms, and the amounts adsorbed increased as the temperature was raised. Since chlorhexidine, whose pKa's are 2.2 and 10.3, is considered to exist in aqueous solution as the di-cation, an ion-ion interaction should be formed between protonated biguanide and anionic portions of carbon black or sanitary cotton. The chlorophenyl and hexane moieties interact with hydrophobic portions of carbon black or sanitary cotton. The perturbation experiment conducted on this interaction system showed that the nature of interaction was irreversible. The enthalpy change calculated from Langmuir constants was small, indicating the existence of ion-ion interaction. The entropy values, 27.4 to 28.2 e.u. obtained in this system, suggested that the hydration shells of the ions were rather tightly bound. The area occupied by a chlorhexidine molecule, 548 (A)(2), was twice greater than the projection area, 276 (A)(2), suggesting that chlorhexidine was adsorbed in such a way that each molecule is sufficiently well spaced.

  8. Kinetics and Thermodynamics of Reserpine Adsorption onto Strong Acidic Cationic Exchange Fiber.

    PubMed

    Guo, Zhanjing; Liu, Xiongmin; Huang, Hongmiao

    2015-01-01

    The kinetics and thermodynamics of the adsorption process of reserpine adsorbed onto the strong acidic cationic exchange fiber (SACEF) were studied by batch adsorption experiments. The adsorption capacity strongly depended on pH values, and the optimum reserpine adsorption onto the SACEF occurred at pH = 5 of reserpine solution. With the increase of temperature and initial concentration, the adsorption capacity increased. The equilibrium was attained within 20 mins. The adsorption process could be better described by the pseudo-second-order model and the Freundlich isotherm model. The calculated activation energy Ea was 4.35 kJ/mol. And the thermodynamic parameters were: 4.97<ΔH<7.44 kJ/mol, -15.29<ΔG<-11.87 kJ/mol and 41.97<ΔS<47.35 J/mol·K. The thermodynamic parameters demonstrated that the adsorption was an endothermic, spontaneous and feasible process of physisorption within the temperature range between 283 K and 323 K and the initial concentration range between 100 mg/L and 300 mg/L. All the results showed that the SACEF had a good adsorption performance for the adsorption of reserpine from alcoholic solution.

  9. Adsorption studies of azotetrazolate and 3,6-dihydrazinotetrazine on peat.

    PubMed

    Borkowski, Andrzej; Rydelek, Paweł; Szala, Mateusz

    2013-01-01

    The objective of our studies was the evaluation of the adsorption process of two high-nitrogen compounds-dihydrazinotetrazine (DHTz) and azotetrazolate ion (AZ)-on a chosen peat. The experiments were performed using a static method at three different temperatures (283, 298, and 333 K). The adsorption process of DHTz and AZ on peat was characterized by isotherms according to the Freundlich and Langmuir models. The obtained correlations between adsorption and equilibrium concentration were in good accordance with the Freundlich and Langmuir models, as confirmed by high values of the correlation coefficients (0.97-0.99). Adsorption of AZ on peat was less efficient than that of DHTz, and this inference was experimentally proven. The maximum surface coverages of peat particles with adsorbate according to the Langmuir model were calculated as 0.02 and 0.17 mol kg(-1) (at 298 K) for AZ and DHTz, respectively. The determined adsorption equilibrium constants confirmed greater adsorption of DHTz on the investigated peat. It can be concluded that adsorption of AZ occurred to a much lesser extent compared to that of DHTz, pointing to a potentially greater threat of migration of soluble azotetrazolates in soil. Standard enthalpies of adsorption estimated for AZ and DHTz were -11.1 and -23.7 kJ mol(-1), respectively. Based on these adsorption enthalpy values, it can be stated that both investigated compounds are adsorbed on peat by a physisorption process.

  10. Adsorption of a cationic surfactant by a magsorbent based on magnetic alginate beads.

    PubMed

    Obeid, Layaly; El Kolli, Nadia; Dali, Noëlle; Talbot, Delphine; Abramson, Sébastien; Welschbillig, Mathias; Cabuil, Valérie; Bée, Agnès

    2014-10-15

    Adsorption of cetylpyridinium chloride (CPC), a cationic surfactant, by magnetic alginate beads (MagAlgbeads) was investigated. The magnetic adsorbent (called magsorbent) was prepared by encapsulation of magnetic functionalized nanoparticles in an alginate gel. The influence on CPC adsorption of several parameters such as contact time, pH and initial surfactant concentration was studied. The equilibrium isotherm shows that adsorption occurs through both electrostatic interactions with charge neutralization of the carboxylate groups of the beads and hydrophobic interactions inducing the formation of surfactant aggregates in the beads. The dosage of calcium ions released in the solution turns out to be a useful tool for understanding the adsorption mechanisms. Adsorption is accompanied by a shrinking of the beads that corresponds to a 45% reduction of the volume. Adsorption kinetic experiments show that equilibrium time is strongly dependent on the surfactant concentration, which monitors the nature of the interactions. On the other hand, since the pH affects the ionization state of adsorption sites, adsorption depends on the pH solution, maximum adsorption being obtained in a large pH range (3.2-12) in agreement with the pKa value of alginate (pKa=3.4-4.2). Finally, due to the formation of micelle-like surfactants aggregates in the magnetic alginate beads, they could be used as a new efficient magsorbent for hydrophobic pollutants.

  11. Protein nanoparticle interaction: A spectrophotometric approach for adsorption kinetics and binding studies

    NASA Astrophysics Data System (ADS)

    Vaishanav, Sandeep K.; Chandraker, Kumudini; Korram, Jyoti; Nagwanshi, Rekha; Ghosh, Kallol K.; Satnami, Manmohan L.

    2016-08-01

    Investigating the protein nanoparticle interaction is crucial to understand how to control the biological interactions of nanoparticles. In this work, Model protein Bovine serum albumin (BSA) was used to evaluate the process of protein adsorption to the gold nanoparticles (GNPs) surface. The binding of a model protein (BSA) to GNPs was investigated through fluorescence quenching measurements. The strong affinities of BSA for GNPs were confirmed by the high value of binding constant (Ks) which was calculated to be 2.2 × 1011 L/mol. In this consequence, we also investigated the adsorption behavior of BSA on GNPs surface via UV-Vis spectroscopy. The effect of various operational parameters such as pH, contact time, initial BSA concentration, and temperature on adsorption of BSA was investigated using batch adsorption experiments. Kinetics of adsorption was found to follow the pseudo-second order rate equation. The suitability of Freundlich and Langmuir adsorption models to the equilibrium data was investigated. The equilibrium adsorption was well described by the Freundlich isotherm model. The maximum adsorption capacity for BSA adsorbed on GNPs was 58.71 mg/g and equilibrium constant was 0.0058 calculated by the Langmuir model at 298 K and pH = 11.0. Thermodynamic parameters showed that the adsorption of BSA onto GNPs was feasible, spontaneous, and exothermic.

  12. Kinetics and Thermodynamics of Reserpine Adsorption onto Strong Acidic Cationic Exchange Fiber

    PubMed Central

    Guo, Zhanjing; Liu, Xiongmin; Huang, Hongmiao

    2015-01-01

    The kinetics and thermodynamics of the adsorption process of reserpine adsorbed onto the strong acidic cationic exchange fiber (SACEF) were studied by batch adsorption experiments. The adsorption capacity strongly depended on pH values, and the optimum reserpine adsorption onto the SACEF occurred at pH = 5 of reserpine solution. With the increase of temperature and initial concentration, the adsorption capacity increased. The equilibrium was attained within 20 mins. The adsorption process could be better described by the pseudo-second-order model and the Freundlich isotherm model. The calculated activation energy Ea was 4.35 kJ/mol. And the thermodynamic parameters were: 4.97<ΔH<7.44 kJ/mol, -15.29<ΔG<-11.87 kJ/mol and 41.97<ΔS<47.35 J/mol·K. The thermodynamic parameters demonstrated that the adsorption was an endothermic, spontaneous and feasible process of physisorption within the temperature range between 283 K and 323 K and the initial concentration range between 100 mg/L and 300 mg/L. All the results showed that the SACEF had a good adsorption performance for the adsorption of reserpine from alcoholic solution. PMID:26422265

  13. Characteristic Evaluation of Graphene Oxide for Bisphenol A Adsorption in Aqueous Solution

    PubMed Central

    Phatthanakittiphong, Thatchaphong; Seo, Gyu Tae

    2016-01-01

    This paper investigates the characteristics of graphene oxide (GO) for Bisphenol A (BPA) adsorption in water. Batch experiments on the influence of significant parameters were performed. While an improvement of the adsorption capacity of BPA was obtained by the increment of contact time and the initial BPA concentration, the increment of pH above 8, GO dosage, and temperature showed the reverse results. The thermodynamic study suggested that BPA adsorption on GO was an exothermic and spontaneous process. The kinetics was explained by the pseudo-second-order model which covers all steps of adsorption. The fit of the results with the Langmuir isotherm indicated the monolayer adsorption. At 298 K, the adsorption reached equilibrium within 30 min with the maximum adsorption capacity of 49.26 mg/g. The low BPA adsorption capacity of GO can be interpreted by the occurrence of oxygen-containing functional groups (OCFGs) that are able to form hydrogen bonds with the surrounding OCFGs and water molecules. This effect inhibited the role of π–π interactions that are mainly responsible for the adsorption of BPA. PMID:28335257

  14. Kinetic Batch Soil Adsorption Studies of 2, 4-dinitroanisole (DNAN)

    NASA Astrophysics Data System (ADS)

    Arthur, J.; Mark, N. W.; Taylor, S.; Brusseau, M. L.; Dontsova, K.

    2014-12-01

    Currently the explosive 2, 4, 6- trinitrotoluene (TNT) is used as a main ingredient in munitions; however the compound has failed to meet sensitivity requirements. The replacement compound being tested is 2, 4-dinitroanisole (DNAN). DNAN is less sensitive to shock, high temperatures, and has good detonation characteristics. However, DNAN is more soluble than TNT, which can influence transport and fate behavior and thus bioavailability and exposure potential. DNAN has been shown to have some human and environmental toxicity. The objective of this study was to investigate the environmental fate of DNAN in soil, with a specific focus on sorption processes. Batch experiments were conducted using 11 soils collected from military installations located across the United States. The soils were characterized for pH, specific surface area, electrical conductivity, cation exchange capacity, and organic carbon content. Adsorption kinetic data determined at room temperature were fitted using the first order kinetic equation. Adsorption isotherms were fitted with linear and Freundlich isotherm equations. The magnitudes of the linear adsorption coefficients ranged from 0.6 to 6 cm3/g. Results indicated that the adsorption of DNAN is strongly dependent on the amount of organic carbon present in the soil.

  15. Nitrate removal from aqueous solution by adsorption onto various materials.

    PubMed

    Oztürk, Neşe; Bektaş, T Ennil

    2004-08-09

    In this study sepiolite, sepiolite activated by HCl, slag and powdered activated carbon were used as adsorbent with a particle size was between 71 and 80 microm (200-170 mesh). NaNO3 solution (100 mg/l) was used in batch adsorption experiments for nitrate removal. First kinetic studies were carried out and it was determined that slag was not effective for nitrate removal, then contact time, pH and adsorbent dosage effects on nitrate removal by adsorption were investigated using other adsorbents except slag. The equilibrium time was found to be 30, 45, 5 min for sepiolite, powdered activated carbon and activated sepiolite, respectively. The most effective pH value for nitrate removal was 2 for powdered activated carbon. pH value did not affect nitrate removal significantly for other adsorbents. Adsorbent dosages were varied from 5 to 20 g/l solutions. An increase in adsorbent dosage increased the percent removal of nitrate. A series of isotherm studies were undertaken and the data evaluated for compliance with the Langmuir and Freundlich isotherm models. To investigate the adsorption mechanisms, three simplified kinetic models, i.e., first-, second-order and intraparticle diffusion were tested. Adsorption followed second-order rate kinetics. The correlation coefficients for second order kinetic model are greater than 0.996. Experimental data show that sepiolite activated by HCl was effective for nitrate removal.

  16. Co-modified MCM-41 as an effective adsorbent for levofloxacin removal from aqueous solution: optimization of process parameters, isotherm, and thermodynamic studies.

    PubMed

    Jin, Ting; Yuan, Wenhua; Xue, Yujie; Wei, Hong; Zhang, Chaoying; Li, Kebin

    2016-12-21

    Antibiotics are emerging contaminants due to their potential risks to human health and ecosystems. Poor biodegradability makes it necessary to develop effective physical-chemical methods to eliminate these contaminants from water. The cobalt-modified MCM-41 was prepared by a one-pot hydrothermal method and characterized by SAXRD, N2 adsorption-desorption, SEM, UV-Vis DR, and FTIR spectroscopy. The results revealed that the prepared 3% Co-MCM-41 possessed mesoporous structure with BET surface areas at around 898.5 m(2)g(-1). The adsorption performance of 3% Co-MCM-41 toward levofloxacin (LVF) was investigated by batch experiments. The adsorption of LVF on 3% Co-MCM-41 was very fast and reached equilibrium within 2 h. The adsorption kinetics followed the pseudo-second-order kinetic model with the second-order rate constants in the range of 0.00198-0.00391 g mg(-1) min(-1). The adsorption isotherms could be well represented by the Langmuir, Freundlich, and Dubinin-Radushkevich (D-R) isotherm equations. Nevertheless, D-R isotherm provided the best fit based on the coefficient of determination and average relative error values. The mean free energy of adsorption (E) calculated from D-R model was about 11 kJ mol(-1), indicating that the adsorption was mainly governed by a chemisorption process. Moreover, the adsorption capacity was investigated as a function of pH, adsorbent dosage, LVF concentration, and temperature with help of respond surface methodology (RSM). A quadratic model was established, and an optimal condition was obtained as follows: pH 8.5, adsorbent dosage of 1 g L(-1), initial LVF concentration of 119.8 mg L(-1), and temperature of 31.6 °C. Under the optimal condition, the adsorption capacity of 3% Co-MCM-41 to LVF could reach about 108.1 mg g(-1). The solution pH, adsorbent dosage, LVF concentration, and a combination of adsorbent dose and LVF concentration were significant factors affecting the adsorption process. The adsorption

  17. Intestinal adsorption of levothyroxine by antacids and laxatives: case stories and in vitro experiments.

    PubMed

    Mersebach, H; Rasmussen, A K; Kirkegaard, L; Feldt-Rasmussen, U

    1999-03-01

    Two patients with hypothyroidism treated for upper dyspepsia and constipation with aluminum hydroxide and magnesium oxide, respectively, presented a marked increase in the serum concentration of thyroid stimulating hormone and low serum thyroxine on a fixed dosage of levothyroxine. After discontinuation of antacids/laxatives, thyroid stimulating hormone was again reduced indicating interaction between levothyroxine and antacids/laxatives. In vitro studies revealed a dose-related increased adsorption of levothyroxine by addition of a combination of aluminum hydroxide, magnesium hydroxide and magnesium carbonate, while no connection between levothyroxine and the addition of magnesium oxide, alone, was found. This finding has major clinical consequences since 1) many patients are treated with levothyroxine, 2) most patients do not tell physicians that they take antacids/laxatives, and 3) consumption of antacids/laxatives in patients with levothyroxine-treated hypothyroidism may lead to serious undersubstitution with levothyroxine.

  18. Modelling of moisture adsorption for sugar palm (Arenga pinnata) starch film

    NASA Astrophysics Data System (ADS)

    Jatmiko, Tri Hadi; Poeloengasih, Crescentiana D.; Prasetyo, Dwi Joko; Hernawan

    2017-03-01

    Sorption characteristic of food products is important for design, optimization, storage and modelling. Sugar palm starch film with two different plasticizers (sorbitol and glycerol) with varied concentration studied for its adsorption isotherm characteristic. The data of adsorption isotherm fitted with GAB, Oswin, Smith and Peleg models. All models describe the experiment data well, but Peleg model is better than the other models on both sugar palm starch film plasticized with sorbitol and glycerol. Moisture sorption of sugar palm starch increased linearly with plasticizer concentration. A new model by taking account of plasticizer concentration describes the experiment data well with an average of coefficients of determination (R2) 0.9913 and 0.9939 for film plasticized with glycerol and sorbitol respectively.

  19. Performance, kinetics, and equilibrium of methylene blue adsorption on biochar derived from eucalyptus saw dust modified with citric, tartaric, and acetic acids.

    PubMed

    Sun, Lei; Chen, Dongmei; Wan, Shungang; Yu, Zebin

    2015-12-01

    Biochar derived from eucalyptus saw dust modified with citric, tartaric, and acetic acids at low temperatures was utilized as adsorbent to remove methylene blue (MB) from aqueous solutions. Fourier transform infrared spectroscopy analysis showed that the carboxyl group was introduced on the biochar surface. Adsorption experiment data indicated that eucalyptus saw dust modified with citric acid showed higher MB adsorption efficiency than that modified with tartaric and acetic acids. Pseudo-second-order kinetics was the most suitable model for describing MB adsorption on biochar compared with pseudo-first-order, Elovich, and intraparticle diffusion models. The calculated values of ΔG(0) and ΔH(0) indicated the spontaneous and endothermic nature of the adsorption process. MB adsorption on biochar followed the Langmuir isotherm. The maximum adsorption capacities for eucalyptus saw dust modified with citric, tartaric, and acetic acids were 178.57, 99.01, and 29.94 mg g(-1), respectively, at 35°C.

  20. Reduction of COD in refinery wastewater through adsorption on date-pit activated carbon.

    PubMed

    El-Naas, Muftah H; Al-Zuhair, Sulaiman; Abu Alhaija, Manal

    2010-01-15

    Experiments were carried out to evaluate the batch adsorption of COD from petroleum refinery wastewater on a locally prepared date-pit activated carbon (DP-AC), and its adsorption effectiveness was compared to that of commercially available BDH activated carbon (BDH-AC). Adsorption equilibrium and kinetic data were determined for both adsorbents and fitted to several adsorption isotherm and kinetics models, respectively. The Langmuir monolayer isotherm fitted well the equilibrium data of COD on both adsorbents; whereas, the kinetics data were best fitted by the pseudo-second order model. Modeling of the controlling mechanisms indicated that both intrinsic kinetics and mass transfer contributed to controlling the adsorption process. Mass transfer seemed to be the dominant mechanism at low COD content, while intrinsic kinetics dominates at high concentrations. In general, the adsorption effectiveness of locally prepared DP-AC was proven to be comparable to that of BDH-AC. Therefore, DP-AC can be utilized as an effective and less expensive adsorbent for the reduction of COD in refinery wastewater.

  1. Adsorption Behavior of Ferromagnetic Carbon Nanotubes for Methyl Orange from Aqueous Solution.

    PubMed

    Wang, Liping; Zhang, Mingyu; Zhao, Chenxi; Yang, Shan

    2016-03-01

    The ferromagnetic carbon nanotubes which can be easily separated from aqueous solution were prepared and characterized by scanning electron microscope (SEM), Fourier transform infrared spectroscopy (FTIR) and X-ray diffraction (XRD). Batch experiments were carried out to investigate the adsorption behavior of ferromagnetic carbon nanotubes for removing methyl orange (MO). The results showed that these ferromagnetic carbon nanotubes were richer in surface function groups than the carbon nanotubes did, furthermore, both γ-Fe2O3 and Fe with ferromagnetism were found on the surface of carbon nanotubes. The results also demonstrated that ferromagnetic carbon nanotubes possessed stronger adsorption ability for MO than carbon nanotubes did. The adsorption isotherms followed Langmuir isotherm equation and the adsorption kinetics could be well described with the pseudo second-order kinetic model. The adsorption process involved an intraparticle diffusion, while it was not the only rate-controlling step. The values of AG were negative and the value of ΔH is -12.37 kJ/mol, proving that the adsorption of MO onto ferromagnetic carbon nanotubes was a spontaneous and exothermic process.

  2. [Adsorption kinetic and thermodynamic studies of lead onto activated carbons from cotton stalk].

    PubMed

    Li, Kun-quan; Zheng, Zheng; Jiang, Jian-chun; Zhang, Ji-biao

    2010-05-01

    Low-cost high surface area microporous carbons were prepared from cotton stalk and cotton stalk fiber by H3PO4 activation. The adsorption of lead ions on the carbons was investigated by conducting a series of batch adsorption experiments. The influence of solution pH value, contact time and temperature was investigated. The adsorption kinetics, thermodynamic behavior and mechanism were also discussed. The surface area and pore structure of the activated carbons were analyzed by BET equation, BJH method and H-K method according to the data from nitrogen adsorption at 77K. Boehm titration, Fourier transform infrared spectroscopy (FTIR), the point of zero charge (pH(PZC)) measurement and elemental analysis were used to characterize the surface properties. The results show that the carbons from cotton stalk and cotton stalk fiber have high surface area of 1570 and 1731 m2 x g(-1), and high content of oxygen-containing functional groups of 1.43 and 0.83 mmol x g(-1). The adsorption experiments show that the carbons have high adsorption capacity for lead, and the maximum adsorption equilibrium amount was found to be 120 mg x g(-1). The adsorption amount increased with contact time, and almost 80% of the adsorption occurred in the first 5 min. The pseudo-second-order model describes the adsorption kinetics most effectively. The Freundlich isotherm was found to the best explanation for experimental data. The negative change in free energy (delta G0) and positive change in enthalpy (delta H0) indicate that the adsorption is a spontaneous and endothermic process, and the adsorption of lead ions onto the carbons might be involved in an ion-exchange mechanism.

  3. A study of boron adsorption onto activated sludge.

    PubMed

    Fujita, Yuichiro; Hata, Takayosi; Nakamaru, Makoto; Iyo, Toru; Yoshino, Tsuneo; Shimamura, Tadashi

    2005-08-01

    Boron adsorption onto activated sludge was investigated using bench-scale reactors under simulated wastewater treatment conditions. Two experiments, continuous flow and batch, were performed. Boron concentrations were determined by means of inductively coupled plasma mass spectrometry. The results of the continuous-flow experiment indicated that a small amount of boron accumulated on the activated sludge and its concentration in the sludge depended on the nature of the biota in the sludge. Freundlich and Langmuir isotherm plots generated using the data from the batch experiment indicated that boron was adsorbed onto rather than absorbed into the sludge. The Freundlich constants, k and 1/n, were determined to be 26 mg/kg and 0.87. These values indicate that activated sludge has a limited capacity for boron adsorption and thus utilization of the excess sludge for farmland may not be toxic to plant at least boron concern.

  4. Preparative separation and purification of Rebaudioside A from Stevia rebaudiana Bertoni crude extracts by mixed bed of macroporous adsorption resins.

    PubMed

    Li, Jie; Chen, Zhenbin; Di, Duolong

    2012-05-01

    The separation and purification of Rebaudioside A (RA) from Stevia rebaudiana Bertoni crude extracts (Steviosides) by macroporous adsorption resin (MAR) mixed bed were systematically investigated. MAR mixed bed of HPD750-LSA40-LSA30-DS401 was selected due to its better separation degree. Based on the kinetics/thermodynamics experiment of the mixed bed, it was found that the experimental data fitted better to the pseudo-second-order model, and intra-particle diffusion was rate-limiting step. The adsorption isotherm was consistent with IV equilibrium adsorption isotherm classified by Brunauer. Furthermore, the influencing factors for the separation of RA based on HPLC were also investigated. Under the optimal conditions, the separation degree for RA (DAS) increased from 0.771 to 1.54. Moreover, the experimental results showed that the purity of the obtained product increased from 60% to 97%.

  5. Competitive adsorption of Cu(II) and Cd(II) ions by chitosan crosslinked with epichlorohydrin-triphosphate.

    PubMed

    Laus, Rogério; de Fávere, Valfredo Tadeu

    2011-10-01

    In this study, chitosan (CTS) was crosslinked with both epichlorohydrin (ECH) and triphosphate (TPP), by covalent and ionic crosslinking reactions, respectively. The resulting adsorbent (CTS-ECH-TPP) was characterized by SEM, CHN, EDS, FT-IR and TGA analyses, and tested for metal adsorption. The adsorbent was used in batch experiments to evaluate the adsorption of Cu(II) and Cd(II) ions in single and binary metal solutions. In single metal solutions the maximum adsorption capacities for Cu(II) and Cd(II) ions, obtained by Langmuir model, were 130.72 and 83.75 mg g⁻¹, respectively. Adsorption isotherms for binary solutions showed that the presence of Cu(II) decreased Cd(II) adsorption due to a significant competition effect, that is, the adsorbent was selective towards Cu(II) rather than Cd(II).

  6. Adsorption of Benzoic Compounds onto Stainless Steel Particles

    PubMed

    Suzuki; Shibata; Inoue

    1997-09-15

    Equilibrium experiment was conducted to investigate the factors determining the adsorption of benzoic acid (BA) and its derivatives, m- and p-hydroxy BA, onto SUS316L stainless steel particles of 8-10 &mgr;m diameter and under 100 mesh. Adsorption isotherms of these benzoic compounds were determined in the presence of 0.05 M NaCl at pH 4 and 30°C. The adsorptions of the these compounds were described well by a Langmuirian model for both adsorbents. When the maximum number of the benzoic compound adsorption sites was expressed on the basis of unit surface area (N, mol/m2), the N values were relatively constant, while the greatest value of the affinity (K, ml/&mgr;mol) was obtained for p-hydroxy BA, although its value was in the same range as that of the other two adsorbates. Diffuse-reflectance Fourier transform infrared spectra of the fine adsorbent (8-10 &mgr;m diameter) after equilibration suggest that the adsorption mainly takes place through the carboxyl group of the adsorbate-stainless steel surface interaction for all adsorbates, whereas concomitant interaction occurs in part with participation of the phenolic hydroxyl group for p-OH BA adsorbate, accounting for the difference in adsorption properties. Copyright 1997 Academic Press. Copyright 1997Academic Press

  7. Adsorption characterizations of fulvic acid fractions onto kaolinite.

    PubMed

    Li, Aimin; Xu, Minjuan; Li, Wenhui; Wang, Xuejun; Dai, Jingyu

    2008-01-01

    Fulvic acids extracted from a typical rice-production region near Taihu Lake of China were fractionated into three fractions including F4.8, F7.0 and F11.0 (eluted by pH 4.8 buffer, pH 7.0 buffer and pH 11.0 buffer, respectively). Sorption of fulvic acid (FA) fractions onto kaolinite was studied by batch adsorption experiments, and characterizations of kaolinite before and after adsorption were investigated using scanning electron microscopy (SEM). Adsorption isotherms of kaolinite for three FA fractions fit well with the Langmuir adsorption model. The adsorption density of the three fractions was positively correlated with the ratio of the amount of the alkyl carbon to that of carboxyl and carbonyl carbon in FA fractions and followed an order of F11.0 > F7.0 > F4.8. Hydrophobic interaction was one of the control mechanisms for the sorption of FA fraction onto kaolinite. SEM images confirmed that compared to blank kaolinite samples, kaolinite samples coated by a FA fraction displayed an opener and more dispersed conformation resulting from the disruption of the floc structure in complex. Dispersion of kaolinite after adsorption was due to the repulsion between negatively charged FA-coated particles, which is closely related to the amount of FA fractions absorbed on kaolinite.

  8. Synthesized magnetic nanoparticles coated zeolite for the adsorption of pharmaceutical compounds from aqueous solution using batch and column studies.

    PubMed

    Salem Attia, Tamer Mohamed; Hu, Xia Lin; Yin, Da Qiang

    2013-11-01

    The contamination of fresh water with pharmaceutical and personal care products (PPCPs) has risen during the last few years. The adsorption of some PPCPs namely, Diclofenac-Na, Naproxen, Gemfibrozil and Ibuprofen from aqueous solution has been studied, magnetic nanoparticles coated zeolite (MNCZ) has been used as the adsorbent. Batch adsorption experiment was conducted to study the influences of different adsorption parameters such as contact time, solution pH and PPCPs concentrations in order to optimize the reaction conditions. The removal was favored at low pH values. Thus, as pH turns from acidic to basic conditions these compounds were less efficiently removed. The initial concentration does not appear to exert a noticeable effect on the removal efficiency of the studied PPCPs at low concentrations, but it showed less removal efficiency during high concentration of PPCPs especially for Ibuprofen. The removal of Diclofenac-Na was independent on time, while the contact time was of significant effect on the adsorption of Naproxen, Gemfibrozil and Ibuprofen even though these compounds were removed up to 95% during 10 min using MNCZ. From the isotherm adsorption study, the adsorption of PPCPs studied on MNCZ was best fitted with Freundlich isotherm equation. Pseudo-second order model providing the best fit model with the experimental data. Column adsorption study was conducted to compare the removal efficiency of MNCZ with other processes used at drinking water treatment plants (DWTPs), MNCZ showed high removal efficiency (>99%) than other used processes at DWTPs.

  9. Adsorption and abiotic oxidation of arsenic by aged biofilter media: equilibrium and kinetics.

    PubMed

    Sahabi, Danladi Mahuta; Takeda, Minoru; Suzuki, Ichiro; Koizumi, Jun-ichi

    2009-09-15

    Removal of arsenic from groundwater by biological adsorptive filtration depends largely on its interaction with biogenic iron and manganese oxides surfaces. In the present study we investigated the arsenic adsorption and abiotic oxidation capacities of an aged biofilter medium (BM2) collected from a long time established groundwater treatment plant for removal of iron and manganese by biological filtration. Batch oxidation/adsorption kinetic experiments indicated that BM2 can easily oxidize As(III) to As(V) with the rate of oxidation less affected by pH-variations from 4 to 8.5. The adsorption capacity of the biofilter medium for the produced or added As(V), however, depends strongly on the pH of the solution. The kinetics results have shown that As(III) sorption followed pseudo-second order kinetics, whereas the sorption of As(V) was best described by the intra-particle diffusion model, indicating that adsorptions of As(III) and As(V) onto BM2 were governed by different mechanisms. Adsorption isotherms at 25 degrees C were measured for a range of arsenite and arsenate initial concentrations of 0.67-20 micromol/L and the pH range from 4 to 9. Adsorption maxima were highest at pH 4 and decrease steadily as the pH increases. The equilibrium data for both As(III) and As(V) fitted very well to the Freundlich and Sips isotherm equations and, in most cases, the two isotherms overlapped with the same correlation coefficients, indicating sorption to be multilayer on the heterogeneous surface of BM2. The implication of the data for arsenic removal from water by biological filtration has been discussed.

  10. Adsorption Removal of Environmental Hormones of Dimethyl Phthalate Using Novel Magnetic Adsorbent

    PubMed Central

    Chang, Chia-Chi; Tseng, Jyi-Yeong; Ji, Dar-Ren; Chiu, Chun-Yu; Lu, De-Sheng; Chang, Ching-Yuan; Yuan, Min-Hao; Chang, Chiung-Fen; Chiou, Chyow-San; Chen, Yi-Hung; Shie, Je-Lueng

    2015-01-01

    Magnetic polyvinyl alcohol adsorbent M-PVAL was employed to remove and concentrate dimethyl phthalate DMP. The M-PVAL was prepared after sequential syntheses of magnetic Fe3O4 (M) and polyvinyl acetate (M-PVAC). The saturated magnetizations of M, M-PVAC, and M-PVAL are 57.2, 26.0, and 43.2 emu g−1 with superparamagnetism, respectively. The average size of M-PVAL by number is 0.75 μm in micro size. Adsorption experiments include three cases: (1) adjustment of initial pH (pH0) of solution to 5, (2) no adjustment of pH0 with value in 6.04–6.64, and (3) adjusted pH0 = 7. The corresponding saturated amounts of adsorption of unimolecular layer of Langmuir isotherm are 4.01, 5.21, and 4.22 mg g−1, respectively. Values of heterogeneity factor of Freundlich isotherm are 2.59, 2.19, and 2.59 which are greater than 1, revealing the favorable adsorption of DMP/M-PVAL system. Values of adsorption activation energy per mole of Dubinin-Radushkevich isotherm are, respectively, of low values of 7.04, 6.48, and 7.19 kJ mol−1, indicating the natural occurring of the adsorption process studied. The tiny size of adsorbent makes the adsorption take place easily while its superparamagnetism is beneficial for the separation and recovery of micro adsorbent from liquid by applying magnetic field after completion of adsorption. PMID:26258169

  11. An experimental study of adsorption in vapor-dominated geothermal systems

    SciTech Connect

    Satik, Cengiz; Horne, Roland N.

    1995-01-26

    We report results of steam adsorption experiments conducted for rock samples from vapor-dominated geothermal reservoirs. We examine the effect of the temperature on the adsorption/desorption isotherms. We find that the temperature effect is only important on the desorption such that the hysteresis becomes more pronounced as the temperature increases. The scanning behavior within the steam sorption hysteresis loop is also studied to investigate the behavior during repressurization. Collection of sets of data on the sorption behavior of The Geysers geothermal field in California is presented.

  12. CR-100 synthetic zeolite adsorption characteristics toward Northern Banat groundwater ammonia.

    PubMed

    Tomić, Željko; Kukučka, Miroslav; Stojanović, Nikoleta Kukučka; Kukučka, Andrej; Jokić, Aleksandar

    2016-10-14

    The adsorption characteristics of synthetic zeolite CR-100 in a fixed-bed system using continuous flow of groundwater containing elevated ammonia concentration were examined. The possibilities for adsorbent mass calculation throughout mass transfer zone using novel mathematical approach as well as zeolite adsorption capacity at every sampling point in time or effluent volume were determined. The investigated adsorption process consisted of three clearly separated steps indicated to sorption kinetics. The first step was characterized by decrease and small changes in effluent ammonia concentration vs. experiment time and quantity of adsorbed ammonia per mass unit of zeolite. The consequences of this phenomenon were showed in the plots of the Freundlich and the Langmuir isotherm models through a better linear correlation according as graphical points contingent to the first step were not accounted. The Temkin and the Dubinin-Radushkevich isotherm models showed the opposite tendency with better fitting for overall measurements. According to the obtained isotherms parameter data, the investigated process was found to be multilayer physicochemical adsorption, and also that synthetic zeolite CR-100 is a promising material for removal of ammonia from Northern Banat groundwater with an ammonia removal efficiency of 90%.

  13. A Study of Adsorptive Characteristics of Australian Coals

    NASA Astrophysics Data System (ADS)

    Lan, Y. P.; Tsai, L. L.

    2012-04-01

    Ever since the Kyoto Protocol, controlling carbon dioxide emission and reducing its content in atmosphere are very important environmental issues up to today. One of the effective methods for permanent sequestration of anthropogenic CO2 is to inject CO2 into deep, unminable coal seams and recover coal bed methane at the same time. CO2-ECBM technology had been proved to be very promising to meet the needs of both environment and energy. Beside other external environment factors, capacity of CO2 adsorption and CH4 desorption are the most influencing factors in selection of sites for the geological storage of CO2. Therefore, the objective of this study is to understand the relationship between gas adsorption and CO2 sequestration, by various experiments for the characterization of Australian of coals. Generally speaking, coal seam gas comprises mostly of CH4, CO2, C2H6, and N2. However, some of the Australian coals were reported with significant amount of CO2 up to 90%, which might strongly affect their capacity of CO2 capture and storage (CCS). High to medium volatile bituminous coals from Sydney Basin and Bowen Basin, southeast Australia were selected in this study. Experiments include maceral composition and vitrinite reflectance measurements, petrographic analysis, Proximate analysis, Ultimate analysis, specific surface area analysis as well as CO2 and CH4 adsorption experiments were performed. Parameters for difference adsorption functions (Langmuir, BET, D-R and D-A) were then calculated to fit their adsorption isotherms the best fitting curve can then be found. Among these adsorption functions, Langmuir is the most basic and commonly used function theory. The results of all experiments were synthesized to discuss the relations among each other, so as to establish the relationship between gas adsorption and coal characteristics.

  14. Revisiting Isotherm Analyses Using R: Comparison of Linear, Non-linear, and Bayesian Techniques

    EPA Science Inventory

    Extensive adsorption isotherm data exist for an array of chemicals of concern on a variety of engineered and natural sorbents. Several isotherm models exist that can accurately describe these data from which the resultant fitting parameters may subsequently be used in numerical ...

  15. Efficient Pb(II) removal using sodium alginate-carboxymethyl cellulose gel beads: Preparation, characterization, and adsorption mechanism.

    PubMed

    Ren, Huixue; Gao, Zhimin; Wu, Daoji; Jiang, Jiahui; Sun, Youmin; Luo, Congwei

    2016-02-10

    Alginate-carboxymethyl cellulose (CMC) gel beads were prepared in this study using sodium alginate (SA) and sodium CMC through blending and cross-linking. The specific surface area and aperture of the prepared SA-CMC gel beads were tested. The SA-CMC structure was characterized and analyzed via infrared spectroscopy, scanning electron microscopy, and energy-dispersive X-ray spectroscopy. Static adsorption experiment demonstrated that Pb(II) adsorption of SA-CMC exceeded 99% under the optimized conditions. In addition, experiments conducted under the same experimental conditions showed that the lead ion removal efficiency of SA-CMC was significantly higher than that of conventional adsorbents. The Pb(II) adsorption process of SA-CMC followed the Langmuir adsorption isotherm, and the dynamic adsorption model could be described through a pseudo-second-order rate equation. Pb(II) removal mechanisms of SA-CMC, including physical, chemical, and electrostatic adsorptions, were discussed based on microstructure analysis and adsorption kinetics. Chemical adsorption was the main adsorption method among these mechanisms.

  16. Adsorption of mercury in coal-fired power plants gypsum slurry on TiO2/chitosan composite material

    NASA Astrophysics Data System (ADS)

    Gao, P.; Gao, B. B.; Gao, J. Q.; Zhang, K.; Chen, Y. J.; Yang, Y. P.; Chen, H. W.

    2016-07-01

    In this study, a simple method was used to prepare a chitosan adsorbent to mix with KI and TiO2. Gravimetric analysis (TG), scanning electron microscopy (SEM) and Fourier transform infrared spectroscopy (FTIR) were used to characterize the samples before and after adsorption of Hg2+. A mercury adsorption experiment was also conducted in the gypsum slurry. The results show that using hydrobromic acid as a solvent of adsorbent resulted in a better adsorption effect than using acetic acid alone. Also, the sample (CS-KI/TiO2-HBr) had a maximum mercury adsorption capacity when the pH=5 and the t=50°C. The characterization experiments showed that the thermal stability of composite materials declined and the TiO2 uniformly dispersed in the surface of the samples with a lamellar structure, generating a lot of cracks and recesses that increased the reactive sites. Furthermore, when the TiO2 reacted with CS, it resulted in Ti-C, Ti-O and Ti-N bonds. The Br- can prevent the growth of TiO2 crystal grains and strengthen the ability of I- to remove mercury. The adsorption isotherm and kinetic results indicated that the adsorption behaviour of CS-KI/TiO2-HBr as it removes Hg2+ is an inhomogeneous multilayer adsorption process. The surface adsorption and intraparticle diffusion effects are both important in the Hg2+ adsorption process.

  17. An efficient removal of RB5 from aqueous solution by adsorption onto nano-ZnO/Chitosan composite beads.

    PubMed

    Çınar, Seda; Kaynar, Ümit H; Aydemir, Tülin; Çam Kaynar, Sermin; Ayvacıklı, Mehmet

    2017-03-01

    In this study, the removal of Reactive Black 5 (RB-5) by nano-ZnO/Chitosan composite beads (nano-ZnO/CT-CB) from aqueous solution was investigated. ZnO nanoparticles were prepared by the via the microwave-assisted combustion technique. And then nano-ZnO/Chitosan composite beads were prepared by polymerization in the presence of nano-ZnO and chitosan. Characterization of composite beads were conducted using SEM, TEM, FTIR, TGA and XRD. Several important parameters influencing the removal of RB 5 such as contact time, pH and temperature were investigated systematically by batch experiments. At optimum conditions of pH 4 and adsorbent concentration of 0.2g, dye removal efficiency was found 76%. Langmuir, Freundlich and Temkin adsorption models were used to describe adsorption isotherms and constants. The maximum adsorption capacity (qm) by Langmuir isotherm has been found to be 189.44mg/g. Isotherms have also been used to obtain the thermodynamic parameters such as free energy, enthalpy and entropy of adsorption. The positive value of the enthalpy change (32.7kJ/mol) indicated that the adsorption is an endothermic process. The obtained results showed that the tested adsorbents are efficient and alternate low-cost adsorbent for removal of dyes from aqueous media.

  18. Characterization of metal adsorption kinetic properties in batch and fixed-bed reactors.

    PubMed

    Chen, J Paul; Wang, Lin

    2004-01-01

    Copper adsorption kinetic properties in batch and fixed-bed reactors were studied in this paper. The isothermal adsorption experiments showed that the copper adsorption capacity of a granular activated carbon (Filtrasorb 200) increased when ionic strength was higher. The presence of EDTA diminished the adsorption. An intraparticle diffusion model and a fixed-bed model were successfully used to describe the batch kinetic and fixed-bed operation behaviors. The kinetics became faster when the solution pH was not controlled, implying that the surface precipitation caused some metal uptake. The external mass transfer coefficient, the diffusivity and the dispersion coefficient were obtained from the modeling. It was found that both external mass transfer and dispersion coefficients increased when the flow rate was higher. Finally effects of kinetic parameters on simulation of fixed-bed operation were conducted.

  19. Kinetics and thermodynamics studies of silver ions adsorption onto coconut shell activated carbon.

    PubMed

    Silva-Medeiros, Flávia V; Consolin-Filho, Nelson; Xavier de Lima, Mateus; Bazzo, Fernando Previato; Barros, Maria Angélica S D; Bergamasco, Rosângela; Tavares, Célia R G

    2016-12-01

    The presence of silver in the natural water environment has been of great concern because of its toxicity, especially when it is in the free ion form (Ag(+)). This paper aims to study the adsorption kinetics of silver ions from an aqueous solution onto coconut shell activated carbon using batch methods. Batch kinetic data were fitted to the first-order model and the pseudo-second-order model, and this last equation fits correctly the experimental data. Equilibrium experiments were carried out at 30°C, 40°C, and 50°C. The adsorption isotherms were reasonably fit using Langmuir model, and the adsorption process was slightly influenced by changes in temperature. Thermodynamic parameters (ΔH°, ΔG°, and ΔS°) were determined. The adsorption process seems to be non-favorable, exothermic, and have an increase in the orderness.

  20. Adsorption of sodium diclofenac on graphene: a combined experimental and theoretical study.

    PubMed

    Jauris, I M; Matos, C F; Saucier, C; Lima, E C; Zarbin, A J G; Fagan, S B; Machado, F M; Zanella, I

    2016-01-21

    The interactions of sodium diclofenac drug (s-DCF) with different graphene species were investigated using both first principles calculations based on Density Functional Theory (DFT) and adsorption experiments. Through batch adsorption experiments, it was found that rGO was a good adsorbent for removing the s-DCF drug from aqueous solutions. The general-order kinetic model shows the best fit to the experimental data compared with pseudo-first order and pseudo-second order kinetic adsorption models. The equilibrium data (at 25 °C) were fitted to the Liu isotherm model. The maximum sorption capacity for adsorption of the s-DCF drug was 59.67 mg g(-1) for rGO. The s-DCF adsorption onto pristine graphene, graphene with a vacancy, reduced oxide graphene (rGO) and functionalized graphene nanoribbons were simulated providing a good understanding of the adsorption process of this molecule on graphene-family surfaces. The results predict a physisorption regime in all cases. Based on these results, the ab initio calculations and the adsorption experiments point out that the graphene-family are promising materials for extracting s-DCF from wastewater effluents.

  1. Adsorption experiment of toxic micro-pollutants derived from automobiles using red soil.

    PubMed

    Kawai, Takahiro; Ichiki, Atsushi; Sawada, Yasunori

    2015-01-01

    In some countries, non-point source pollution derived from a city's economic activities tends to be a barrier to the improvement of water quality. Roadway runoff is known to contain toxic micro-pollutants such as polycyclic aromatic hydrocarbons (PAHs). Conversely, red soil is known to adsorb some organic matter. In this study, artificial roadway runoff water containing toxic micro-pollutants was made using roadway dust collected from a highway, and used for both batch-type tests and soil column tests with red soil in order to understand adsorption ability of the red soil on such toxic micro-pollutants, especially PAHs. In the batch-type tests, PAHs could be removed by approximately 40% when the contact time was 90 minutes. In the soil column tests, PAHs were removed by more than 80% while suspended solids were removed by more than 90%. Notably, PAHs with a high molecular weight were removed more readily in the tests than PAHs with a low molecular weight.

  2. Adsorption of pesticides on resins.

    PubMed

    Kyriakopoulos, Grigorios; Hourdakis, Adamadia; Doulia, Danae

    2003-03-01

    The objective of this work was to assess the capability of organic hydrophobic polymeric resins Amberlite XAD-4 and XAD-7 to remove the pesticides alachlor and amitrole from water. The pesticides adsorption on the two different adsorbents was measured by batch equilibrium technique and isotherm types and parameters were estimated. Two theoretical models were applied based on a Freundlich and a Langmuir isotherms. The effect of pesticides chemical composition and structure as well as the nature of solid surface on the efficiency of adsorption was evaluated. The influence of pH also was studied. In low pH solutions adsorption of amitrole was higher upon the nonionic aliphatic acrylic ester copolymer XAD-7 in comparison to the nonionic, crosslinked macroreticular copolymer of styrene divinylbenzene XAD-4. In neutral and intermediate pH solutions the polar acrylic ester copolymer XAD-7 was more effective to the retention of alachlor. The acrylic ester copolymer showed at pH 3 the lower effectiveness in alachlor removal from water. The data of the adsorption isotherms of pesticides upon the examined polymeric resins seemed to conform to both the Freundlich and the Langmuir isotherm models.

  3. Visualizing Gas Adsorption on Porous Solids: Four Simple, Effective Demonstrations

    ERIC Educational Resources Information Center

    Cheung, Ocean

    2014-01-01

    Gas adsorption on porous solids is a topic that is often discussed in an undergraduate chemistry or chemical engineering course. The idea of porosity and gas adsorption on a porous solid is usually discussed with adsorption isotherms recorded using commercially available equipment. This discussion can be rather abstract and can be difficult for…

  4. [Preparation of surface molecularly imprinted polymers for penicilloic acid, and its adsorption properties].

    PubMed

    Zheng, Penglei; Luo, Zhimin; Chang, Ruimiao; Ge, Yanhui; Du, Wei; Chang, Chun; Fu, Qiang

    2015-09-01

    On account of the specificity and reproducibility for the determination of penicilloic acid in penicillin, this study aims to prepare penicilloic acid imprinted polymers (PEOA-MIPs) by surface polymerization method at the surface of modified silica particles by using penicilloic acid (PEOA) as the template molecule, methacrylic acid (MAA) as the functional monomer, ethylene glycol dimethacrylate ( EGDMA) as the cross linker, and methanol/acetonitrile as the solvents. The synthesis conditions were optimized, and PEOA-MIPs had the best adsorption capacity when the molar ratio of template molecule/functional monomer was 1 :4, cross linking degree was 85% and the solvent ratio of methanol/acetonitrile was 1 :1 (v/v). The adsorption properties were evaluated by adsorption experiments, including the adsorption isotherms, kinetics and selectivity. The adsorption process between PEOA-MIPs and PEOA fitted the Langmuir adsorption isotherm with the maximum adsorption capacity of 122. 78 mg/g and the pseudo-second-order reaction kinetics with fast adsorption kinetics (the equilibrium time of 45 min). The as-synthesized PEOA-MIPs were characterized by scanning electron microscopy (SEM), Fourier transform infrared spectroscopy (FT-IR), and thermal gravimetric analysis (TGA). The results indicated that the MIPs layer has been successfully grafted on the surface of SiO2 microparticles and the PEOA-MIPs had the excellent thermal stability. The PEOA-MIPs showed the highest selective recognition for PEOA. The PEOA-MIPs possess a high adsorption capacity, rapid mass-transfer rate and high selectivity to PEOA when compared with non-imprinted polymers (PEOA-NIPs). The PEOA-MIPs was expected to be used as the solid phase extraction medium and this study provides the potential applications for fast recognition and analysis of the penicilloic acid in penicillin.

  5. [Study on treatment of methylene blue wastewater by fly ash adsorption-Fenton and thermal regeneration].

    PubMed

    Bai, Yu-Jie; Zhang, Ai-Li; Zhou, Ji-Ti

    2012-07-01

    The physicochemical properties of water-washed fly ash (FA) and acid modified fly ash (M-FA) were investigated. The adsorption of methylene blue by FA and M-FA were studied by batch experiments. Two methods, Fenton-drive oxidation regeneration and thermal regeneration, were used for regeneration of the used FA and M-FA. The result showed that the rate of adsorption process followed the second order kinetics and the adsorption followed Langmuir isotherms. The adsorption equilibrium time was 30 min, and the equilibrium adsorption capacity of FA and M-FA were 4.22 mg x g(-1) and 5.98 mg x g(-1) respectively. The adsorption capability of M-FA was higher than that of FA. In the range of pH 2-12, the adsorption capacity of M-FA increased with the increase of pH, whereas the adsorption capacity of FA decreased slowly until the pH 8 and then increased. Electrostatic adsorption was the major factor on the adsorption capacity. Around 61% and 55% percentage regeneration (PR) were obtained for FA and M-FA respectively when 78.4 mmol x L(-1) H2O2 and 0.72 mmol x L(-1) Fe2+ were used. When the condition of thermal regeneration was 400 degrees C and 2 h, a positive correlation can be found between the PRs of FA and regeneration times, the PRs were 102%, 104% and 107% in three cycles of adsorption-thermal regeneration process. However a negative correlation can be found between the PRs of M-FA and regeneration times, the PRs were 82%, 75% and 74% in three cycles of adsorption-thermal regeneration process. The PR of FA was higher than that of M-FA, and thermal regeneration was superior to Fenton-drive regeneration.

  6. Three model space experiments on chemical reactions. [Gibbs adsorption, equilibrium shift and electrodeposition

    NASA Technical Reports Server (NTRS)

    Grodzka, P.; Facemire, B.

    1977-01-01

    Three investigations conducted aboard Skylab IV and Apollo-Soyuz involved phenomena that are of interest to the biochemistry community. The formaldehyde clock reaction and the equilibrium shift reaction experiments conducted aboard Apollo Soyuz demonstrate the effect of low-g foams or air/liquid dispersions on reaction rate and chemical equilibrium. The electrodeposition reaction experiment conducted aboard Skylab IV demonstrate the effect of a low-g environment on an electrochemical displacement reaction. The implications of the three space experiments for various applications are considered.

  7. Phosphate adsorption performance of a novel filter substrate made from drinking water treatment residuals.

    PubMed

    Wang, Wendong; Ma, Cui; Zhang, Yinting; Yang, Shengjiong; Shao, Yue; Wang, Xiaochang

    2016-07-01

    Phosphate is one of the most predominant pollutants in natural waters. Laboratory experiments were conducted to investigate the phosphate adsorption performance of a (NFS) made from drinking water treatment residuals. The adsorption of phosphate on the NFS fitted well with the Freundlich isotherm and pseudo second-order kinetic models. At pH7.0, the maximum adsorption capacity of 1.03mg/g was achieved at 15°C corresponding to the wastewater temperature in cold months, and increased notably to 1.31mg/g at 35°C. Under both acidic conditions (part of the adsorption sites was consumed) and basic conditions (negative charges formed on the surface of NFS, which led to a static repulsion of PO4(3-) and HPO4(2-)), the adsorption of phosphate was slightly inhibited. Further study showed that part of the adsorption sites could be recovered by 0.25mol/L NaOH. The activation energy was calculated to be above 8.0kJ/mol, indicating that the adsorption of phosphate on NFS was probably a chemical process. Considering the strong phosphate adsorption capacity and recoverability, NFS showed great promise on enhancing phosphate removal from the secondary treated wastewater in the filtration process.

  8. Adsorption of Ag, Cu and Hg from aqueous solutions using expanded perlite.

    PubMed

    Ghassabzadeh, Hamid; Mohadespour, Ahmad; Torab-Mostaedi, Meisam; Zaheri, Parisa; Maragheh, Mohammad Ghannadi; Taheri, Hossein

    2010-05-15

    The aim of the present work was to investigate the ability of expanded perlite (EP) to remove of silver, copper and mercury ions from aqueous solutions. Batch adsorption experiments were carried out and the effect of pH, adsorbent dosage, contact time and temperature of solution on the removal process has been investigated. The optimum pH for the adsorption was found to be 6.5. Adsorption of these metal ions reached their equilibrium concentration in 120, 240 and 180 min for Ag (I), Cu (II) and Hg (II) ions, respectively. Experimental data were also evaluated in terms of kinetic characteristics of adsorption and it was found that adsorption process for these metal ions followed well pseudo-second-order kinetics. Using Langmuir isotherm model, maximum adsorption capacity of EP was found to be 8.46, 1.95 and 0.35 mg/g for Ag (I), Cu (II) and Hg (II) ions, respectively. Finally, the thermodynamic parameters including, the change of free energy (DeltaG degrees ), enthalpy (DeltaH degrees ) and entropy (DeltaS degrees ) of adsorption were calculated for each metal ion. The results showed that the adsorption of these metal ions on EP was feasible and exothermic at 20-50 degrees C.

  9. Adsorption of Cd(II) by two variable-charge soils in the presence of pectin.

    PubMed

    Wang, Ru-Hai; Zhu, Xiao-Fang; Qian, Wei; Zhao, Min-Hua; Xu, Ren-Kou; Yu, Yuan-Chun

    2016-07-01

    Batch experiments were conducted to investigate cadmium(II) (Cd(II)) adsorption by two variable-charge soils (an Oxisol and an Ultisol) as influenced by the presence of pectin. When pectin dosage was less than 30 g kg(-1), the increase in Cd(II) adsorption with the increasing dose of pectin was greater than that when the pectin dosage was >30 g kg(-1). Although both Langmuir and Freundlich equations fitted the adsorption isotherms of Cd(II) and electrostatic adsorption data of Cd(II) by the two soils well, the Langmuir equation showed a better fit. The increase in the maximum total adsorption of Cd(II) induced by pectin was almost equal in both the soils, whereas the increase in the maximum electrostatic adsorption of Cd(II) was greater in the Oxisol than in the Ultisol because the former contained greater amounts of free Fe/Al oxides than the latter, which, in turn, led to a greater increase in the negative charge on the Oxisol. Therefore, the presence of pectin induced the increase in Cd(II) adsorption by the variable-charge soils mainly through the electrostatic mechanism. Pectin increased the adsorption of Cd(II) by the variable-charge soils and thus decreased the activity and mobility of Cd(II) in these soils.

  10. Adsorption of a Textile Dye on Commercial Activated Carbon: A Simple Experiment to Explore the Role of Surface Chemistry and Ionic Strength

    ERIC Educational Resources Information Center

    Martins, Angela; Nunes, Nelson

    2015-01-01

    In this study, an adsorption experiment is proposed using commercial activated carbon as adsorbent and a textile azo dye, Mordant Blue-9, as adsorbate. The surface chemistry of the activated carbon is changed through a simple oxidation treatment and the ionic strength of the dye solution is also modified, simulating distinct conditions of water…

  11. Phosphate adsorption on lanthanum loaded biochar.

    PubMed

    Wang, Zhanghong; Shen, Dekui; Shen, Fei; Li, Tianyu

    2016-05-01

    To attain a low-cost and high-efficient phosphate adsorbent, lanthanum (La) loaded biochar (La-BC) prepared by a chemical precipitation method was developed. La-BC and its pristine biochar (CK-BC) were comparatively characterized using zeta potential, BET surface area, scanning electron microscopy/energy dispersive spectrometer (SEM-EDS), X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS) and Fourier transform infrared spectroscopy (FT-IR). The adsorption ability and the mechanisms during adsorption process for the La-BC samples were also investigated. La loaded on the surface of biochar can be termed as La-composites (such as LaOOH, LaONO3 and La(OH)3), leading to the decrease of negative charge and surface area of biochar. La-BC exhibited the high adsorption capacity to phosphate compared to CK-BC. Adsorption isotherm and adsorption kinetic studies showed that the Langmuir isotherm and second order model could well describe the adsorption process of La-BC, indicating that the adsorption was dominated by a homogeneous and chemical process. The calculated maximum adsorption capacity was as high as 46.37 mg g(-1) (computed in P). Thermodynamic analysis revealed that the adsorption was spontaneous and endothermic. SEM, XRD, XPS and FT-IR analysis suggested that the multi-adsorption mechanisms including precipitation, ligand exchange and complexation interactions can be evidenced during the phosphate adsorption process by La-composites in La-BC.

  12. Adsorption of organic chemicals in soils.

    PubMed Central

    Calvet, R

    1989-01-01

    This paper presents a review on adsorption of organic chemicals on soils sediments and their constituents. The first part of this review deals with adsorption from gas and liquid phases and gives a discussion on the physical meaning of the shape of adsorption isotherms. Results show that no general rules can be proposed to describe univocally the relation between the shape of isotherms and the nature of adsorbate-adsorbent system. Kinetics of adsorption is discussed through the description of various models. Theoretical developments exist both for the thermodynamics and the kinetics of adsorption, but there is a strong need for experimental results. Possible adsorption mechanisms are ion exchange, interaction with metallic cations, hydrogen bonds, charge transfers, and London-van der Waals dispersion forces/hydrophobic effect. However, direct proofs of a given mechanism are rare. Several factors influence adsorption behavior. Electronic structure of adsorbed molecules, properties of adsorbents, and characteristics of the liquid phase are discussed in relation to adsorption. Such properties as water solubility, organic carbon content of adsorbing materials, and the composition of the liquid phase are particularly important. Evaluation of adsorption can be obtained through either laboratory measurements or use of several correlations. Adsorption measurements must be interpreted, taking into account treatment of adsorbent materials, experimental conditions, and secondary phenomena such as degradations. Correlations between adsorption coefficients and water-octanol partition coefficient or water solubility are numerous. They may be useful tools for prediction purposes. Relations with transport, bioavailability, and degradation are described. PMID:2695323

  13. Competitive adsorption of Pb and Cd on bacteria-montmorillonite composite.

    PubMed

    Du, Huihui; Chen, Wenli; Cai, Peng; Rong, Xingmin; Feng, Xionghan; Huang, Qiaoyun

    2016-11-01

    The characteristics and mechanisms of competitive adsorption of trace metals on bacteria-associated clay mineral composites have never been studied, despite their being among the most common organic-mineral complexes in geological systems. Herein, competitive adsorption of Pb and Cd on Pseudomonas putida-montmorillonite composite was investigated through adsorption-desorption experiment, isothermal titration calorimetry (ITC), and synchrotron micro X-ray fluorescence (μ-XRF). From the experiment, stronger competition was observed on clay mineral than on bacteria-clay composite because more non-specific sites accounted for heavy metal adsorption on clay mineral surface at the studied pH 5. Both competing heavy metals tended to react with bacterial fractions in the composite, which was verified by the higher correlation of Cd (and Pb) with Zn (R(2) = 0.41) elemental distribution than with Si (R(2) = 0.10). ITC results showed that competitive adsorption exhibited a lower entropy change (ΔS) at the metal-sorbent interfaces compared with single-metal adsorption, revealing that Cd and Pb are bound to the same types of adsorption sites on the sorbent. The competitive effect on bacteria-clay composite was found to be helpful for a better understanding on the fixation, remobilization and subsequent migration of heavy metals in multi-metal contaminated environments.

  14. [Adsorption of methylene blue from water by the biochars generated from crop residues].

    PubMed

    Xu, Ren-Kou; Zhao, An-Zhen; Xiao, Shuang-Cheng; Yuan, Jin-Hua

    2012-01-01

    Biochars were prepared from straws of rice, peanut and soybean and rice hull using a low temperature pyrolysis method and adsorption of methylene blue by these biochars were investigated with batch and leaching experiments. Results indicated that biochars have high adsorption capacity for methylene blue and followed the order: rice straw char > soybean straw char > peanut straw char > rice hull char. This order is generally consistent with the amount of negative charge and specific surface area of these biochars. While methylene blue was mainly adsorbed specifically by the biochars, because the adsorption of methylene blue increased with the increase of ionic strength and the adsorption led to the shift of zeta potential of biochar particles to positive value direction. Langmuir equation fitted the adsorption isotherms well and can be used to describe the adsorption behaviors of methylene blue by the biochars. The maximum adsorption capacity of methylene blue predicted by langmuir equation was 196.1, 169.5, 129.9 and 89.3 mmol x kg(-1) for rice straw char, soybean straw char, peanut straw char and rice hull char, respectively. Leaching experiments show that rice hull char of 156 g can remove methylene blue from 30 L water containing 0.3 mmol x L(-1) of methylene blue completely and the cumulative amount of methylene blue absorbed by the biochar reaches 57.7 mmol x kg(-1). The biochars can be used as efficient adsorbents to remove methylene blue from waste water of dye.

  15. A combined QCM and XPS investigation of asphaltene adsorption on metal surfaces.

    PubMed

    Rudrake, Amit; Karan, Kunal; Horton, J Hugh

    2009-04-01

    To investigate asphaltene-metal interactions, a combined quartz crystal microbalance (QCM) and X-ray photoelectron spectroscopy (XPS) study of asphaltene adsorption on a gold surface was conducted. Adsorption experiments were conducted at 25 degrees C with solutions of asphaltenes in toluene at concentrations ranging from 50 to 1500 ppm. QCM measurements yielded information on the kinetics of adsorption and further assessment of the data allowed the estimation of equilibrium adsorption levels. XPS analysis of adsorbed and bulk asphaltene demonstrated the presence of carboxylic, thiophenic, sulfide, pyridinic and pyrrolic type functional groups. The intensity of the main carbon (C-H) peak was related to surface coverage of adsorbed asphaltene as a function of asphaltene concentration by a simple mathematical model. The mass adsorption data from the QCM experiments also allowed estimation of the surface coverage, which was compared to those from XPS analyses. Surface coverage estimates as a function of asphaltene concentration could be described by a Langmuir (type-I) isotherm. The free energy of asphaltene adsorption was estimated to be -26.8+/-0.1 and -27.3+/-0.1 kJ/mol from QCM and XPS data, respectively assuming asphaltene molar mass of 750 g/gmol. QCM and XPS data was also analyzed to estimate adsorbed layer thickness after accounting for surface coverage. The thickness of the adsorbed asphaltene estimated from both XPS and QCM data analyses ranged from 6-8 nm over the entire range of adsorption concentrations investigated.

  16. Evaluation of vermicompost as a raw natural adsorbent for adsorption of pesticide methylparathion.

    PubMed

    Mendes, Camila Bitencourt; Lima, Giovana de Fátima; Alves, Vanessa Nunes; Coelho, Nívia Maria Melo; Dragunski, Douglas Cardoso; Tarley, César Ricardo Teixeira

    2012-01-01

    The assessment of vermicompost (VC) as a low-cost and alternative adsorbent for the removal of the pesticide methylparathion (MP) from an aqueous medium has been investigated by batch and column experiments. Parameters related to MP adsorption, i.e. equilibrium time (61.5 min) and adsorption pH (6.8) were optimized by using Doehlert design. The initial and final MP concentrations after adsorption assays were determined by square-wave adsorptive cathodic stripping voltammetry using an electrode composed of a multiwalled carbon nanotube dispersed in mineral oil. Batch adsorption experimental data were fitted to the Langmuir and Freundlich isotherm adsorptions, and a very good fit to the Langmuir linear model, giving a maximum adsorption capacity (MAC) of 0.17 mg g(-1). This result was very similar to that obtained with the column experiments. In order to evaluate the MP desorption from column packed VC, 100.0 ml of nitric acid solution (pH 3.0) has been percolated through material. No leaching of MP was observed, thus confirming the strong interaction between MP and VC. The satisfactory MAC obtained and low cost makes the VC a reliable natural material for the removal of MP from aqueous effluents.

  17. Selective adsorption behavior of Cd(II) ion imprinted polymers synthesized by microwave-assisted inverse emulsion polymerization: Adsorption performance and mechanism.

    PubMed

    Zhu, Fang; Li, Luwei; Xing, Junde

    2017-01-05

    Microwave-assisted inverse emulsion polymerization method was used to prepare Cd(II) imprinted polymer (IIP) by using β-cyclodextrin (β-CD) and acrylamide (AM) as functional monomer, epichlorohydrin (ECH) as crossing-linking agent, ammonium persulfate as initiator. The Cd(II) imprinted polymer was characterized by SEM, FTIR and TGA. The influences of initial concentration of Cd(II), pH values, temperature, time and competitive ions on adsorption capacity and recognition properties are investigated. Under the optimal conditions, the adsorption capacity could reach 107mg/g. Furthermore, pseudo first order kinetic model, pseudo second order kinetic model and intra-particular diffusion model were used to describe the adsorption kinetic behavior. Results showed that the pseudo-second-order model (R(2) 0.9928-0.9961) had the best agreement with the experimental data. Langmuir adsorption isotherm model described the experimental data well, which indicated that adsorption was mainly monolayer absorption. Moreover, the study of adsorption thermodynamics (ΔG(0)<0, ΔH(0)>0, ΔS(0)>0) suggested that the adsorption process was a spontaneous and endothermic process. Competitive selectivity experiment revealed that imprinted polymer could selectively recognize Cd(II). It provides a new idea for removing Cd(II) from aqueous solution.

  18. Enhanced adsorption of methylene blue by citric acid modification of biochar derived from water hyacinth (Eichornia crassipes).

    PubMed

    Xu, Yan; Liu, Yunguo; Liu, Shaobo; Tan, Xiaofei; Zeng, Guangming; Zeng, Wei; Ding, Yang; Cao, Weicheng; Zheng, Bohong

    2016-12-01

    In this work, a novel potential adsorbent, citric acid (CA)-modified biochar, named as CAWB, was obtained from water hyacinth biomass by slow pyrolysis in a N2 environment at 300 °C. The CA modification focused on enhancing the contaminants adsorption capacity of biochar pyrolyzed at relatively low temperature. Over 90 % of the total methylene blue (MB) could be removed at the first 60 min by CAWB, and the maximum MB adsorption capacity could reach to 395 mg g(-1). The physicochemical properties of CAWB was examined by FTIR, XPS, SEM, and BET analysis. The results indicated that the additional carboxyl groups were introduced to the surface of CAWB via the esterification reaction with CA, which played a significant role in the adsorption of MB. Batch adsorption studies showed that the initial MB concentration, solution pH, background ionic strength, and temperature could affect the removal efficiency obviously. The adsorption process could be well described by the pseudo-second-order kinetic model and Langmuir isotherm. Thermodynamic analysis revealed that the MB adsorption onto CAWB was an endothermic and spontaneous process. The regeneration study revealed that CAWB still exhibited an excellent regeneration and adsorption performance after multiple cycle adsorptions. The adsorption experiments of actual dye wastewater by CAWB suggested that it had a great potential in environmental application.

  19. Highly enhanced adsorption for the removal of Hg(II) from aqueous solution by Mercaptoethylamine/Mercaptopropyltrimethoxysilane functionalized vermiculites.

    PubMed

    Tran, Lytuong; Wu, Pingxiao; Zhu, Yajie; Yang, Lin; Zhu, Nengwu

    2015-05-01

    Vermiculites modified with Mercaptoethylamine (MEA) and 3-Mercaptopropyltrimethoxysilane (MPTMS) were used as effective adsorbents for the removal of Hg(II) from aqueous solution. The physicochemical characteristics of the pristine and functionalized vermiculites were analyzed by XRD, BET, FTIR, SEM, TEM and Zeta potentials, confirming that the vermiculite was successfully functionalized by the organic ligands containing the thiol (SH) metal-chelating groups. Batch adsorption experiments demonstrated that the factors such as initial pH, contact time, temperature, coexisting cations and initial Hg(II) concentration could significantly influence the adsorption behaviors typically for VER and MEA-VER, whereas the adsorption capacity of MPTMS-VER showed negligible dependence on such factors. The maximum adsorption capacity of Hg(II) ions was greatly improved after functionalization, which was in the order of MPTMS-VER>MEA-VER>VER (286.29 μg g(-1), 176.33 μg g(-1), 99.95 μg g(-1), respectively). The adsorption isotherm could be well described with Langmuir model and the kinetic studies indicated that the adsorption process fitted well with the pseudo-second-order model. The calculated thermodynamic parameters suggested that the adsorption process was feasible and spontaneous. The adsorption mechanism of Hg(II) on thiol groups was studied through XPS analysis. Considering the favorable adsorption capacities, thiol-functionalized vermiculites show a promising application in the removal of Hg(II) from wastewater.

  20. Comparing the removal of perchlorate when using single-walled carbon nanotubes (SWCNTs) or granular activated carbon: adsorption kinetics and thermodynamics.

    PubMed

    Lou, Jie C; Hsu, Yung S; Hsu, Kai L; Chou, Ming S; Han, Jia Y

    2014-01-01

    This study aims to remove perchlorate using single-walled carbon nanotubes (SWCNTs) or granular activated carbon (GAC). Dynamic and equilibrium adsorption experiments were performed to evaluate the thermodynamic behavior of perchlorate on SWCNTs and GAC. Key parameters affecting the adsorption, such as pH, ionic strength, and temperature were studied. The experimental results showed that the dynamic adsorption experiment achieved equilibrium in approximately eight hours. The adsorption capacity increased as the concentration of perchlorate increased or as the ionic strength decreased. The selected adsorption models were the modified Freundlich, the pseudo-1st-order, and the pseudo-2nd-order equations. The results showed that the modified Freundlich equation best described the kinetic adsorption processes. The maximal adsorption capacities of GAC and SWCNTs were 33.87-28.21 mg/g and 13.64 - 10.03 mg/g, respectively, at a constant temperature between 5°C and 45°C. The thermodynamic parameters, such as the equilibrium constant (K0 ), the standard free energy changes (ΔG°), the standard enthalpy change (ΔH°) and the standard entropy change (ΔS°), were obtained. The results of the isothermal equilibrium adsorption experiment showed that low pH levels, low ionic strength, and low-temperature conditions facilitated the perchlorate adsorption, indicating that GAC and SWCNTs are potential absorbents for water treatment.

  1. Adsorption of heavy metal cations by Na-clinoptilolite: equilibrium and selectivity studies.

    PubMed

    Mihaly-Cozmuta, L; Mihaly-Cozmuta, A; Peter, A; Nicula, C; Tutu, H; Silipas, Dan; Indrea, Emil

    2014-05-01

    This paper summarizes the conclusions of experiments conducted on the adsorption of Cd(2+), Co(2+), Cu(2+), Mn(2+), Ni(2+), Pb(2+) and Zn(2+) onto zeolite. The focus of the experiments was to establish the influence of the initial pH of the contact solution as well as the selectivity of zeolite on the efficiency of the adsorption process. To this end, experimental adsorption isotherms were established for the pH values ranging from 1 to 4 by using the Na-form of clinoptilolite (particle size range 0.5-1 mm) as an adsorbent. Langmuir, Freundlich and Dubinin-Raduschkevich isotherm models were used to validate the experimental data and the Gibbs free energy was calculated based on the distribution coefficient. From the Langmuir model, correlations between the maximum adsorption capacity and selected physical-chemical parameters of the cations studied were established. The results of the experiments suggest that the selectivity of zeolite is strongly influenced by the pH of the contact solution, dehydration energy of cations, diffusion coefficient and the pH at which the precipitation of hydroxides occurs.

  2. Adsorption of etheramine on kaolinite: a cheap alternative for the treatment of mining effluents.

    PubMed

    Magriotis, Zuy M; Leal, Paulo V B; Sales, Priscila F; Papini, Rísia M; Viana, Paulo R M

    2010-12-15

    The results of laboratory experiments aimed at determining the influence of physicochemical parameters on the adsorption of etheramine (adsorbate) on white, pink and yellow kaolinites (adsorbent) are presented. The adsorption of etheramine was favoured at pH 10.0 under conditions where the initial concentration of etheramine was 200 mg l(-1) and the ratio of adsorbent to volume of etheramine solution was 1:100 g ml(-1). Equilibrium adsorption was attained within 30 min and the efficiencies of removal of etheramine by white, pink and yellow kaolinite were 77%, 80% and 69%, respectively. The adsorption isotherms of the kaolinites were determined under optimum conditions and with adsorbate in the concentration range of 0-4000 mg l(-1). The amounts of etheramine adsorbed per unit mass of adsorbent were 33.03, 34.32 and 23.11 mg g(-1) for white, pink and yellow kaolinites, respectively. The adsorption of etheramine on kaolinites was better fitted to the Langmuir rather than the Freundlich isotherm, and could be explained by a pseudo-second-order kinetic model. It is concluded that kaolinites offer significant potential in the treatment of effluents originating from the processing of lower grade iron ores by froth flotation.

  3. Equilibrium, kinetic and thermodynamic studies of mercury adsorption on almond shell.

    PubMed

    Khaloo, Shokooh Sadat; Matin, Amir Hossein; Sharifi, Sahar; Fadaeinia, Masoumeh; Kazempour, Narges; Mirzadeh, Shaghayegh

    2012-01-01

    The application of almond shell as a low cost natural adsorbent to remove Hg(2+) from aqueous solution was investigated. Batch experiments were carried out to evaluate the adsorption capacity of the material. The chemical and physical parameters such as pH, sorbent amount, initial ion concentration, and contact time were optimized for the maximum uptake of mercury onto the solid surface. Adsorption isotherms were expressed by Langmuir and Freundlich adsorption models, and the experimental data were found to fit the Langmuir model rather than the Freundlich. The maximum adsorption capacity obtained from the Langmuir isotherm was 135.13 mg/g. A kinetic study was carried out with pseudo-first-order and pseudo-second-order reaction equations and it was found that the Hg(2+) uptake process followed the pseudo-second-order rate expression. The thermodynamic values, ΔG(0), ΔH(0) and ΔS(0), indicated that adsorption was an endothermic and spontaneous process. The potential of this material for mercury elimination was demonstrated by efficient Hg(2+) removal from a synthetic effluent.

  4. Adsorption of dyes on carbon nanomaterials from aqueous solutions.

    PubMed

    Rodríguez, A; Ovejero, G; Sotelo, J L; Mestanza, M; García, J

    2010-10-01

    The removal of methylene blue (MB), a cationic dye and orange II (OII), an anionic dye, from aqueous solution by using carbon nanomaterials as multiwalled carbon nanotubes (MWNTs) and carbon nanofibers (CNF) as adsorbents was studied in batch experiments. The effect of pH, temperature and surface modification of adsorbent on the removal of MB and OII was also investigated. The removals of OII and MB by adsorption on MWNT were maximum at pH 3.0 and pH 7.0, respectively. However, in the case CNF was employed as adsorbent, the optimum values of pH were 9.0 and 5.0 for OII and MB, respectively. Langmuir and Freundlich isotherms are applied to fit the adsorption data of both dyes. Equilibrium data were well described by the typical Langmuir adsorption isotherm. Overall, the study demonstrated that MWNTs and CNFs can effectively remove cationic and anionic dyes as MB and OII from aqueous solutions under these experimental conditions.

  5. Mesoporous carbon adsorbents from melamine-formaldehyde resin using nanocasting technique for CO2 adsorption.

    PubMed

    Goel, Chitrakshi; Bhunia, Haripada; Bajpai, Pramod K

    2015-06-01

    Mesoporous carbon adsorbents, having high nitrogen content, were synthesized via nanocasting technique with melamine-formaldehyde resin as precursor and mesoporous silica as template. A series of adsorbents were prepared by varying the carbonization temperature from 400 to 700°C. Adsorbents were characterized thoroughly by nitrogen sorption, X-ray diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM), thermogravimetric analysis (TGA), elemental (CHN) analysis, Fourier transform infrared (FTIR) spectroscopy and Boehm titration. Carbonization temperature controlled the properties of the synthesized adsorbents ranging from surface area to their nitrogen content, which play major role in their application as adsorbents for CO2 capture. The nanostructure of these materials was confirmed by XRD and TEM. Their nitrogen content decreased with an increase in carbonization temperature while other properties like surface area, pore volume, thermal stability and surface basicity increased with the carbonization temperature. These materials were evaluated for CO2 adsorption by fixed-bed column adsorption experiments. Adsorbent synthesized at 700°C was found to have the highest surface area and surface basicity along with maximum CO2 adsorption capacity among the synthesized adsorbents. Breakthrough time and CO2 equilibrium adsorption capacity were investigated from the breakthrough curves and were found to decrease with increase in adsorption temperature. Adsorption process for carbon adsorbent-CO2 system was found to be reversible with stable adsorption capacity over four consecutive adsorption-desorption cycles. From three isotherm models used to analyze the equilibrium data, Temkin isotherm model presented a nearly perfect fit implying the heterogeneous adsorbent surface.

  6. Effect of Na+ impregnated activated carbon on the adsorption of NH4(+)-N from aqueous solution.

    PubMed

    Shi, Mo; Wang, Zhengfang; Zheng, Zheng

    2013-08-01

    Two kinds of activated carbons modified by Na+ impregnation after pre-treatments involving oxidation by nitric acid or acidification by hydrochloric acid (denoted as AC/N-Na and AC/HCl-Na, respectively), were used as adsorbents to remove NH4(+)-N. The surface features of samples were investigated by BET, SEM, XRD and FT-IR. The adsorption experiments were conducted in equilibrium and kinetic conditions. Influencing factors such as initial solution pH and initial concentration were investigated. A possible mechanism was proposed. Results showed that optimal NH4(+)-N removal efficiency was achieved at a neutral pH condition for the modified ACs. The Langmuir isotherm adsorption equation provided a better fit than other models for the equilibrium study. The adsorption kinetics followed both the pseudo second-order kinetics model and intra-particle kinetic model. Chemical surface analysis indicated that Na+ ions form ionic bonds with available surface functional groups created by pre-treatment, especially oxidation by nitric acid, thus increasing the removal efficiency of the modified ACs for NH4(+)-N. Na(+)-impregnated ACs had a higher removal capability in removing NH4(+)-N than unmodified AC, possibly resulting from higher numbers of surface functional groups and better intra-particle diffusion. The good fit of Langmuir isotherm adsorption to the data indicated the presence of monolayer NH4(+)-N adsorption on the active homogenous sites within the adsorbents. The applicability of pseudo second-order and intra-particle kinetic models revealed the complex nature of the adsorption mechanism. The intra-particle diffusion model revealed that the adsorption process consisted not only of surface adsorption but also intra-particle diffusion.

  7. Protein adsorption using novel carboxymethyl-curdlan microspheres.

    PubMed

    Rafigh, Sayyid Mahdi; Vaziri Yazdi, Ali; Safekordi, Ali Akbar; Heydari Nasab, Amir; Ardjmand, Mehdi; Naderi, Fereshteh; Mozafari, Hamid

    2016-06-01

    Carboxymethyl-curdlan as a water soluble curdlan derivative, was synthesized in an aqueous alkaline medium using monochloroacetic acid. Novel carboxymethyl-curdlan (CC) microspheres were prepared by the method of W/O/W emulsion. The chemical and morphological structures of CC microspheres were investigated by scanning electron microscopy (SEM), Fourier-transform infrared spectroscopy (FTIR) and particle size analysis. The CC microspheres were spherical, free flowing, non-aggregated and uniform mono-disperse with diameter of 260μm. The prepared CC microspheres were applied to adsorbing Bovine serum albumin (BSA) as model protein. Factors influencing the adsorption of BSA such as solution pH, temperature, initial BSA concentration and ionic strength were examined by batch experiments. The maximum adsorption capacity was calculated as 168mg/g under optimal conditions including BSA initial concentration (4mg/mL), pH (4.7), adsorption time (9h) and temperature (35°C). The adsorption isotherm followed the Langmuir model and the adsorption kinetics fitted the pseudo-second-order model. In addition, the CC microspheres can be also regenerated and re-used.

  8. Competitive adsorption of furfural and phenolic compounds onto activated carbon in fixed bed column.

    PubMed

    Sulaymon, Abbas H; Ahmed, Kawther W

    2008-01-15

    For a multicomponent competitive adsorption of furfural and phenolic compounds, a mathematical model was builtto describe the mass transfer kinetics in a fixed bed column with activated carbon. The effects of competitive adsorption equilibrium constant, axial dispersion, external mass transfer, and intraparticle diffusion resistance on the breakthrough curve were studied for weakly adsorbed compound (furfural) and strongly adsorbed compounds (parachlorophenol and phenol). Experiments were carried out to remove the furfural and phenolic compound from aqueous solution. The equilibrium data and intraparticle diffusion coefficients obtained from separate experiments in a batch adsorber, by fitting the experimental data with theoretical model. The results show that the mathematical model includes external mass transfer and pore diffusion using nonlinear isotherms and provides a good description of the adsorption process for furfural and phenolic compounds in a fixed bed adsorber.

  9. Dynamic behaviour of Cd2+ adsorption in equilibrium batch studies by CaCO3(-)-rich Corbicula fluminea shell.

    PubMed

    Ismail, Farhah Amalya; Aris, Ahmad Zaharin; Latif, Puziah Abdul

    2014-01-01

    This work presents the structural and adsorption properties of the CaCO3(-)-rich Corbicula fluminea shell as a natural and economic adsorbent to remove Cd ions from aqueous solutions under batch studies. Experiments were conducted with different contact times, various initial concentrations, initial solution pH and serial biosorbent dosage to examine the dynamic characterization of the adsorption and its influence on Cd uptake capacity. The characterization of the C. fluminea shell using SEM/EDX revealed that the adsorbent surface is mostly impregnated by small particles of potentially calcium salts. The dominant Cd adsorption mechanism is strongly pH and concentration dependent. A maximum Cd removal efficiency of 96.20% was obtained at pH 7 while the optimum adsorbent dosage was observed as 5 g/L. The Langmuir isotherm was discovered to be more suitable to represent the experimental equilibrium isotherm results with higher correlation coefficients (R(2) > 0.98) than Freundlich (R(2) < 0.97).The correlation coefficient values (p < 0.01) indicated the superiority of the Langmuir isotherm over the Freundlich isotherm.

  10. Accurate Treatment of Electrostatics during Molecular Adsorption in Nanoporous Crystals without Assigning Point Charges to Framework Atoms

    SciTech Connect

    Watanabe, Taku; Manz, Thomas A.; Sholl, David S.

    2011-02-28

    Molecular simulations have become an important complement to experiments for studying gas adsorption and separation in crystalline nanoporous materials. Conventionally, these simulations use force fields that model adsorbate-pore interactions by assigning point charges to the atoms of the adsorbent. The assignment of framework charges always introduces ambiguity because there are many different choices for defining point charges, even when the true electron density of a material is known. We show how to completely avoid such ambiguity by using the electrostatic potential energy surface (EPES) calculated from plane wave density functional theory (DFT). We illustrate this approach by simulating CO2 adsorption in four metal-organic frameworks (MOFs): IRMOF-1, ZIF-8, ZIF-90, and Zn(nicotinate)2. The resulting CO2 adsorption isotherms are insensitive to the exchange-correlation functional used in the DFT calculation of the EPES but are sensitive to changes in the crystal structure and lattice parameters. Isotherms computed from the DFT EPES are compared to those computed from several point charge models. This comparison makes possible, for the first time, an unbiased assessment of the accuracy of these point charge models for describing adsorption in MOFs. We find an unusually high Henry’s constant (109 mmol/g·bar) and intermediate isosteric heat of adsorption (34.9 kJ/mol) for Zn(nicotinate)2, which makes it a potentially attractive material for CO2 adsorption applications.

  11. Accurate Treatment of Electrostatics during Molecular Adsorption in Nanoporous Crystals without Assigning Point Charges to Framework Atoms

    SciTech Connect

    Watanabe, T; Manz, TA; Sholl, DS

    2011-03-24

    Molecular simulations have become an important complement to experiments for studying gas adsorption and separation in crystalline nanoporous materials. Conventionally, these simulations use force fields that model adsorbate-pore interactions by assigning point charges to the atoms of the adsorbent. The assignment of framework charges always introduces ambiguity because there are many different choices for defining point charges, even when the true electron density of a material is known. We show how to completely avoid such ambiguity by using the electrostatic potential energy surface (EPES) calculated from plane wave density functional theory (DFT). We illustrate this approach by simulating CO(2) adsorption in four metal-organic frameworks (MOFs): IRMOF-1, ZIE-8, ZIE-90, and Zn(nicotinate)(2). The resulting CO(2) adsorption isotherms are insensitive to the exchange-correlation functional used in the DFT calculation of the EPES but are sensitive to changes in the crystal structure and lattice parameters. Isotherms computed from the DFT EPES are compared to those computed from several point charge models. This comparison makes possible, for the first time, an unbiased assessment of the accuracy of these point charge models for describing adsorption in MOFs. We find an unusually high Henry's constant (109 mmol/g.bar) and intermediate isosteric heat of adsorption (34.9 kJ/mol) for Zn(nicotinate)(2), which makes it a potentially attractive mateiial for CO(2) adsorption applications.

  12. Simultaneous reduction and adsorption for immobilization of uranium from aqueous solution by nano-flake Fe-SC.

    PubMed

    Kong, Lingjun; Zhu, Yuting; Wang, Min; Li, Zhixuan; Tan, Zhicong; Xu, Ruibin; Tang, Hongmei; Chang, Xiangyang; Xiong, Ya; Chen, Diyun

    2016-12-15

    Uranium containing radioactive wastewater is seriously hazardous to the natural environment if it is being discharged directly. Herein, nano-flake like Fe loaded sludge carbon (Fe-SC) is synthesized by carbothermal process from Fe-rich sludge waste and applied in the immobilization of uranium in aqueous. Batch isotherm and kinetic adsorption experiments are adopted to investigate the adsorption behavior of Fe-SC to uranium in aqueous. XPS analyses were conducted to evaluate the immobilized mechanism. It was found that the carbonized temperature played significant role in the characteristics and immobilization ability of the resulted Fe-SC. The Fe-SC-800 carbonized at 800°C takes more advantageous ability in immobilization of uranium from aqueous than the commercial available AC and powder zero valent iron. The adsorption behavior could be fitted well with the Langmuir isotherm adsorption model and pseudo-second order model. The equilibrium adsorption amount and rate for Fe-SC-800 is high to 148.99mgg(-1) and 0.015gmg(-1)min(-1), respectively. Both reductive precipitation and physical adsorption are the main mechanisms of immobilization of uranium from aqueous by Fe-SC-800.

  13. [Effect of SDS on the adsorption of Cd2+ onto amphoteric modified bentonites].

    PubMed

    Wang, Jian-Tao; Meng, Zhao-Fu; Yang, Ya-Ti; Yang, Shu-Ying; Li, Bin; Xu, Shao-e

    2014-07-01

    Under different modified ratios, temperatures, pH and ionic strengths, the effect of sodium dodecyl sulfonate (SDS) on the adsorption of Cd2+ onto bentonites which modified with amphoteric modifier dodecyl dimethyl betaine (BS-12) was studied by batch experiments, and the adsorption mechanism was also discussed. Results showed that the adsorption of Cd2+ on amphoteric bentonites can be enhanced significantly by SDS combined modification, Cd2+ adsorption decreases in the order: BS + 150SDS (BS-12 + 150% SDS) > BS + 100SDS (BS-12 + 100% SDS) > BS +50SDS(BS-12 + 50% SDS) > BS + 25SDS (BS-12 + 25% SDS) > BS (BS-12) > CK (unmodified soil). The adsorption isotherm can be described by the Langmuir equation. The change of temperature effect from positive on CK and amphoteric bentonites to negative on BS + 150SDS bentonites is observed with an increase of SDS modified ratio. The pH has little influence on Cd2+ adsorption on bentonites. The adsorption of Cd2+ on bentonites decreases with ionic strength rise, but the effect of ionic strength can be reduced with an increase of SDS modified ratio also. The adsorption thermodynamic parameters demonstrated that the adsorption of Cd2+ on modified bentonites was spontaneously controlled by entropy increment. When the SDS modified ratio is lower than 100% CEC, the adsorption of Cd2+ on modified bentonites is a process with characteristics of both enthalpy increment and entropy increment, while the SDS modified ratio is equal to or higher than 100% CEC, the adsorption of Cd2+ on modified bentonites becomes a process of enthalpy decrement and entropy increment.

  14. Prediction of equilibrium parameters of adsorption of lead (II) ions onto diatomite

    NASA Astrophysics Data System (ADS)

    Salman, Taylan; Ardalı, Yüksel; Gamze Turan, N.

    2013-04-01

    Heavy metals from industrial wastewaters are one of the most important environmental issues to be solved today. Due to their toxicity and nonbiodegradable nature, heavy metals cause environmental and public health problems. Various techniques have been developed to remove heavy metals from aqueous solutions. These include chemical precipitation, reverse osmosis, ion Exchange and adsorption. Among them, adsorption is considered to be a particularly competitive and effective process for the removal of heavy metals from aqueous solutions. There is growing interest in using low cost, commercially available materials for the adsorption of heavy metals. Diatomite is a siliceous sedimentary rock having an amorphous form of silica (SiO2. nH2O) containing a small amount of microcrystalline material. It has unique combination of physical and chemical properties such as high porosity, high permeability, small particle size, large surface area, and low thermal conductivity. In addition, it is available in Turkey and in various locations around the world. Therefore, diatomite has been successfully used as adsorbent for the removal of heavy metals. The aim of the study is to investigate the adsorption properties of diatomite. The equilibrium adsorption data were applied to the Langmuir, Freundlich and Dubinin-Radushkevic (D-R) isotherm models. Adsorption experiments were performed under batch process, using Pb (II) initial concentration, pH of solution and contact time as variables. The results demonstrated that the adsorption of Pb (II) was strongly dependent on pH of solution. The effect of pH on adsorption of Pb(II) on diatomite was conducted by varying pH from 2 to 12 at 20 oC. In the pH range of 2.0-4.0, the adsorption percentage increases slightly as the pH increasing. At pH>4, the adsorption percentage decreases with increasing pH because hydrolysis product and the precipitation begin to play an important role in the sorption of Pb (II). At pH4, the maximum adsorption

  15. Understanding H isotope adsorption and absorption of Al-alloys using modeling and experiments (LDRD: #165724)

    SciTech Connect

    Ward, Donald K.; Zhou, Xiaowang; Karnesky, Richard A.; Kolasinski, Robert; Foster, Michael E.; Thurmer, Konrad; Chao, Paul; Epperly, Ethan Nicholas; Zimmerman, Jonathan A.; Wong, Bryan M.; Sills, Ryan B.

    2015-09-01

    Current austenitic stainless steel storage reservoirs for hydrogen isotopes (e.g. deuterium and tritium) have performance and operational life-limiting interactions (e.g. embrittlement) with H-isotopes. Aluminum alloys (e.g.AA2219), alternatively, have very low H-isotope solubilities, suggesting high resistance towards aging vulnerabilities. This report summarizes the work performed during the life of the Lab Directed Research and Development in the Nuclear Weapons investment area (165724), and provides invaluable modeling and experimental insights into the interactions of H isotopes with surfaces and bulk AlCu-alloys. The modeling work establishes and builds a multi-scale framework which includes: a density functional theory informed bond-order potential for classical molecular dynamics (MD), and subsequent use of MD simulations to inform defect level dislocation dynamics models. Furthermore, low energy ion scattering and thermal desorption spectroscopy experiments are performed to validate these models and add greater physical understanding to them.

  16. [Simulation study on the effect of salinity on the adsorption behavior of mercury in wastewater-irrigated area].

    PubMed

    Zheng, Shun-An; Li, Xiao-Hua; Xu, Zhi-Yu

    2014-05-01

    This study was designed to pinpoint the impact of salinity ( NaCl and Na2SO4, added at salinity levels of 0-5%, respectively) on the adsorption behavior of mercury in wastewater-irrigated areas of Tianjin City by batch and kinetic experiments. The results showed that, the Langmuir isotherm and the Elovich equation can well fitted batch and kinetic experimental data, respectively. As NaCI spiked in soil, Hg( II) adsorption capacity and strength had marked decreases, from 868.64 mgkg-1 and 1. 32 at control to 357.48 mgkg-1 and 0.63 at 5% salinity level of NaCI, respectively. As Na2SO4 spiked in soil, Hg(II) adsorption capacity (parameter qm in Langmuir isotherm) and strength (parameter k in Langmuir isotherm) changed slightly, from 868.64 mg kg-1 and 1.32 at control to 739.44 mg.kg-1 and 1. 18 at 5% salinity level of Na2 SO4, respectively. Kinetic data showed that, Hg( II) adsorption rate (parameter b in Elovich equation) in soil was not influenced by Na2SO, addition. However, the addition of NaC1 had a great effect on mercury adsorption rate. Hg(II ) adsorption capacity as a function of CI- or SO(2-)(4) content in soil could be simulated by the natural logarithm model, while Hg( II ) adsorption rate as a function of CI- content in soil could be simulated by the linear model. The study manifested that NaCI can significantly increase migration of Hg( II ) in the soil irrigated with wastewater, which may enhance Hg( II) bioavailability in the soil and cause a hazard to surface water. Especially, it will be harmful to human body through the food chain.

  17. Adsorption modeling for macroscopic contaminant dispersal analysis