Equilibrium solubility of CO{sub 2} in aqueous solutions of 1-amino-2-propanol as function of concentration, temperature, and pressure

Energy Technology Data Exchange (ETDEWEB)

Rebolledo-Morales, Miguel Angel; Rebolledo-Libreros, Maria Esther [Instituto Mexicano del Petroleo, Direccion de Investigacion y Posgrado, Programa de Ingenieria Molecular, Area de Investigacion de Termofisica, Eje Central Lazaro Cardenas Norte 152, 07730 Mexico, D.F. (Mexico); Trejo, Arturo, E-mail: atrejo@imp.m [Instituto Mexicano del Petroleo, Direccion de Investigacion y Posgrado, Programa de Ingenieria Molecular, Area de Investigacion de Termofisica, Eje Central Lazaro Cardenas Norte 152, 07730 Mexico, D.F. (Mexico)

2011-05-15

Research highlights: Gas solubility of CO{sub 2} in aqueous solutions of 1-amino-2-propanol was measured. Solubility increases as pressure and concentration of 1-amino-2-propanol increase. The Kent-Eisenberg model was used to correlate all the experimental results. Aqueous solutions of MIPA are an excellent alternative to use in gas purification. - Abstract: Using a dynamic method with recirculation of the vapour phase, experimental values for the gas solubility of carbon dioxide in aqueous solutions of 1-amino-2-propanol (MIPA) were measured at T = (313.15 and 393.15) K, over the pressure range of (0.2 to 2436.4) kPa. The concentrations of the studied aqueous MIPA solutions were (0.20, 0.30, 0.40, and 0.50) mass fraction. The results of gas solubility are given as the partial pressure of CO{sub 2}, p{sub CO{sub 2}}, against its mole ratio, {alpha}{sub CO{sub 2}} (mol CO{sub 2} {center_dot} mol{sup -1} MIPA), and its mole fraction, x{sub CO{sub 2}}. It is observed that the solubility of CO{sub 2} increases as the concentration of MIPA in solution increases, at a given temperature throughout the pressure range considered; also the solubility values increase, under constant temperature, as the pressure increases in the studied concentration range of MIPA. The physicochemical model of Kent and Eisenberg was used to correlate simultaneously all the experimental results of the solubility of CO{sub 2} in the studied aqueous solutions of MIPA. The model correlates satisfactorily the experimental results. The deviation for pressure was 96.9 kPa using 62 experimental solubility points. The solubility results of carbon dioxide presented in this work are compared with those reported in the literature for aqueous solutions of monoethanolamine (MEA), diethanolamine (DEA), diisopropanolamine (DIPA), and N-methyldiethanolamine (MDEA) and it is possible to conclude that the aqueous solutions of MIPA are an excellent alternative to use in gas purification processes, since the

Solubility of Two Vegetable Oils in Supercritical CO2

Czech Academy of Sciences Publication Activity Database

Sovová, Helena; Zarevúcka, Marie; Vacek, Miroslav; Stránský, Karel

2001-01-01

Roč. 20, č. 1 (2001), s. 15-28 ISSN 0896-8446 R&D Projects: GA ČR GA203/99/1457; GA ČR GA203/98/1445 Institutional research plan: CEZ:AV0Z4072921 Keywords : vegetable oil * supercritical CO2 * solubility Subject RIV: CI - Industrial Chemistry, Chemical Engineering Impact factor: 1.975, year: 2001

Phase equilibrium of (CO2 + 1-aminopropyl-3-methylimidazolium bromide + water) electrolyte system and effects of aqueous medium on CO2 solubility: Experiment and modeling

International Nuclear Information System (INIS)

Chen, Ying; Guo, Kaihua; Bi, Yin; Zhou, Lan

2017-01-01

Highlights: • Phase and chemical equilibrium data for (CO 2 + [APMIm]Br + H 2 O) electrolyte system. • A modified eNRTL model for CO 2 solubility in the amino-based IL aqueous solution. • Effects of aqueous medium on both chemical and physical dissolution of CO 2 . • The correlative coefficient, R s ∗ , for the Henry’s constant of the solution. • New parameters for the segments interaction and the chemical equilibrium constants. - Abstract: New experimental data for solubility of carbon dioxide (CO 2 ) in the aqueous solution of 1-aminopropyl-3-methylimidazolium bromide ([APMIm]Br) with four different water mass fractions (0.559, 0.645, 0.765 and 0.858) at T = (278.15–348.15) K with an interval of T = 10 K and p = (0.1237–6.9143) MPa were presented. The electrolyte nonrandom two-liquid (eNRTL) model was modified to be applicable for an ionic liquid (IL) aqueous solution system, by introducing an idle factor β to illustrate the association effect of IL molecules. A solution Henry’s constant for CO 2 solubility in the IL aqueous solution was defined by introducing a correlative coefficient R s ∗ . The vapor-liquid phase equilibrium of the [APMIm]Br-H 2 O-CO 2 ternary system was successfully calculated with the modified eNRTL model. The chemical and physical mechanisms for the ionized CO 2 formation and the molecular CO 2 dissolved in the solution were identified. The effects of aqueous medium on both chemical and physical dissolution of CO 2 in the [APMIm]Br aqueous solution were studied, and a considerable enhancement of the solubility of CO 2 with increase of the water content in the solution was observed.

INEXPENSIVE CO{sub 2} THICKENING AGENTS FOR IMPROVED MOBILITY CONTROL OF CO{sub 2} FLOODS

Energy Technology Data Exchange (ETDEWEB)

Robert M. Enick; Eric J. Beckman; Andrew Hamilton

2004-10-01

The objective of this research was the design, synthesis and evaluation of inexpensive, nonfluorous carbon dioxide thickening agents. We followed the same strategy employed in the design of fluorinated CO{sub 2} polymeric thickeners. First, a highly CO{sub 2}-philic, hydrocarbon-based monomer was to be identified. Polymers or oligomers of this monomer were then synthesized. The second step was to be completed only when a CO{sub 2}-soluble polymer that was soluble in CO{sub 2} at pressures comparable to the MMP was identified. In the second step, viscosity-enhancing associating groups were to be incorporated into the polymer to make it a viable thickener that exhibited high CO{sub 2} solubility at EOR MMP conditions. This final report documents the CO{sub 2} solubility of a series of commercial and novel polymers composed of carbon, hydrogen, oxygen and, in some cases, nitrogen.

Inexpensive CO2 Thickening Agents for Improved Mobility Control of CO2 Floods

Energy Technology Data Exchange (ETDEWEB)

Robert Enick; Eric Beckman; Andrew Hamilton

2005-08-31

The objective of this research was the design, synthesis and evaluation of inexpensive, non-fluorous carbon dioxide thickening agents. We followed the same strategy employed in the design of fluorinated CO{sub 2} polymeric thickeners. First, a highly CO{sub 2}-philic, hydrocarbon-based monomer was to be identified. Polymers or oligomers of this monomer were then synthesized. The second step was to design a CO{sub 2}-thickener based on these CO{sub 2}-philic polymers. Two types of thickeners were considered. The first was a copolymer in which the CO{sub 2}-philic monomer was combined with a small proportion of CO{sub 2}-phobic associating groups that could cause viscosity-enhancing intermolecular interactions to occur. The second was a small hydrogen-bonding compound with urea groups in the core to promote intermolecular interactions that would cause the molecules to 'stack' in solution while the arms were composed of the CO{sub 2}-philic oligomers. Although we were not able to develop a viable thickener that exhibited high enough CO{sub 2} solubility at EOR MMP conditions to induce a viscosity increase, we made significant progress in our understanding of CO{sub 2}-soluble compounds that can be used in subsequent studies to design CO{sub 2}-soluble thickeners or CO{sub 2}-soluble surfactant-based foaming agents. These findings are detailed in this final report. In summary, we assessed many polymers and verified that the most CO{sub 2}-soluble oxygenated hydrocarbon polymer is poly(vinyl acetate), PVAc. This is primarily due to the presence of both ether and carbonyl oxygens associated with acetate-rich compounds. In addition to polymers, we also made small acetate-rich molecules that were also capable of associating in solution via the inclusion of hydrogen-bonding groups in hopes of forming viscosity-enhancing macromolecules. Despite the presence of multiple acetate groups in these compounds, which can impart incredible CO{sub 2}-solubility to many

CO{sub 2} solubility in brines of sedimentary basins. Application to CO{sub 2} sequestration (greenhouse gas); Solubilite de CO{sub 2} dans les saumures des bassins sedimentaires. Application au stockage de CO{sub 2} (gaz a effet de serre)

Energy Technology Data Exchange (ETDEWEB)

Portier, S.

2005-04-01

Large scale combustion of fossil energy leads today to a production of 20 billions tons of CO{sub 2} annually. This increases continuously the CO{sub 2} concentration in the atmosphere, responsible of the observed climatic increase of the temperature since one century. One of the most acceptable solutions consists in the so called CO{sub 2} sequestration in natural geological formations. The control of the process and the prediction of the final quantity of CO{sub 2} trapped in the deep saline aquifers depend on the knowledge of the solubility of acid gas in natural brines in the in situ temperature and pressure conditions. The possible dissolution of acid gases in aqueous phases brings a new complexity, owing to the fact that they behave like electrolytes in aqueous mediums A thermodynamic model for CO{sub 2} solubility is presented. The vapour phase is described by a cubic state equation. The aqueous phase is described by apparent constants of CO{sub 2} dissolution and dissociation, adjusted on literature data. This model is validated by measurements of the British Geological Survey (CO{sub 2} sequestration at Sleipner oil field, North Sea). The results of this study made it possible to calculate the impact of a CO{sub 2} injection on the solubility of calcite by acidification of formation water. The consequences in terms of CO{sub 2} storage capacity of deep saline aquifers are estimated. (author)

Spectroscopy, modeling and computation of metal chelate solubility in supercritical CO2. 1998 annual progress report

International Nuclear Information System (INIS)

Brennecke, J.F.; Chateauneuf, J.E.; Stadtherr, M.A.

1998-01-01

'This report summarizes work after 1 year and 8 months (9/15/96-5/14/98) of a 3 year project. Thus far, progress has been made in: (1) the measurement of the solubility of metal chelates in SC CO 2 with and without added cosolvents, (2) the spectroscopic determination of preferential solvation of metal chelates by cosolvents in SC CO 2 solutions, and (3) the development of a totally reliable computational technique for phase equilibrium computations. An important factor in the removal of metals from solid matrices with CO 2 /chelate mixtures is the equilibrium solubility of the metal chelate complex in the CO 2 .'

A thermodynamic model for the solubility of NpO2(am) in the aqueous K+-HCO3--CO32--OH--H2O system

International Nuclear Information System (INIS)

Rai, D.; Hess, N.J.; Felmy, A.R.; Moore, D.A.; Yui, M.

1999-01-01

Solubility of NpO 2 (am) was determined in the aqueous K + -HCO 3 - -CO 3 2- -OH - -H 2 O system extending to high concentrations of carbonate, bicarbonate, and mixed carbonate-hydroxide. Several reducing agents (Fe powder, Na 2 S 2 O 4 , NH 2 . NH 2 , and NH 2 OH . HCl) were tested for their effectiveness to maintain neptunium in the tetravalent state. Of these reducing agents, Na 2 S 2 O 4 was found to be the most effective. Even in the presence of Na 2 S 2 O 4 , significant oxidation of Np(IV) to Np(V) occurred in samples containing relatively low concentrations of carbonate/bicarbonate, relatively high concentrations of hydroxide, and samples equilibrated for relatively long periods. X-ray absorption spectroscopy (XAS) and solvent extraction were used to identify aqueous species and oxidation states and to help select appropriate data sets for thermodynamic interpretations. The dominant aqueous species in CO 3 2- and relatively concentrated HCO 3 - solutions was found by XAS to be Np(CO 3 ) 5 6- . Solubility of NpO 2 (am) in carbonate and bicarbonate solutions increased dramatically with increasing molal concentrations (carbonate >0.1 moles per kg H 2 O (m) and bicarbonate >0.01 m), indicating that carbonate makes strong complexes with Np(IV). The dominant Np(IV)-carbonate species that reasonably described all of the experimental data were Np(CO 3 ) 5 6- in low to high concentrations of carbonate and hydroxide and in high concentrations of bicarbonate, and Np(OH) 2 (CO 3 ) 2 2- in low concentrations of bicarbonate. The logarithm of the thermodynamic equilibrium constants for the NpO 2 (am) dissolution reactions involving these species [(NpO 2 (am) + 5 CO 3 2- + 4 H + Np(CO 3 ) 3 6- + 2 H 2 O) and (NpO 2 (am) + 2 HCO 3 - Np(OH) 2 (CO 3 ) 2 2- )] were found to be 34.85 and -4.44, respectively. These values, when combined with the solubility product of NpO 2 (am) [log K Sp = -54.9 [1, and recent unpublished data from Rai et al.

Improving co-amorphous drug formulations by the addition of the highly water soluble amino acid proline

DEFF Research Database (Denmark)

Jensen, Katrine Birgitte Tarp; Löbmann, Korbinian; Rades, Thomas

2014-01-01

Co-amorphous drug amino acid mixtures were previously shown to be a promising approach to create physically stable amorphous systems with the improved dissolution properties of poorly water-soluble drugs. The aim of this work was to expand the co-amorphous drug amino acid mixture approach...... by combining the model drug, naproxen (NAP), with an amino acid to physically stabilize the co-amorphous system (tryptophan, TRP, or arginine, ARG) and a second highly soluble amino acid (proline, PRO) for an additional improvement of the dissolution rate. Co-amorphous drug-amino acid blends were prepared...... the molecular interactions in the form of hydrogen bonds between all three components in the mixture. A salt formation between the acidic drug, NAP, and the basic amino acid, ARG, was found in co-amorphous NAP–ARG. In comparison to crystalline NAP, binary NAP–TRP and NAP–ARG, it could be shown that the highly...

Determination of calcium salt solubility with changes in pH and P(CO(2)), simulating varying gastrointestinal environments.

Science.gov (United States)

Goss, Sandra L; Lemons, Karen A; Kerstetter, Jane E; Bogner, Robin H

2007-11-01

The amount of calcium available for absorption is dependent, in part, on its sustained solubility in the gastrointestinal (GI) tract. Many calcium salts, which are the calcium sources in supplements and food, have pH-dependent solubility and may have limited availability in the small intestine, the major site of absorption. The equilibrium solubility of four calcium salts (calcium oxalate hydrate, calcium citrate tetrahydrate, calcium phosphate, calcium glycerophosphate) were determined at controlled pH values (7.5, 6.0, 4.5 and solubility of calcium carbonate was also measured at pH 7.5, 6.0 and 4.5 with two CO(2) environments (0.3 and 152 mmHg) above the solution. The precipitation profile of CaCO(3) was calculated using in-vivo data for bicarbonate and pH from literature and equilibrium calculations. As pH increased, the solubility of each calcium salt increased. However, in distilled water each salt produced a different pH, affecting its solubility value. Although calcium citrate does have a higher solubility than CaCO(3) in water, there is little difference when the pH is controlled at pH 7.5. The partial pressure of CO(2) also played a role in calcium carbonate solubility, depressing the solubility at pH 7.5. The calculations of soluble calcium resulted in profiles of available calcium, which agreed with previously published in-vivo data on absorbed calcium. The experimental data illustrate the impact of pH and CO(2) on the solubility of many calcium salts in the presence of bicarbonate secretions in the intestine. Calculated profiles using in-vivo calcium and bicarbonate concentrations demonstrate that large calcium doses may not further increase intestinal calcium absorption once the calcium carbonate solubility product has been reached.

Carbonate mineral solubility at low temperatures in the Na-K-Mg-Ca-H-Cl-SO 4-OH-HCO 3-CO 3-CO 2-H 2O system

Science.gov (United States)

Marion, Giles M.

2001-06-01

Carbonate minerals have played an important role in the geochemical evolution of Earth, and may have also played an important role in the geochemical evolution of Mars and Europa. Several models have been published in recent years that describe chloride and sulfate mineral solubilities in concentrated brines using the Pitzer equations. Few of these models are parameterized for subzero temperatures, and those that are do not include carbonate chemistry. The objectives of this work are to estimate Pitzer-equation bicarbonate-carbonate parameters and carbonate mineral solubility products and to incorporate them into the FREZCHEM model to predict carbonate mineral solubilities in the Na-K-Mg-Ca-H-Cl-SO 4-OH-HCO 3-CO 3-CO 2-H 2O system at low temperatures (≤25°C) with a special focus on subzero temperatures. Most of the Pitzer-equation parameters and equilibrium constants are taken from the literature and extrapolated into the subzero temperature range. Solubility products for 14 sodium, potassium, magnesium, and calcium bicarbonate and carbonate minerals are included in the model. Most of the experimental data are at temperatures ≥ -8°C; only for the NaHCO 3-NaCl-H 2O and Na 2CO 3-NaCl-H 2O systems are there bicarbonate and carbonate data to temperatures as low as -21.6°C. In general, the fit of the model to the experimental data is good. For example, calculated eutectic temperatures and compositions for NaHCO 3, Na 2CO 3, and their mixtures with NaCl and Na 2SO 4 salts are in good agreement with experimental data to temperatures as low as -21.6°C. Application of the model to eight saline, alkaline carbonate waters give predicted pHs ranging from 9.2 to 10.2, in comparison with measured pHs that range from 8.7 to 10.2. The model suggests that the CaCO 3 mineral that precipitates during seawater freezing is probably calcite and not ikaite. The model demonstrates that a proposed salt assemblage for the icy surface of Europa consisting of highly hydrated MgSO 4

High-pressure solubility of carbon dioxide in pyrrolidinium-based ionic liquids: [bmpyr][dca] and [bmpyr][Tf{sub 2}N

Energy Technology Data Exchange (ETDEWEB)

Lee, Byung-Chul; Nam, Sang Gyu [Hannam University, Daejeon (Korea, Republic of)

2015-03-15

Solubility data of carbon dioxide (CO{sub 2}) in two pyrrolidinium-based ionic liquids: 1-butyl-1-methylpyrrolidinium dicyanamide ([bmpyr][dca]) and 1-butyl-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)imide ([bmpyr] [Tf{sub 2}N]) are presented at pressures up to about 30MPa and temperatures from 303..2 K to 343.2 K. The solubility was determined by measuring bubble or cloud point pressures of mixtures of CO{sub 2} and ionic liquid using a high-pressure equilibrium apparatus equipped with a variable-volume view cell. The CO{sub 2} solubility in the ionic liquid in terms of the mole fraction or the molality increased with the increase of the equilibrium pressure at a given temperature, but decreased with the increase of temperature at a given pressure. At a given temperature, the mole fraction of CO{sub 2} dissolved in the ionic liquid increased rapidly as pressure increased. CO{sub 2} solubility in the mole fraction almost reached saturation around 0.65 for [bmpyr][dca] and around 0..8 for [bmpyr][Tf{sub 2}N], respectively. The experimental data for the CO{sub 2}+ionic liquid systems were correlated using the Peng-Robinson equation of state (PR-EoS). The mixing rules of the Wong-Sandler type rather than the classical mixing rules of the van der Waals type were coupled with the PR-EoS. The resulting modeling approach proved to be able to correlate the CO{sub 2} solubilities in aforementioned ionic liquids over the aforementioned range of temperature and pressure within 5% average deviations.

High-Pressure Phase Equilibria in Systems Containing CO2 and Ionic Liquid of the [Cnmim][Tf2N] Type

OpenAIRE

Sedláková, Z. (Zuzana); Wagner, Z. (Zdeněk)

2012-01-01

In this review, we present a comparison of the high-pressure phase behaviour of binary systems constituted of CO2 and ionic liquids of the [Cn(m)mim][Tf2N] type. The comparative study shows that the solubility of CO2 in ionic liquids of the [Cnmim][Tf2N] type generally increases with increasing pressure and decreasing temperature, but some peculiarities have been observed. The solubility of CO2 in ionic liquid solvents was correlated using the Soave–Redlich–Kwong equation of state. The result...

PC-SAFT modeling of CO2 solubilities in hydrophobic deep eutectic solvents

NARCIS (Netherlands)

Dietz, C.H.J.T.; van Osch, D.J.G.P.; Kroon, M.C.; Sadowski, G.; van Sint Annaland, M.; Gallucci, F.; Zubeir, L.F.; Held, C.

2017-01-01

The PC-SAFT 'pseudo-pure' approach was used for the modeling of CO2 solubilities in various hydrophobic deep eutectic solvents (DESs) for the first time. Only liquid density data were used to obtain the segment number, the temperature-independent segment diameter and the dispersion-energy parameter,

Modeling solubility of CO2/hydrocarbon gas in ionic liquid ([emim][FAP]) using Aspen Plus simulations.

Science.gov (United States)

Bagchi, Bishwadeep; Sati, Sushmita; Shilapuram, Vidyasagar

2017-08-01

The Peng-Robinson equation of state with quadratic van der Waals (vdW) mixing rule model was chosen to perform the thermodynamic calculations in Flash3 column of Aspen Plus to predict the solubility of CO 2 or any one of the hydrocarbons (HCs) among methane, ethane, propane, and butane in an ionic liquid 1-ethyl-3-methylimidazolium tris(pentafluoroethyl)trifluorophosphate ([emim][FAP]). Bubble point pressure, solubility, bubble point temperature, fugacity, and partial molar volume at infinite dilution were obtained from the simulations, and enthalpy of absorption, Gibbs free energy of solvation, and entropy change of absorption were estimated by thermodynamic relations. Results show that carbon chain length has a significant effect on the bubble point pressure. Methane has the highest bubble point pressure among all the considered HCs and CO 2 . The bubble point pressure and fugacity variation with temperature is different for CO 2 as compared to HCs for mole fractions above 0.2. Two different profiles are noticed for enthalpy of absorption when plotted as a function of mole fraction of gas soluble in IL. Partial molar volume of CO 2 decreases with increase in temperature in [emim][FAP], while it is increased for HCs. Bubble point temperature decreases with increase in the mole fraction of the solute. Entropy of solvation increases with temperature till a particular value followed by a decrease with further increase in temperature. Gibbs free energy change of solvation showed that the process of solubility was spontaneous.

Residual and Solubility trapping during Geological CO2 storage : Numerical and Experimental studies

OpenAIRE

Rasmusson, Maria

2018-01-01

Geological storage of carbon dioxide (CO2) in deep saline aquifers mitigates atmospheric release of greenhouse gases. To estimate storage capacity and evaluate storage safety, knowledge of the trapping mechanisms that retain CO2 within geological formations, and the factors affecting these is fundamental. The objective of this thesis is to study residual and solubility trapping mechanisms (the latter enhanced by density-driven convective mixing), specifically in regard to their dependency on ...

Vertically averaged approaches for CO 2 migration with solubility trapping

KAUST Repository

Gasda, S. E.

2011-05-20

The long-term storage security of injected carbon dioxide (CO2) is an essential component of geological carbon sequestration operations. In the postinjection phase, the mobile CO2 plume migrates in large part because of buoyancy forces, following the natural topography of the geological formation. The primary trapping mechanisms are capillary and solubility trapping, which evolve over hundreds to thousands of years and can immobilize a significant portion of the mobile CO2 plume. However, both the migration and trapping processes are inherently complex, spanning multiple spatial and temporal scales. Using an appropriate model that can capture both large- and small-scale effects is essential for understanding the role of these processes on the long-term storage security of CO2 sequestration operations. Traditional numerical models quickly become prohibitively expensive for the type of large-scale, long-term modeling that is necessary for characterizing the migration and immobilization of CO2 during the postinjection period. We present an alternative modeling option that combines vertically integrated governing equations with an upscaled representation of the dissolution-convection process. With this approach, we demonstrate the effect of different modeling choices for typical large-scale geological systems and show that practical calculations can be performed at the temporal and spatial scales of interest. Copyright 2011 by the American Geophysical Union.

Measurement and correlation of antifungal drugs solubility in pure supercritical CO{sub 2} using semiempirical models

Energy Technology Data Exchange (ETDEWEB)

Yamini, Yadollah, E-mail: yyamini@modares.ac.ir [Department of Chemistry, Faculty of Sciences, Tarbiat Modares University, P.O. Box 14115-175, Tehran (Iran, Islamic Republic of); Moradi, Morteza [Department of Chemistry, Faculty of Sciences, Tarbiat Modares University, P.O. Box 14115-175, Tehran (Iran, Islamic Republic of)

2011-07-15

Highlights: > Ketoconazole (KZ) and clotrimazole (CZ) are two antifungal drugs. > The solubilities of KZ and CZ were measured in supercritical CO{sub 2}. > The experimental results were correlated using five density based models. > The heats' of drug-CO{sub 2} solvation and drug vaporization were estimated. - Abstract: In the present study the solubilities of two antifungal drugs of ketoconazole and clotrimazole in supercritical carbon dioxide were measured using a simple static method. The experimental data were measured at (308 to 348) K, over the pressure range of (12.2 to 35.5) MPa. The mole fraction solubilities ranged from 0.2 . 10{sup -6} to 17.45 . 10{sup -5}. In this study five density based models were used to calculate the solubility of drugs in supercritical carbon dioxide. The density based models are Chrastil, modified Chrastil, Bartle, modified Bartle and Mendez-Santiago and Teja (M-T). Interaction parameters for the studied models were obtained and the percentage of average absolute relative deviation (AARD%) in each calculation was displayed. The correlation results showed good agreement with the experimental data. A comparison among the five models revealed that the Bartle and its modified models gave much better correlations of the solubility data with an average absolute relative deviation (AARD%) ranging from 4.8% to 6.2% and from 4.5% to 6.3% for ketoconazole and clotrimazole, respectively. Using the correlation results, the heat of drug-CO{sub 2} solvation and that of drug vaporization was separately approximated in the range of (-22.1 to -26.4 and 88.3 to 125.9) kJ . mol{sup -1}.

The solubility of rhodochrosite (MnCO3) and siderite (FeCO3) in anaerobic aquatic environments

DEFF Research Database (Denmark)

Jensen, Dorthe Lærke; Boddum, J.K.; Tjell, Jens Christian

2002-01-01

Natural groundwaters are often reported to be highly supersaturated with the carbonate minerals siderite (FeCO3) and rhodochrosite (MnCO3). The kinetics of precipitation and dissolution were determined in the light of new determinations of the solubility products of siderite and rhodochrosite...... steady state for rhodochrosite was reached after 140 days. Suspensions of siderite and rhodochrosite crystals reached steady state after 10 and 80 days, respectively. The solubility product of siderite (log KS0(FeCO3)) was 11.03 0.10 for dried crystals and 10.43 0.15 for wet crystals. For rhodochrosite...... the solubility product (log KS0(MnCO3)) was 11.39 0.14 for dried crystals and 12.51 0.07 for wet crystals. The solubility product determined from supersaturated solutions was log KS0(MnCO3)=11.65 0.14. The observed slow precipitation kinetics of siderite and rhodochrosite might explain the apparent...

Geothermal-brine modeling - prediction of mineral solubilities in natural waters: the Na-K-Mg-Ca-H-Cl-SO{sub 4}-OH-HCO{sub 3} CO{sub 3}-CO{sub 2}-H{sub 2}O system to high ionic strengths at 25{sup 0}C

Energy Technology Data Exchange (ETDEWEB)

Weare, J.H.

1981-01-01

The mineral solubility model of Harvie and Weare (1980) is extended to the eight component system, Na-K-Ca-Mg-H-Cl-SO{sub 4}-OH-HCO{sub 3}-CO{sub 3}-CO{sub 2}-H{sub 2}O at 25{sup 0}C to high concentrations. The model is based on the semi-empirical equations of Pitzer (1973) and co-workers for the thermodynamics of aqueous electrolyte solutions. The model is parameterized using many of the available isopiestic, electromotive force, and solubility data available for many of the subsystems. The predictive abilities of the model are demonstrated by comparison to experimental data in systems more complex than those used in parameterization. The essential features of a chemical model for aqueous electrolyte solutions and the relationship between pH and the equilibrium properties of a solution are discussed.

Catholyte-Free Electrocatalytic CO2 Reduction to Formate.

Science.gov (United States)

Lee, Wonhee; Kim, Young Eun; Youn, Min Hye; Jeong, Soon Kwan; Park, Ki Tae

2018-04-16

Electrochemical reduction of carbon dioxide (CO 2 ) into value-added chemicals is a promising strategy to reduce CO 2 emission and mitigate climate change. One of the most serious problems in electrocatalytic CO 2 reduction (CO 2 R) is the low solubility of CO 2 in an aqueous electrolyte, which significantly limits the cathodic reaction rate. This paper proposes a facile method of catholyte-free electrocatalytic CO 2 reduction to avoid the solubility limitation using commercial tin nanoparticles as a cathode catalyst. Interestingly, as the reaction temperature rises from 303 K to 363 K, the partial current density (PCD) of formate improves more than two times with 52.9 mA cm -2 , despite the decrease in CO 2 solubility. Furthermore, a significantly high formate concentration of 41.5 g L -1 is obtained as a one-path product at 343 K with high PCD (51.7 mA cm -2 ) and high Faradaic efficiency (93.3 %) via continuous operation in a full flow cell at a low cell voltage of 2.2 V. © 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Skeletal mineralogy of coral recruits under high temperature and pCO2

Science.gov (United States)

Foster, T.; Clode, P. L.

2016-03-01

Aragonite, which is the polymorph of CaCO3 precipitated by modern corals during skeletal formation, has a higher solubility than the more stable polymorph calcite. This higher solubility may leave animals that produce aragonitic skeletons more vulnerable to anthropogenic ocean acidification. It is therefore important to determine whether scleractinian corals have the plasticity to adapt and produce calcite in their skeletons in response to changing environmental conditions. Both high pCO2 and lower Mg / Ca ratios in seawater are thought to have driven changes in the skeletal mineralogy of major marine calcifiers in the past ˜ 540 Ma. Experimentally reduced Mg / Ca ratios in ambient seawater have been shown to induce some calcite precipitation in both adult and newly settled modern corals; however, the impact of high pCO2 on the mineralogy of recruits is unknown. Here we determined the skeletal mineralogy of 1-month-old Acropora spicifera coral recruits grown under high temperature (+3 °C) and pCO2 (˜ 900 µatm) conditions, using X-ray diffraction and Raman spectroscopy. We found that newly settled coral recruits produced entirely aragonitic skeletons regardless of the treatment. Our results show that elevated pCO2 alone is unlikely to drive changes in the skeletal mineralogy of young corals. Not having an ability to switch from aragonite to calcite precipitation may leave corals and ultimately coral reef ecosystems more susceptible to predicted ocean acidification. An important area for prospective research would be the investigation of the combined impact of high pCO2 and reduced Mg / Ca ratio on coral skeletal mineralogy.

Rapid solubility and mineral storage of CO₂ in basalt

DEFF Research Database (Denmark)

Gislason, Sigurdur R.; Broecker, W.S.; Gunnlaugsson, E.

2014-01-01

The long-term security of geologic carbon storage is critical to its success and public acceptance. Much of the security risk associated with geological carbon storage stems from its buoyancy. Gaseous and supercritical CO2 are less dense than formation waters, providing a driving force for it to ......The long-term security of geologic carbon storage is critical to its success and public acceptance. Much of the security risk associated with geological carbon storage stems from its buoyancy. Gaseous and supercritical CO2 are less dense than formation waters, providing a driving force...... for it to escape back to the surface. This buoyancy can be eliminated by the dissolution of CO2 into water prior to, or during its injection into the subsurface. The dissolution makes it possible to inject into fractured rocks and further enhance mineral storage of CO2 especially if injected into silicate rocks...... rich in divalent metal cations such as basalts and ultra-mafic rocks. We have demonstrated the dissolution of CO2 into water during its injection into basalt leading to its geologic solubility storage in less than five minutes and potential geologic mineral storage within few years after injection [1...

CO2 Capture in Ionic Liquids: A Review of Solubilities and Experimental Methods

Directory of Open Access Journals (Sweden)

Elena Torralba-Calleja

2013-01-01

Full Text Available The growing concern of climate change and global warming has in turn given rise to a thriving research field dedicated to finding solutions. One particular area which has received considerable attention is the lowering of carbon dioxide emissions from large-scale sources, that is, fossil fuel power. This paper focuses on ionic liquids being used as novel media for CO2 capture. In particular, solubility data and experimental techniques are used at a laboratory scale. Cited CO2 absorption data for imidazolium-, pyrrolidinium-, pyridinium-, quaternary-ammonium-, and tetra-alkyl-phosphonium-based ionic liquids is reviewed, expressed as mole fractions (X of CO2 to ionic liquid. The following experimental techniques are featured: gravimetric analysis, the pressure drop method, and the view-cell method.

Extended solid solubility of a Co-Cr system by mechanical alloying

Energy Technology Data Exchange (ETDEWEB)

Betancourt-Cantera, J.A. [Area Academica de Ciencias de la Tierra y Materiales, UAEH Carr. Pachuca-Tulancingo Km. 4.5, Pachuca, Hidalgo 42184 (Mexico); Sanchez-De Jesus, F., E-mail: fsanchez@uaeh.edu.mx [Area Academica de Ciencias de la Tierra y Materiales, UAEH Carr. Pachuca-Tulancingo Km. 4.5, Pachuca, Hidalgo 42184 (Mexico); Torres-Villasenor, G. [Instituto de Investigaciones en Materiales-UNAM, Apdo. Postal 70-360, 04510 Mexico, DF (Mexico); Bolarin-Miro, A.M. [Area Academica de Ciencias de la Tierra y Materiales, UAEH Carr. Pachuca-Tulancingo Km. 4.5, Pachuca, Hidalgo 42184 (Mexico); Cortes-Escobedo, C.A. [Centro de Investigacion e Innovacion Tecnologica del IPN Cda. CECATI S/N, Col. Sta. Catarina, Azcapotzalco, 02250 Mexico, DF (Mexico)

2012-07-15

Highlights: Black-Right-Pointing-Pointer Solubility of the Co-Cr system is modified by means of Mechanical Alloying (MA). Black-Right-Pointing-Pointer MA induces the formation of new solid solutions of Co-Cr system in non-equilibrium. Black-Right-Pointing-Pointer MA promote the formation of metastable Co-Cr phases with greater solubility. - Abstract: Mechanical alloying, MA, has been successfully used to extend the limits of solid solubility in many commercially important metallic systems. The aim of this work is to demonstrate that MA modifies the solid solubility of the Co-Cr system. Co and Cr elemental powders were used as precursors and mixed in an adequate weight ratio to obtain Co{sub 100-x}Cr{sub x} (0 {<=} x {<=} 100, {Delta}x = 10) to study the effect of mechanical processing in the solubility of the Co-Cr system. Processing was carried out at room temperature in a shaker mixer mill using vials and balls of hardened steel as milling media with a ball:powder weight ratio of 10:1. Crystalline structure characterization of the milled powders was conducted using X-ray diffraction, and phase transformations as a function of composition were analyzed. Thermal analysis confirmed structural changes occurred in the mechanically alloyed powders. The evolution of the phase transformations with composition is reported for each composition. The results showed that after high energy ball milling for 7 h, the solid solubility between Co and Cr could be evidently extended, despite the low solid solubility at the equilibrium conditions of this system. Additionally, the micrographs of the milled powders showed that increasing composition of chromium changes the shape and size of the particles while simultaneously reducing their agglomeration; this effect is possibly attributed to the brittleness of elemental chrome.

Full Characterization of CO2-Oil Properties On-Chip: Solubility, Diffusivity, Extraction Pressure, Miscibility, and Contact Angle.

Science.gov (United States)

Sharbatian, Atena; Abedini, Ali; Qi, ZhenBang; Sinton, David

2018-02-20

Carbon capture, storage, and utilization technologies target a reduction in net CO 2 emissions to mitigate greenhouse gas effects. The largest such projects worldwide involve storing CO 2 through enhanced oil recovery-a technologically and economically feasible approach that combines both storage and oil recovery. Successful implementation relies on detailed measurements of CO 2 -oil properties at relevant reservoir conditions (P = 2.0-13.0 MPa and T = 23 and 50 °C). In this paper, we demonstrate a microfluidic method to quantify the comprehensive suite of mutual properties of a CO 2 and crude oil mixture including solubility, diffusivity, extraction pressure, minimum miscibility pressure (MMP), and contact angle. The time-lapse oil swelling/extraction in response to CO 2 exposure under stepwise increasing pressure was quantified via fluorescence microscopy, using the inherent fluorescence property of the oil. The CO 2 solubilities and diffusion coefficients were determined from the swelling process with measurements in strong agreement with previous results. The CO 2 -oil MMP was determined from the subsequent oil extraction process with measurements within 5% of previous values. In addition, the oil-CO 2 -silicon contact angle was measured throughout the process, with contact angle increasing with pressure. In contrast with conventional methods, which require days and ∼500 mL of fluid sample, the approach here provides a comprehensive suite of measurements, 100-fold faster with less than 1 μL of sample, and an opportunity to better inform large-scale CO 2 projects.

Thermodynamic approach to improving solubility prediction of co-crystals in comparison with individual poorly soluble components

International Nuclear Information System (INIS)

Perlovich, German L.

2014-01-01

Highlights: • Thermodynamic approach for solubility improvement of co-crystal was developed. • The graphical technique for estimation of co-crystal solubility was elaborated. • Hydration enthalpies of some drugs and amino acids were calculated. • Applicability/operability of the approach was exemplified by some drugs and amino acids. - Abstract: A novel thermodynamic approach to compare poorly soluble components (active pharmaceutical ingredient (API)) both in co-crystals and individual compounds was developed. An algorithm of choosing potential co-crystals with improved solubility characteristics on the basis of the known solvation/hydration API and co-former enthalpies is described. The applicability and operability of the algorithm were tested exemplified by some drugs and amino acids

New Approach to Modeling Supercritical CO2 Extraction of Cuticular Waxes: Interplay between Solubility and Kinetics.

Czech Academy of Sciences Publication Activity Database

Sovová, Helena; Stateva, R. P.

2015-01-01

Roč. 54, č. 17 (2015), s. 4861-4870 ISSN 0888-5885 Institutional support: RVO:67985858 Keywords : n-alkanes * supercritical CO2 * solubility Subject RIV: CI - Industrial Chemistry, Chemical Engineering Impact factor: 2.567, year: 2015

Towards improved solubility of poorly water-soluble drugs: cryogenic co-grinding of piroxicam with carrier polymers.

Science.gov (United States)

Penkina, Anna; Semjonov, Kristian; Hakola, Maija; Vuorinen, Sirpa; Repo, Timo; Yliruusi, Jouko; Aruväli, Jaan; Kogermann, Karin; Veski, Peep; Heinämäki, Jyrki

2016-01-01

Amorphous solid dispersions (SDs) open up exciting opportunities in formulating poorly water-soluble active pharmaceutical ingredients (APIs). In the present study, novel catalytic pretreated softwood cellulose (CPSC) and polyvinylpyrrolidone (PVP) were investigated as carrier polymers for preparing and stabilizing cryogenic co-ground SDs of poorly water-soluble piroxicam (PRX). CPSC was isolated from pine wood (Pinus sylvestris). Raman and Fourier transform infrared (FTIR) spectroscopy, X-ray powder diffraction (XRPD) and differential scanning calorimetry (DSC) were used for characterizing the solid-state changes and drug-polymer interactions. High-resolution scanning electron microscope (SEM) was used to analyze the particle size and surface morphology of starting materials and final cryogenic co-ground SDs. In addition, the molecular aspects of drug-polymer interactions and stabilization mechanisms are presented. The results showed that the carrier polymer influenced both the degree of amorphization of PRX and stabilization against crystallization. The cryogenic co-ground SDs prepared from PVP showed an enhanced dissolution rate of PRX, while the corresponding SDs prepared from CPSC exhibited a clear sustained release behavior. In conclusion, cryogenic co-grinding provides a versatile method for preparing amorphous SDs of poorly water-soluble APIs. The solid-state stability and dissolution behavior of such co-ground SDs are to a great extent dependent on the carrier polymer used.

Molecular simulations and experimental studies of solubility and diffusivity for pure and mixed gases of H2, CO2, and Ar absorbed in the ionic liquid 1-n-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)amide ([hmim][Tf2N]).

Science.gov (United States)

Shi, Wei; Sorescu, Dan C; Luebke, David R; Keller, Murphy J; Wickramanayake, Shan

2010-05-20

Classical molecular dynamics and Monte Carlo simulations are used to calculate the self-diffusivity and solubility of pure and mixed CO(2), H(2), and Ar gases absorbed in the ionic liquid 1-n-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)amide ([hmim][Tf(2)N]). Overall, the computed absorption isotherms, Henry's law constants, and partial molar enthalpies for pure H(2) agree well with the experimental data obtained by Maurer et al. [J. Chem. Eng. Data 2006, 51, 1364] and the experimental values determined in this work. However, the agreement is poor between the simulations and the experimental data by Noble et al. [Ind. Eng. Chem. Res. 2008, 47, 3453] and Costa Gomes [J. Chem. Eng. Data 2007, 52, 472] at high temperatures. The computed H(2) permeability values are in good agreement with the experimental data at 313 K obtained by Luebke et al. [J. Membr. Sci. 2007, 298, 41; ibid, 2008, 322, 28], but about three times larger than the experimental value at 573 K from the same group. Our computed H(2) solubilities using different H(2) potential models have similar values and solute polarizations were found to have a negligible effect on the predicted gas solubilities for both the H(2) and Ar. The interaction between H(2) and the ionic liquid is weak, about three times smaller than between the ionic liquid and Ar and six times smaller than that of CO(2) with the ionic liquid, results that are consistent with a decreasing solubility from CO(2) to Ar and to H(2). The molar volume of the ionic liquid was found to be the determining factor for the H(2) solubility. For mixed H(2) and Ar gases, the solubilities for both solutes decrease compared to the respective pure gas solubilities. For mixed gases of CO(2) and H(2), the solubility selectivity of CO(2) over H(2) decreases from about 30 at 313 K to about 3 at 573 K. For the permeability, the simulated values for CO(2) in [hmim][Tf(2)N] are about 20-60% different than the experimental data by Luebke et al. [J. Membr

CO2 adsorption using TiO2 composite polymeric membranes: A kinetic study.

Science.gov (United States)

Hafeez, Sarah; Fan, X; Hussain, Arshad; Martín, C F

2015-09-01

CO2 is the main greenhouse gas which causes global climatic changes on larger scale. Many techniques have been utilised to capture CO2. Membrane gas separation is a fast growing CO2 capture technique, particularly gas separation by composite membranes. The separation of CO2 by a membrane is not just a process to physically sieve out of CO2 through the controlled membrane pore size. It mainly depends upon diffusion and solubility of gases, particularly for composite dense membranes. The blended components in composite membranes have a high capability to adsorb CO2. The adsorption kinetics of the gases may directly affect diffusion and solubility. In this study, we have investigated the adsorption behaviour of CO2 in pure and composite membranes to explore the complete understanding of diffusion and solubility of CO2 through membranes. Pure cellulose acetate (CA) and cellulose acetate-titania nanoparticle (CA-TiO2) composite membranes were fabricated and characterised using SEM and FTIR analysis. The results indicated that the blended CA-TiO2 membrane adsorbed more quantity of CO2 gas as compared to pure CA membrane. The high CO2 adsorption capacity may enhance the diffusion and solubility of CO2 in the CA-TiO2 composite membrane, which results in a better CO2 separation. The experimental data was modelled by Pseudo first-order, pseudo second order and intra particle diffusion models. According to correlation factor R(2), the Pseudo second order model was fitted well with experimental data. The intra particle diffusion model revealed that adsorption in dense membranes was not solely consisting of intra particle diffusion. Copyright © 2015. Published by Elsevier B.V.

Thermodynamic description of Tc(iv) solubility and carbonate complexation in alkaline NaHCO3-Na2CO3-NaCl systems.

Science.gov (United States)

Baumann, A; Yalçıntaş, E; Gaona, X; Polly, R; Dardenne, K; Prüßmann, T; Rothe, J; Altmaier, M; Geckeis, H

2018-03-28

The solubility of 99 Tc(iv) was investigated in dilute to concentrated carbonate solutions (0.01 M ≤ C tot ≤ 1.0 M, with C tot = [HCO 3 - ] + [CO 3 2- ]) under systematic variation of ionic strength (I = 0.3-5.0 M NaHCO 3 -Na 2 CO 3 -NaCl-NaOH) and pH m (-log[H + ] = 8.5-14.5). Strongly reducing conditions (pe + pH m ≈ 2) were set with Sn(ii). Carbonate enhances the solubility of Tc(iv) in alkaline conditions by up to 3.5 log 10 -units compared to carbonate-free systems. Solvent extraction and XANES confirmed that Tc was kept as +IV during the timeframe of the experiments (≤ 650 days). Solid phase characterization performed by XAFS, XRD, SEM-EDS, chemical analysis and TG-DTA confirmed that TcO 2 ·0.6H 2 O(am) controls the solubility of Tc(iv) under the conditions investigated. Slope analysis of the solubility data in combination with solid/aqueous phase characterization and DFT calculations indicate the predominance of the species Tc(OH) 3 CO 3 - at pH m ≤ 11 and C tot ≥ 0.01 M, for which thermodynamic and activity models are derived. Solubility data obtained above pH m ≈ 11 indicates the formation of previously unreported Tc(iv)-carbonate species, possibly Tc(OH) 4 CO 3 2- , although the likely formation of additional complexes prevents deriving a thermodynamic model valid for this pH m -region. This work provides the most comprehensive thermodynamic dataset available for the system Tc 4+ -Na + -Cl - -OH - -HCO 3 - -CO 3 2- -H 2 O(l) valid under a range of conditions relevant for nuclear waste disposal.

The use of solvent extractions and solubility theory to discern hydrocarbon associations in coal, with application to the coal-supercritical CO2 system

Science.gov (United States)

Kolak, Jonathan J.; Burruss, Robert A.

2014-01-01

Samples of three high volatile bituminous coals were subjected to parallel sets of extractions involving solvents dichloromethane (DCM), carbon disulfide (CS2), and supercritical carbon dioxide (CO2) (40 °C, 100 bar) to study processes affecting coal–solvent interactions. Recoveries of perdeuterated surrogate compounds, n-hexadecane-d34 and four polycyclic aromatic hydrocarbons (PAHs), added as a spike prior to extraction, provided further insight into these processes. Soxhlet-DCM and Soxhlet-CS2 extractions yielded similar amounts of extractable organic matter (EOM) and distributions of individual hydrocarbons. Supercritical CO2 extractions (40 °C, 100 bar) yielded approximately an order of magnitude less EOM. Hydrocarbon distributions in supercritical CO2 extracts generally mimicked distributions from the other solvent extracts, albeit at lower concentrations. This disparity increased with increasing molecular weight of target hydrocarbons. Five- and six-ring ring PAHs generally were not detected and no asphaltenes were recovered in supercritical CO2 extractions conducted at 40 °C and 100 bar. Supercritical CO2 extraction at elevated temperature (115 °C) enhanced recovery of four-ring and five-ring PAHs, dibenzothiophene (DBT), and perdeuterated PAH surrogate compounds. These results are only partially explained through comparison with previous measurements of hydrocarbon solubility in supercritical CO2. Similarly, an evaluation of extraction results in conjunction with solubility theory (Hildebrand and Hansen solubility parameters) does not fully account for the hydrocarbon distributions observed among the solvent extracts. Coal composition (maceral content) did not appear to affect surrogate recovery during CS2 and DCM extractions but might affect supercritical CO2 extractions, which revealed substantive uptake (partitioning) of PAH surrogates into the coal samples. This uptake was greatest in the sample (IN-1) with the highest vitrinite content. These

Dissolution and Solubility Enhancement of the Highly Lipophilic Drug Phenytoin via Interaction with Poly(N-isopropylacrylamide-co-vinylpyrrolidone) Excipients.

Science.gov (United States)

Widanapathirana, Lakmini; Tale, Swapnil; Reineke, Theresa M

2015-07-06

Excipients of natural or synthetic origin play an important role in pharmaceutical performance to enhance the solubility, bioavailability, release, and stability of insoluble drugs. Herein, a series of seven excipient models was prepared by both homopolymerization and copolymerization of 1-vinyl-2-pyrrolidone (VP) and N-isopropylacrylamide (NIPAAm) by free radical polymerization yielding two homopolymers poly(VP) and poly(NIPAAm) and five copolymers of poly(NIPAAm-co-VP) at difference compositions. While the VP monomer provided aqueous solubility at a variety of conditions to the excipient, the incorporation of NIPAAm into the copolymer offered additional hydrogen bond donating sites to optimize the drug-polymer interactions in the system. Due to the presence of NIPAAm, the copolymers were sensitive to temperature as well. It was found that as the proportion of VP was increased (from 0 to 100%), the lower critical solution temperature (LCST) and the water solubility of the polymer models increased. To examine the role of specific drug-polymer interactions during dissolution on drug solubility and bioavailability, the polymers were formulated with the anticonvulsant drug phenytoin, which is a poorly water-soluble BCS class II drug where oral absorption is limited by the drug solubility. Amorphous solid dispersions (ASD) were prepared via spray drying of phenytoin with the polymer excipient models to contain 10% and 25% by weight drug loading. Physical characterization of the ASDs by powder X-ray diffraction (PXRD) and differential scanning calorimetry (DSC) revealed that the polymers held the drug in a high-energy amorphous phase in all the formulations prepared. All ASDs exhibited improved in vitro dissolution rates compared to drug only and physical mixtures of the polymers and the drug. Drug solubility was the highest with the ASDs containing poly(NIPAAm-co-VP) 60:40 and 50:50, which showed a solubility enhancement of near 14-fold increase compared to pure drug

Thermodynamic modeling of neptunium(V) solubility in concentrated Na-CO3-HCO3-Cl-ClO4-H-OH-H2O systems

International Nuclear Information System (INIS)

Novak, C.F.; Roberts, K.E.

1994-01-01

Safety assessments of nuclear waste repositories often require estimation of actinide solubilities as a function of groundwater composition. Although considerable amount of research has been done on the solubility and speciation of actinides, relatively little has been done to unify these data into a model applicable to concentrate brines. Numerous authors report data on the aqueous chemical properties of Np(V) in NaClO 4 , Na 2 CO 3 , and NaCl media, but a consistent thermodynamic model for predicting these properties is not available. To meet this need, a model was developed to describe the solubility of Np(V) in Na-Cl-ClO 4 -CO 3 aqueous systems, based on the Pitzer activity coefficient formalism for concentrated electrolytes. Hydrolysis and/or carbonate complexation are the dominant aqueous reactions with neptunyl in these systems. Literature data for neptunyl extraction and solubility, and solubility data that the authors developed, are used to parameterize an integrated model for Np(V) solubility in the Np(V)-Na-CO 3 -HCO 3 -Cl-ClO 4 -H-OH-H 2 O system. The resulting model is tested against additional solubility data, and compared with Np(V) solubility experiments in complex synthetic brines

Bioinspired co-crystals of Imatinib providing enhanced kinetic solubility.

Science.gov (United States)

Reggane, Maude; Wiest, Johannes; Saedtler, Marco; Harlacher, Cornelius; Gutmann, Marcus; Zottnick, Sven H; Piechon, Philippe; Dix, Ina; Müller-Buschbaum, Klaus; Holzgrabe, Ulrike; Meinel, Lorenz; Galli, Bruno

2018-05-04

Realizing the full potential of co-crystals enhanced kinetic solubility demands a comprehensive understanding of the mechanisms of dissolution, phase conversion, nucleation and crystal growth, and of the complex interplay between the active pharmaceutical ingredient (API), the coformer and co-existing forms in aqueous media. One blueprint provided by nature to keep poorly water-soluble bases in solution is the complexation with phenolic acids. Consequently, we followed a bioinspired strategy for the engineering of co-crystals of a poorly water-soluble molecule - Imatinib - with a phenolic acid, syringic acid (SYA). The dynamics of dissolution and solution-mediated phase transformations were monitored by Nuclear Magnetic Resonance (NMR) spectroscopy, providing mechanistic insights into the 60 fold-increased long lasting concentrations achieved by the syringate co-crystals as compared to Imatinib base and Imatinib mesylate. This lasting effect was linked to SYA's ability to delay the formation and nucleation of Imatinib hydrate - the thermodynamically stable form in aqueous media - through a metastable association of SYA with Imatinib in solution. Results from permeability studies evidenced that SYA did not impact Imatinib's permeability across membranes while suggesting improved bioavailability through higher kinetic solubility at the biological barriers. These results reflect that some degree of hydrophobicity of the coformer might be key to extend the kinetic solubility of co-crystals with hydrophobic APIs. Understanding how kinetic supersaturation can be shaped by the selection of an interactive coformer may help achieving the needed performance of new forms of poorly water-soluble, slowly dissolving APIs. Copyright © 2018. Published by Elsevier B.V.

Spectroscopy, modeling and computation of metal chelate solubility in supercritical CO2. Annual progress report, September 15, 1996 - September 14, 1997

International Nuclear Information System (INIS)

Brennecke, J.F.; Chateauneuf, J.E.; Stadtherr, M.A.

1997-01-01

'This progress report contains (1) a statement of the objectives of the overall project, (2) a discussion of the results obtained during the first year of the three year grant period, (3) a summary, (4) a description of the future work that will be pursued during the next year, and (5) accounting information. This is followed by the literature cited and the pertinent tables and figures. The overall objectives of this project are to gain a fundamental understanding of the solubility and stability of metal chelates in supercritical CO 2 . Extraction with CO 2 is a excellent way to remove organic compounds from soils, sludges and aqueous solutions and recent research has demonstrated that together with chelating agents it is a viable way to remove metals, as well. The authors seek to gain fundamental knowledge that is vital to computing phase behavior, and modeling and designing processes using CO 2 to separate organics and metal compounds from DOE mixed wastes. The overall program is a comprehensive one to measure local solvation of metal chelates and to determine metal chelate stability in supercritical fluid mixtures using UV-vis and FTIR spectroscopy. The spectroscopic studies provide information on the solution microstructure, which they are using in concert with their own and published solubility data to evaluate and develop thermodynamic models of the solubility behavior. Finally, they are implementing a more reliable computational technique, based on interval mathematics, to compute the phase equilibria using the thermodynamic models. This fundamental information about metal chelate stability and solubility in supercritical CO 2 is important in the design of processes using CO 2 to extract components from mixed wastes and in determining the optimum operating conditions.'

Solubility and stability of inorganic carbonates

International Nuclear Information System (INIS)

Taylor, P.

1987-01-01

The chemistry of inorganic carbonates is reviewed, with emphasis on solubility and hydrolytic stability, in order to identify candidate waste forms for immobilization and disposal of 14 C. At present, CaCO 3 and BaCO 3 are the two most widely favoured wasted forms, primarily because they are the products of proven CO 2 -scrubbing technology. However, they have relatively high solubilities in non-alkaline solutions, necessitating care in selecting and assessing an appropriate disposal environment. Three compounds with better solubility characteristics in near-neutral waters are identified: bismutite, (BiO) 2 CO 3 ; hydrocerussite, Pb 3 (OH) 2 (CO 3 ) 2 ; and rhodochrosite, MnCO 3 . Some of the limitations of each of these alternative waste forms are discussed

Effects of experimental CO2 leakage on solubility and transport of seven trace metals in seawater and sediment.

Science.gov (United States)

Ardelan, Murat V; Steinnes, Eiliv; Lierhagen, Syverin; Linde, Sven Ove

2009-12-01

The impact of CO(2) leakage on solubility and distribution of trace metals in seawater and sediment has been studied in lab scale chambers. Seven metals (Al, Cr, Ni, Pb, Cd, Cu, and Zn) were investigated in membrane-filtered seawater samples, and DGT samplers were deployed in water and sediment during the experiment. During the first phase (16 days), "dissolved" (water. The increase in dissolved fractions of Al, Cr, Ni, Cu, Zn, Cd and Pb in the CO(2) seepage chamber was respectively 5.1, 3.8, 4.5, 3.2, 1.4, 2.3 and 1.3 times higher than the dissolved concentrations of these metals in the control. During the second phase of the experiment (10 days) with the same sediment but replenished seawater, the dissolved fractions of Al, Cr, Cd, and Zn were partly removed from the water column in the CO(2) chamber. DNi and DCu still increased but at reduced rates, while DPb increased faster than that was observed during the first phase. DGT-labile fractions (Me(DGT)) of all metals increased substantially during the first phase of CO(2) seepage. DGT-labile fractions of Al, Cr, Ni, Cu, Zn, Cd and Pb were respectively 7.9, 2.0, 3.6, 1.7, 2.1, 1.9 and 2.3 times higher in the CO(2) chamber than that of in the control chamber. Al(DGT), Cr(DGT), Ni(DGT), and Pb(DGT) continued to increase during the second phase of the experiment. There was no change in Cd(DGT) during the second phase, while Cu(DGT) and Zn(DGT) decreased by 30% and 25%, respectively in the CO(2) chamber. In the sediment pore water, DGT labile fractions of all the seven elements increased substantially in the CO(2) chamber. Our results show that CO(2) leakage affected the solubility, particle reactivity and transformation rates of the studied metals in sediment and at the sediment-water interface. The metal species released due to CO(2) acidification may have sufficiently long residence time in the seawater to affect bioavailability and toxicity of the metals to biota.

High-temperature resistivity and thermoelectric properties of coupled substituted Ca3Co2O6

Directory of Open Access Journals (Sweden)

Meenakshisundaram Senthilkumar and Rajagopalan Vijayaraghavan

2009-01-01

Full Text Available Polycrystalline samples of Ca3−xNaxCo2−xMnxO6 (x=0.0–0.5 have been prepared by the sol-gel cum combustion method using sucrose in order to investigate the effects of the coupled substitution of Na and Mn on Ca and Co sites on the transport properties of Ca3Co2O6(Co326. The products were characterized by Fourier transform infrared spectroscopy, powder x-ray diffraction (XRD, thermogravimetry (TGA, differential thermal analysis and scanning electron microscopy. XRD patterns reveal the formation of single-phase products up to x=0.5. Coupled substitution increases the solubility of both Na and Mn on Ca and Co sites, respectively, in contrast to the limited solubility of Na and Mn (x=0.2 when separately substituted. TGA confirms the formation of the Ca3Co2O6 phase at temperatures ~720 °C. The grain size of the parent and substituted products is in the range 150–250 nm. Electrical resistivity and Seebeck coefficient were measured in the temperature range 300–800 K. Resistivity shows semiconducting behavior for all the compositions, particularly in the low-temperature regime. The Seebeck coefficient increases with temperature throughout the measured temperature range for all compositions. The maximum Seebeck coefficient (200 μV K−1 is observed for x=0.5 at 825 K, and this composition may be optimal for high-temperature thermoelectric applications.

Elevated CO2-mitigation of high temperature stress associated with maintenance of positive carbon balance and carbohydrate accumulation in Kentucky bluegrass.

Science.gov (United States)

Song, Yali; Yu, Jingjin; Huang, Bingru

2014-01-01

Elevated CO2 concentration may promote plant growth while high temperature is inhibitory for C3 plant species. The interactive effects of elevated CO2 and high temperatures on C3 perennial grass growth and carbon metabolism are not well documented. Kentucky bluegrass (Poa pratensis) plants were exposed to two CO2 levels (400 and 800 μmol mol-1) and five temperatures (15/12, 20/17, 25/22, 30/27, 35/32°C, day/night) in growth chambers. Increasing temperatures to 25°C and above inhibited leaf photosynthetic rate (Pn) and shoot and root growth, but increased leaf respiration rate (R), leading to a negative carbon balance and a decline in soluble sugar content under ambient CO2. Elevated CO2 did not cause shift of optimal temperatures in Kentucky bluegrass, but promoted Pn, shoot and root growth under all levels of temperature (15, 20, 25, 30, and 35°C) and mitigated the adverse effects of severe high temperatures (30 and 35°C). Elevated CO2-mitigation of adverse effects of high temperatures on Kentucky bluegrass growth could be associated with the maintenance of a positive carbon balance and the accumulation of soluble sugars and total nonstructural carbohydrates through stimulation of Pn and suppression of R and respiratory organic acid metabolism.

CO2 Capture and Separation Properties in the Ionic Liquid 1-n-Butyl-3-Methylimidazolium Nonafluorobutylsulfonate

Directory of Open Access Journals (Sweden)

Lingyun Zhou

2014-05-01

Full Text Available Recently, the use of ionic liquids (ILs for carbon capture and separation processes has gained great interest by many researchers due to the high solubility of CO2 in ILs. In the present work, solubility measurements of CO2 in the novel IL 1-n-butyl-3-methylimidazolium nonafluorobutylsulfonate [C4mim][CF3CF2CF2CF2SO3] were performed with a high-pressure view-cell technique in the temperature range from 293.15 to 343.15 K and pressures up to about 4.2 MPa. For comparison, solubilities of H2, N2, and O2 in the IL were also measured at 323.15 K via the same procedure. The Krichevsky-Kasarnovsky equation was employed to correlate the measured solubility data. Henry’s law constants, enthalpies, and entropies of absorption for CO2 in the IL were also determined and presented. The CO2 solubility in this IL was compared with other ILs sharing the same cation. It was shown that the solubility of CO2 in these ILs follows the sequence: [C4mim][CF3CF2CF2CF2SO3] ≈ [C4mim][Tf2N] > [C4mim][CF3CF2CF2COO] > [C4mim][BF4], and the solubility selectivity of CO2 relative to O2, N2, and H2 in [C4mim][CF3CF2CF2CF2SO3] was 8, 16, and 22, respectively. Furthermore, this IL is regenerable and exhibits good stability. Therefore, the IL reported here would be a promising sorbent for CO2.

Highly CO2-Selective Gas Separation Membranes Based on Segmented Copolymers of Poly(Ethylene oxide) Reinforced with Pentiptycene-Containing Polyimide Hard Segments.

Science.gov (United States)

Luo, Shuangjiang; Stevens, Kevin A; Park, Jae Sung; Moon, Joshua D; Liu, Qiang; Freeman, Benny D; Guo, Ruilan

2016-01-27

Poly(ethylene oxide) (PEO)-containing polymer membranes are attractive for CO2-related gas separations due to their high selectivity toward CO2. However, the development of PEO-rich membranes is frequently challenged by weak mechanical properties and a high crystallization tendency of PEO that hinders gas transport. Here we report a new series of highly CO2-selective, amorphous PEO-containing segmented copolymers prepared from commercial Jeffamine polyetheramines and pentiptycene-based polyimide. The copolymers are much more mechanically robust than the nonpentiptycene containing counterparts due to the molecular reinforcement mechanism of supramolecular chain threading and interlocking interactions induced by the pentiptycene structures, which also effectively suppresses PEO crystallization leading to a completely amorphous structure even at 60% PEO weight content. Membrane transport properties are sensitively affected by both PEO weight content and PEO chain length. A nonlinear correlation between CO2 permeability with PEO weight content was observed due to the competition between solubility and diffusivity contributions, whereby the copolymers change from being size-selective to solubility-selective when PEO content reaches 40%. CO2 selectivities over H2 and N2 increase monotonically with both PEO content and chain length, indicating strong CO2-philicity of the copolymers. The copolymer film with the longest PEO sequence (PEO2000) and highest PEO weight content (60%) showed a measured CO2 pure gas permeability of 39 Barrer, and ideal CO2/H2 and CO2/N2 selectivities of 4.1 and 46, respectively, at 35 °C and 3 atm, making them attractive for hydrogen purification and carbon capture.

Leakage and Seepage of CO2 from Geologic Carbon Sequestration Sites: CO2 Migration into Surface Water

International Nuclear Information System (INIS)

Oldenburg, Curt M.; Lewicki, Jennifer L.

2005-01-01

ebullition and bubble flow will be the dominant form of gas transport in surface water for all but the smallest seepage fluxes or shallowest water bodies. The solubility of the gas species in water plays a fundamental role in whether ebullition occurs. We used a solubility model to examine CO 2 solubility in waters with varying salinity as a function of depth below a 200 m-deep surface water body. In this system, liquid CO 2 is stable between the deep regions where supercritical CO 2 is stable and the shallow regions where gaseous CO 2 is stable. The transition from liquid to gaseous CO 2 is associated with a large change in density, with corresponding large change in bubble buoyancy. The solubility of CO 2 is lower in high-salinity waters such as might be encountered in the deep subsurface. Therefore, as CO 2 migrates upward through the deep subsurface, it will likely encounter less saline water with increasing capacity to dissolve CO 2 potentially preventing ebullition, depending on the CO 2 leakage flux. However, as CO 2 continues to move upward through shallower depths, CO 2 solubility in water decreases strongly leading to greater likelihood of ebullition and bubble flow in surface water. In the case of deep density-stratified lakes in which ebullition is suppressed, enhanced mixing and man-made degassing schemes can alleviate the buildup of CO 2 and related risk of dangerous rapid discharges. Future research efforts are needed to increase understanding of CO 2 leakage and seepage in surface water and saturated porous media. For example, we recommend experiments and field tests of CO 2 migration in saturated systems to formulate bubble-driven water-displacement models and relative permeability functions that can be used in simulation models

Stem juice production of the C4 sugarcane (Saccharum officinarum) is enhanced by growth at double-ambient CO2 and high temperature.

Science.gov (United States)

Vu, Joseph C V; Allen, Leon H

2009-07-15

Two cultivars of sugarcane (Saccharum officinarum cv. CP73-1547 and CP88-1508) were grown for 3 months in paired-companion, temperature-gradient, sunlit greenhouses under daytime [CO2] of 360 (ambient) and 720 (double ambient) micromol mol(-1) and at temperatures of 1.5 degrees C (near ambient) and 6.0 degrees C higher than outside ambient temperature. Leaf area and biomass, stem biomass and juice and CO2 exchange rate (CER) and activities of ribulose bisphosphate carboxylase-oxygenase (Rubisco) and phosphoenolpyruvate carboxylase (PEPC) of fully developed leaves were measured at harvest. On a main stem basis, leaf area, leaf dry weight, stem dry weight and stem juice volume were increased by growth at doubled [CO2] or high temperature. Such increases were even greater under combination of doubled [CO2]/high temperature. Plants grown at doubled [CO2]/high temperature combination averaged 50%, 26%, 84% and 124% greater in leaf area, leaf dry weight, stem dry weight and stem juice volume, respectively, compared with plants grown at ambient [CO2]/near-ambient temperature combination. In addition, plants grown at doubled [CO2]/high temperature combination were 2-3-fold higher in stem soluble solids than those at ambient [CO2]/near-ambient temperature combination. Although midday CER of fully developed leaves was not affected by doubled [CO2] or high temperature, plants grown at doubled [CO2] were 41-43% less in leaf stomatal conductance and 69-79% greater in leaf water-use efficiency, compared with plants grown at ambient [CO2]. Activity of PEPC was down-regulated 23-32% at doubled [CO2], while high temperature did not have a significant impact on this enzyme. Activity of Rubisco was not affected by growth at doubled [CO2], but was reduced 15-28% at high temperature. The increases in stem juice production and stem juice soluble solids concentration for sugarcane grown at doubled [CO2] or high temperature, or at doubled [CO2]/high temperature combination, were partially

Phase behavior for the poly(alkyl methacrylate)+supercritical CO2+DME mixture at high pressures

International Nuclear Information System (INIS)

Choi, Yong-Seok; Chio, Sang-Won; Byun, Hun-Soo

2016-01-01

The phase behavior curves of binary and ternary system were measured for poly(alkyl methacrylate) in supercritical CO 2 , as well as for the poly(alkyl methacrylate)+dimethyl ether (DME) (or 1-butene) in CO 2 . The solubility curves are reported for the poly(alkyl methacrylate)+DME in supercritical CO 2 at temperature from (300 to 465) K and a pressure from (3.66 to 248) MPa. Also, The high-pressure static-type apparatus of cloud-point curve was tested by comparing the measured phase behavior data of the poly(methyl methacrylate) [PMMA]+CO 2 +20.0 and 30.4 wt% methyl methacrylate (MMA) system with literature data of 10.4, 28.8 and 48.4 wt% MMA concentration. The phase behavior data for the poly(alkyl methacrylate)+CO 2 +DME mixture were measured in changes of the pressure-temperature (p, T) slope and with DME concentrations. Also, the cloud-point pressure for the poly(alkyl methacrylate)+1- butene solution containing supercritical CO 2 shows from upper critical solution temperature (UCST) region to lower critical solution temperature (LCST) region at concentration range from (0.0 to 95) wt% 1-butene at below 455 K and at below 245MPa.

Model of gypsum, calcite and silica solubilities for application to geothermal waters over a wide range of temperature, P/sub CO/sub 2// and ionic strength. Final technical report, October 1, 1983-September 30, 1984

Energy Technology Data Exchange (ETDEWEB)

1984-01-01

This report describes the construction of a high temperature (25 to 250/sup 0/C), variable P/sub CO/sub 2// (1 to 40 atm), chemical model of mineral (including gypsum, calcite and amorphous silica) solubilities in the system: Na-K-Ca-H-Cl-SO/sub 4/-HCO/sub 3/-CO/sub 3/-CO/sub 2/-SiO/sub 2/-H/sub 2/O. This model was designed to support geothermal energy production needs.

A thermodynamic model for the solubility of HfO{sub 2}(am) in the aqueous K{sup +} - HCO{sub 3}{sup -} - CO{sub 3}{sup 2-} - OH{sup -} - H{sub 2}O system

Energy Technology Data Exchange (ETDEWEB)

Rai, Dhanpat [Rai Enviro-Chem, LLC, Yachats, OR (United States); Kitamura, Akira [Japan Atomic Energy Agency, Tokai (Japan); Rosso, Kevin M. [Pacific National Laboratory, Richland, WA (United States)

2017-10-01

Solubility of HfO{sub 2}(am) was determined as a function of KHCO{sub 3} concentrations ranging from 0.001 mol.kg{sup -1} to 0.1 mol.kg{sup -1}. The solubility of HfO{sub 2}(am) increased dramatically with the increase in KHCO{sub 3} concentrations, indicating that Hf(IV) makes strong complexes with carbonate. Thermodynamic equilibrium constants for the formation of Hf-carbonate complexes were determined using both the Pitzer and SIT models. The dramatic increase in Hf concentrations with the increase in KHCO{sub 3} concentrations can best be described by the formation of Hf(OH{sup -}){sub 2}(CO{sub 3}){sub 2}{sup 2-} and Hf(CO{sub 3}){sub 5}{sup 6-}. The log{sub 10} K{sup 0} values for the reactions [Hf{sup 4+}+2CO{sub 3}{sup 2-}+2OH{sup -}↔Hf(OH){sub 2}(CO{sub 3}){sub 2}{sup 2-}] and [Hf{sup 4+}+5CO{sub 3}{sup 2-}↔Hf(CO{sub 3}){sub 5}{sup 6-}], based on the SIT model, were determined to be 44.53±0.46 and 41.53±0.46, respectively, and based on the Pitzer model they were 44.56±0.48 and 40.20±0.48, respectively.

Initial solubility & density evaluation of Non-Aqueous system of amino acid salts for CO2 capture: potassium prolinate blended with ethanol and ethylene glycol

Science.gov (United States)

Murshid, Ghulam; Garg, Sahil

2018-05-01

Amine scrubbing is the state of the art technology for CO2 capture, and solvent selection can significantly reduce the capital and energy cost of the process. Higher energy requirement for aqueous amine based CO2 removal process is still a most important downside preventive its industrial deployment. Therefore, in this study, novel non-aqueous based amino acid salt system consisting of potassium prolinate, ethanol and ethylene glycol has been studied. This work presents initial CO2 solubility study and important physical properties i.e. density of the studied solvent system. Previous work showed that non-aqueous system of potassium prolinate and ethanol has good absorption rates and requires lower energy for solvent regeneration. However, during regeneration, solvent loss issues were found due to lower boiling point of the ethanol. Therefore, ethylene glycol was added into current studied system for enhancing the overall boiling point of the system. The good initial CO2 solubility and low density of studied solvent system offers several advantages as compared to conventional amine solutions.

High pressure solubility data of carbon dioxide in (tri-iso-butyl(methyl)phosphonium tosylate + water) systems

Energy Technology Data Exchange (ETDEWEB)

Ventura, Sonia P.M. [CICECO, Departamento de Quimica, Universidade de Aveiro, 3810-193 Aveiro (Portugal); Pauly, Jerome; Daridon, Jean L. [Laboratoire Haute Pression Centre Universitaire de Recherche Scientifique, Universite de Pau, Avenue de l' Universite, 64000 Pau (France); Lopes da Silva, J.A.; Marrucho, Isabel M. [CICECO, Departamento de Quimica, Universidade de Aveiro, 3810-193 Aveiro (Portugal); Dias, Ana. M.A. [IBB-Instituto de Biotecnologia e Bioengenharia, Centro de Engenharia Biologica, Universidade do Minho, Campus de Gualtar, 4710-553 Braga (Portugal); Coutinho, Joao A.P. [CICECO, Departamento de Quimica, Universidade de Aveiro, 3810-193 Aveiro (Portugal)], E-mail: jcoutinho@ua.pt

2008-08-15

Ionic liquids are attracting great attention nowadays due to their interesting properties which make them useful in a broad range of applications including reaction media or separation/capture of environmentally hazardous gases such as carbon dioxide. In many cases, for practical and/or economical reasons, the use of aqueous solutions of ILs would be preferable to their use as pure compounds. In this work, high pressure equilibrium data for the {l_brace}carbon dioxide (CO{sub 2}) + tri-iso-butyl(methyl)phosphonium tosylate [iBu{sub 3}MeP][TOS] + water system were measured at temperatures ranging from (276 to 370) K and pressures up to 100 MPa. Measurements were performed using a high-pressure cell with a sapphire window that allows direct observation of the liquid-vapour transition. Mixtures with different IL concentrations were studied in order to check the influence of the amount of IL on the solubility of CO{sub 2} in the aqueous mixture. The results show that the presence of IL enhances the solubility of CO{sub 2} in the (IL + water) system revealing a salting-in effect of the IL on the solubility of CO{sub 2}. The appearance of a three phase region was observed for IL concentrations higher than 4 mol% of IL in water when working at pressures between 4 and 8 MPa and temperatures between (280 and 305) K. In this range, the upper limit of the VLE region observed is shown to increase with the temperature being almost independent of the IL initial concentration in the mixture.

High pressure measurement and CPA equation of state for solubility of carbon dioxide and hydrogen sulfide in 1-butyl-3-methylimidazolium acetate

International Nuclear Information System (INIS)

Haghtalab, Ali; Kheiri, Alireza

2015-01-01

Highlights: • Solubility of carbon dioxide in pure [bmim][acetate] is measured. • Simultaneous solubility of CO 2 + H 2 S in [bmim][acetate] is measured. • Both physical and chemical models are applied to modelling the (acid gas + IL) systems. • The CPA EoS is used for phase equilibrium calculation. • A reaction thermodynamic equilibrium model is used in liquid phase. - Abstract: Removal of acid gases such as CO 2 and H 2 S from natural gas is essential for commercial, safety and environmental protection that demonstrate the importance of gas sweetening process. Ionic liquids (IL) have been highly demanded as a green solvent to remove acid gases from sour natural gas and capturing of CO 2 from flue gases. In this work, the solubility of CO 2 in 1-butyl-3-methylimidazolium acetate ([bmim][Ac]) is measured at temperatures (303.15, 328.15, 343.15) K and pressure range of (0.1 to 3.9) MPa. Moreover, the experiments are carried out for simultaneous measurements of (CO 2 + H 2 S) (70% + 30% on a mole basis) solubility in the same ionic liquid at T = (303.15, 323.15, 343.15) K and a pressure range of (0.1 to 2.2) MPa. To model the solubility of acid gases in IL, both physical and chemical equilibria are applied so that the (vapour + liquid) equilibrium calculation is carried out through Cubic-Plus-Association (CPA) EoS. The reaction equilibrium thermodynamic model is used in liquid phase so that the chemical reaction is taking place between IL and acid gasses. The Henry’s and reaction equilibrium constants are obtained though optimization of the solubility data. Using CPA EOS, the pure parameters of [bmim][acetate] are optimised and consequently using these parameters, gas partial pressure calculation is performed for the (CO 2 + IL) and (CO 2 + H 2 S + IL) systems. For the (CO 2 + IL) system, the percent average absolute deviation (AAD%) of 4.83 is resulted and for the (H 2 S + CO 2 + IL) system the values of 18.8 and 13.7 are obtained for H 2 S and CO 2

Co-precipitation and solubility studies of cesium, potassium and sodium tetraphenylborate

International Nuclear Information System (INIS)

Peterson, R.A.

1999-01-01

This report contains the results from a study requested by High Level Waste Division on the co-precipitation and solubility of cesium, potassium, and sodium tetraphenylborate. Co-precipitation of cesium (Cs), potassium (K), and sodium (Na) tetraphenylborate (TPB) helps determine the efficiency of reagent usage in the Small Tank Precipitation Process. This process uses NaTPB to remove cesium from waste by means of precipitation. Previous studies by McCabe suggested that if the sodium ion concentration [Na+] increased the rate at which cesium tetraphenylborate (KTPB) in the presence of high [Na+] (∼5M) appears to produce a mixed solid phase composed of NaTPB and KTPB together in the crystal lattice

Constructing robust and highly-selective hydrogel membranes by bioadhesion-inspired method for CO 2 separation

KAUST Repository

Wu, Yingzhen

2018-06-01

Water-swollen hydrogel membranes are good candidates for CO2 separations due to the favorable solubility of CO2 in water. However, the excessive amount of water often causes the poor mechanical property and low selectivity. Herein, we propose a bioadhesion-inspired method to construct robust and high-performance CO2 separation membranes via in situ generation of polydopamine (PDA) nanoaggregates within poly (vinyl alcohol) (PVA) matrix. PDA nanoaggregates entangled with PVA chains and formed hydrogen bonding with hydroxyl groups from PVA chains. Physical cross-linking occurred between PVA chains and PDA nanoaggregates. Compared with the PVA membrane, the PVA-PDA hybrid membrane with the dopamine content of 0.5mol% exhibited a 1.7-fold increase in tensile strength and a 2.2-fold increase in the tensile modulus. The membranes were used for CO2/CH4 separation. The physical cross-linking resulted in a PVA chain rigidification region around PDA nanoaggregates, which hindered the penetration of larger-size gas molecules and thus enhancing the CO2/CH4 selectivity. Moreover, the abundant amine groups from PDA nanoaggregates could facilitate CO2 transport. The optimized hybrid hydrogel membrane exhibited CO2/CH4 selectivity of 43.2, which was 43.85% higher than that of the PVA membrane. The bioadhesion-inspired method opens up new opportunities to exploit the potential application of hydrogel membranes.

Exceptionally High Efficient Co-Co2P@N, P-Codoped Carbon Hybrid Catalyst for Visible Light-Driven CO2-to-CO Conversion.

Science.gov (United States)

Fu, Wen Gan

2018-05-02

Artificial photosynthesis has attracted wide attention, particularly the development of efficient solar light-driven methods to reduce CO2 to form energy-rich carbon-based products. Because CO2 reduction is an uphill process with a large energy barrier, suitable catalysts are necessary to achieve this transformation. In addition, CO2 adsorption on a catalyst and proton transfer to CO2 are two important factors for the conversion reaction，and catalysts with high surface area and more active sites are required to improve the efficiency of CO2 reduction. Here, we report a visible light-driven system for CO2-to-CO conversion that consists of a heterogeneous hybrid catalyst of Co and Co2P nanoparticles embedded in carbon nanolayers codoped with N and P (Co-Co2P@NPC) and a homogeneous Ru(II)-based complex photosensitizer. The average generation rate of CO of the system was up to 35,000 μmol h-1 g-1 with selectivity of 79.1% in 3 h. Linear CO production at an exceptionally high rate of 63,000 μmol h-1 g-1 was observed in the first hour of reaction. Inspired by this highly active catalyst, we also synthesized Co@NC and Co2P@NPC materials and explored their structure, morphology, and catalytic properties for CO2 photoreduction. The results showed that the nanoparticle size, partially adsorbed H2O molecules on the catalyst surface, and the hybrid nature of the systems influenced their photocatalytic CO2 reduction performance. © 2018 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Exploratory Research on Simulation of CO2-Brine-Mineral Interactions

Energy Technology Data Exchange (ETDEWEB)

Chen Zhu; Shiao hung Chiang

2005-11-01

Application of many carbon sequestration strategies requires knowledge of thermodynamic properties for the extremely complex chemical system of CO{sub 2}-SO{sub 2}-H{sub 2}O-NaCl-CaCl{sub 2}-MgCl{sub 2}. This University Coal Research Phase I program has been successful and highly productive in exploring an approach to develop an equation of state (EOS) to describe thermodynamic properties in the above chemical system. We have compiled available laboratory experimental data and thermodynamic models, and evaluated their appropriateness for the carbon sequestration process. Based on this literature review, we provided an improved CO{sub 2} solubility model for the CO{sub 2}-H{sub 2}O-NaCl system, which incorporates newly available experimental measurements funded by DOE, and is valid in temperature range from 273 to 533 K, pressure from 0 to 2000 bar, and salinity from 0 to 4.5 molality of NaCl equivalent. The improved model also greatly improves the computational efficiency of CO{sub 2} solubility calculations and thus is better suited to be incorporated into large computer simulation models (e.g., reservoir simulation models). The literature review and model development provided insights of the data needs and directions for future work. Synergetic collaboration with DOE scientists has resulted in simulations of injected CO{sub 2} fate in sandstone aquifer with a one-dimensional numerical coupled reactive transport model. We evaluated over 100 references on CO{sub 2} solubility and submitted two manuscripts to peer-reviewed journals. One paper has been accepted for publication in ''Environmental Geosciences''.

Why Southern Ocean uptake of anthropogenic CO2 may be decreasing

CSIR Research Space (South Africa)

Mongwe, P

2012-10-01

Full Text Available to the warm surface water and its influence on CO2 solubility (Figures 2 and 3). The decline is DIC with depth correlates with the decrease in temperature (Figures 2 and 3), as colder water holds more CO2. The Southern Ocean has particularly high DIC... southwards, upwelling is also expected move more southwards, which may result in more intense CO2 outgassing. The emitted CO2 contributes to green house gases, which alter the heat balance and result in increased average temperatures. REFERENCES Le...

Phase behavior for the poly(alkyl methacrylate)+supercritical CO{sub 2}+DME mixture at high pressures

Energy Technology Data Exchange (ETDEWEB)

Choi, Yong-Seok; Chio, Sang-Won; Byun, Hun-Soo [Chonnam National University, Yeosu (Korea, Republic of)

2016-01-15

The phase behavior curves of binary and ternary system were measured for poly(alkyl methacrylate) in supercritical CO{sub 2}, as well as for the poly(alkyl methacrylate)+dimethyl ether (DME) (or 1-butene) in CO{sub 2}. The solubility curves are reported for the poly(alkyl methacrylate)+DME in supercritical CO{sub 2} at temperature from (300 to 465) K and a pressure from (3.66 to 248) MPa. Also, The high-pressure static-type apparatus of cloud-point curve was tested by comparing the measured phase behavior data of the poly(methyl methacrylate) [PMMA]+CO{sub 2}+20.0 and 30.4 wt% methyl methacrylate (MMA) system with literature data of 10.4, 28.8 and 48.4 wt% MMA concentration. The phase behavior data for the poly(alkyl methacrylate)+CO{sub 2}+DME mixture were measured in changes of the pressure-temperature (p, T) slope and with DME concentrations. Also, the cloud-point pressure for the poly(alkyl methacrylate)+1- butene solution containing supercritical CO{sub 2} shows from upper critical solution temperature (UCST) region to lower critical solution temperature (LCST) region at concentration range from (0.0 to 95) wt% 1-butene at below 455 K and at below 245MPa.

Modeling CO2 Storage in Fractured Reservoirs: Fracture-Matrix Interactions of Free-Phase and Dissolved CO2

Science.gov (United States)

Oldenburg, C. M.; Zhou, Q.; Birkholzer, J. T.

2017-12-01

The injection of supercritical CO2 (scCO2) in fractured reservoirs has been conducted at several storage sites. However, no site-specific dual-continuum modeling for fractured reservoirs has been reported and modeling studies have generally underestimated the fracture-matrix interactions. We developed a conceptual model for enhanced CO2 storage to take into account global scCO2 migration in the fracture continuum, local storage of scCO2 and dissolved CO2 (dsCO2) in the matrix continuum, and driving forces for scCO2 invasion and dsCO2 diffusion from fractures. High-resolution discrete fracture-matrix models were developed for a column of idealized matrix blocks bounded by vertical and horizontal fractures and for a km-scale fractured reservoir. The column-scale simulation results show that equilibrium storage efficiency strongly depends on matrix entry capillary pressure and matrix-matrix connectivity while the time scale to reach equilibrium is sensitive to fracture spacing and matrix flow properties. The reservoir-scale modeling results shows that the preferential migration of scCO2 through fractures is coupled with bulk storage in the rock matrix that in turn retards the fracture scCO2 plume. We also developed unified-form diffusive flux equations to account for dsCO2 storage in brine-filled matrix blocks and found solubility trapping is significant in fractured reservoirs with low-permeability matrix.

Novel CO{sub 2}-thickeners for improved mobility control

Energy Technology Data Exchange (ETDEWEB)

Enick, Dr. Robert M.; Beckman, Dr. Eric J.; Hamilton, Dr. Andrew

2000-02-02

The objective of this study was to design, synthesize, and characterize thickening agents for dense carbon dioxide and to evaluate their solubility and viscosity-enhancing potential in CO{sub 2}. Hydrocarbon-fluorocarbon random copolymers, sulfated hydrocarbon-fluorocarbon random copolymers, semifluorinated trialkyltin fluorides and small hydrogen-bonding compounds were evaluated. Random copolymers of styrene and heptadecafluorodecyl acrylate were characterized by high solubility ion dense carbon dioxide and the most substantial increases in solution viscosity. Falling cylinder viscometry results indicated that the 29%styrene--71%fluoroacylate bulk-polymerized copolymer induced 2--250 fold increases in viscosity at copolymer concentrations of 0.2--5.0wt%.

A model for estimating CO2 solubility in aqueous alkanolamines

DEFF Research Database (Denmark)

Gabrielsen, Jostein; Michelsen, Michael Locht; Stenby, Erling Halfdan

2005-01-01

of CO2 over an aqueous alkanolamine solution. Accurate values for the partial pressure of CO2 are obtained for a limited loading, temperature, and pressure range that is useful in modeling CO2 capture from coal-fired power plants. Heat of absorption values derived from the model agree with experimental...

Solubility of uranovanadates of the series A2+(VUO6)2 · nH2O (A2+ = Mg, Ca, Sr, Ba, Co, Ni, Cu, Pb) in water or aqueous solutions

International Nuclear Information System (INIS)

Chernorukov, N.G.; Sulejmanov, E.V.; Nipruk, O.V.; Lizunova, G.M.

2001-01-01

Solubility of uranovanadates of the series A 2+ (VUO 6 ) 2 · nH 2 O (A 2+ - Mg, Ca, Sr, Ba, Co, Ni, Cu, Pb) in water and aqueous solutions of inorganic acids at 25 deg C and different pH values was determined experimentally. The data obtained permitted calculation the Gibbs standard functions of formation and consideration of their state under conditions that were not studied experimentally, in the presence of carbon dioxide, in particular [ru

The Influence of CO2 Solubility in Brine on Simulation of CO2 Injection into Water Flooded Reservoir and CO2 WAG

DEFF Research Database (Denmark)

Yan, Wei; Stenby, Erling Halfdan

2010-01-01

Injection of CO2 into depleted oil reservoirs is not only a traditional way to enhance oil recovery but also a relatively cheaper way to sequester CO2 underground since the increased oil production can offset some sequestration cost. CO2 injection process is often applied to water flooded...... simulations were made for seven oil samples within a wide range of temperature, pressure and salinity. The results were analyzed in terms of the change in oil recovery due to different phase equilibrium descriptions, the delay in breakthrough and the CO2 lost to the aqueous phase. The influence of different...

Solubility Modeling of the Binary Systems Fe(NO3)3–H2O, Co(NO3)2–H2O and the Ternary System Fe(NO3)3–Co(NO3)2–H2O with the Extended Universal Quasichemical (UNIQUAC) Model

DEFF Research Database (Denmark)

Arrad, Mouad; Kaddami, Mohammed; Goundali, Bahija El

2016-01-01

Solubility modeling in the binary system Fe(NO3)3–H2O, Co(NO3)2–H2O and the ternary system Fe(NO3)3–Co(NO3)2–H2O is presented. The extended UNIQUAC model was applied to the thermodynamic assessment of the investigated systems. The model parameters obtained were regressed simultaneously using...... the available databank but with more experimental points, recently published in the open literature. A revision of previously published parameters for the cobalt ion and new parameters for the iron(III) nitrate system are presented. Based on this set of parameters, the equilibrium constants of hydrates...

Experimental investigation of CO2-brine-rock interactions at elevated temperature and pressure: Implications for CO2 sequestration in deep-saline aquifers

Science.gov (United States)

Rosenbauer, R.J.; Koksalan, T.; Palandri, J.L.

2005-01-01

Deep-saline aquifers are potential repositories for excess CO2, currently being emitted to the atmosphere from anthropogenic activities, but the reactivity of supercritical CO2 with host aquifer fluids and formation minerals needs to be understood. Experiments reacting supercritical CO2 with natural and synthetic brines in the presence and absence of limestone and plagioclase-rich arkosic sandstone showed that the reaction of CO2-saturated brine with limestone results in compositional, mineralogical, and porosity changes in the aquifer fluid and rock that are dependent on initial brine composition, especially dissolved calcium and sulfate. Experiments reacting CO2-saturated, low-sulfate brine with limestone dissolved 10% of the original calcite and increased rock porosity by 2.6%. Experiments reacting high-sulfate brine with limestone, both in the presence and absence of supercritical CO2, were characterized by the precipitation of anhydrite, dolomitization of the limestone, and a final decrease in porosity of 4.5%. However, based on favorable initial porosity changes of about 15% due to the dissolution of calcite, the combination of CO2 co-injection with other mitigation strategies might help alleviate some of the well-bore scale and formation-plugging problems near the injection zone of a brine disposal well in Paradox Valley, Colorado, as well as provide a repository for CO2. Experiments showed that the solubility of CO2 is enhanced in brine in the presence of limestone by 9% at 25 ??C and 6% at 120 ??C and 200 bar relative to the brine itself. The solubility of CO2 is enhanced also in brine in the presence of arkosic sandstone by 5% at 120 ??C and 300 bar. The storage of CO 2 in limestone aquifers is limited to only ionic and hydraulic trapping. However, brine reacted with supercritical CO2 and arkose yielded fixation and sequestration of CO2 in carbonate mineral phases. Brine desiccation was observed in all experiments containing a discrete CO2 phase

Modeling of CO2 absorber using an AMP solution

DEFF Research Database (Denmark)

Gabrielsen, Jostein; Michelsen, Michael Locht; Stenby, Erling Halfdan

2006-01-01

Abstract: An explicit model for carbon dioxide (CO2) solubility in an aqueous solution of 2-amino-2-methyl-1-propanol (AMP) has been proposed and an expression for the heat of absorption of CO2 has been developed as a function of loading and temperature. A rate-based steady-state model for CO2...... to absorption of CO2 into an AMP solution in a packed tower and validated against pilot-plant data from the literature. (c) 2006 American Institute of Chemical Engineers....... absorption into an AMP solution has been proposed, using both the proposed expression for the CO2 solubility and the expression for the heat of absorption along with an expression for the enhancement factor and physicochemical data from the literature. The proposed model has successfully been applied...

IUPAC-NIST Solubility Data Series. 95. Alkaline Earth Carbonates in Aqueous Systems. Part 2. Ca

Science.gov (United States)

Vanderdeelen, Jan

2012-06-01

The alkaline earth carbonates are an important class of minerals. This article is part of a volume in the IUPAC-NIST Solubility Data Series that compiles and critically evaluates solubility data of the alkaline earth carbonates in water and in simple aqueous electrolyte solutions. Part 1 outlined the procedure adopted in this volume, and presented the beryllium and magnesium carbonates. Part 2, the current paper, compiles and critically evaluates the solubility data of calcium carbonate. The chemical forms included are the anhydrous CaCO3 types calcite, aragonite, and vaterite, the monohydrate monohydrocalcite (CaCO3. H2O), the hexahydrate ikaite (CaCO3.6H2O), and an amorphous form. The data were analyzed with two model variants, and thermodynamic data of each form consistent with each of the models and with the CODATA key values for thermodynamics are presented.

Amine–mixed oxide hybrid materials for carbon dioxide adsorption from CO2/H2 mixture

Science.gov (United States)

Ravi, Navin; Aishah Anuar, Siti; Yusuf, Nur Yusra Mt; Isahak, Wan Nor Roslam Wan; Shahbudin Masdar, Mohd

2018-05-01

Bio-hydrogen mainly contains hydrogen and high level of carbon dioxide (CO2). High concentration of CO2 lead to a limitation especially in fuel cell application. In this study, the amine-mixed oxide hybrid materials for CO2 separation from bio-hydrogen model (50% CO2:50% H2) have been studied. Fourier-transform infrared spectroscopy (FTIR) and x-ray diffraction (XRD) characterizations showed that the amine–mixed oxide hybrid materials successfully adsorbed CO2 physically with no chemical adsorption evidence. The dry gas of CO2/H2 mixture adsorbed physically on amine–CuO–MgO hybrid material. No carbonates were detected after several times of adsorption, which indicated the good recyclability of adsorbents. The adsorbent system of diethanolamine (DEA)/15% CuO–75% MgO showed the highest CO2 adsorption capacity of 21.2 wt% due to the presence of polar substance on MgO surface, which can adsorb CO2 at ambient condition. The alcohol group of DEA can enhance the CO2 solubility on the adsorbent surface. In the 20% CuO–50% MgO adsorbent system, DEA as amine type showed a high CO2 adsorption of 19.4 wt%. The 10% amine loading system showed that the DEA adsorption system provided high CO2 adsorption. The BET analysis confirmed that a high amine loading contributed to the decrease in CO2 adsorption due to the low surface area of the adsorbent system.

IUPAC-NIST Solubility Data Series. 95. Alkaline Earth Carbonates in Aqueous Systems. Part 2. Ca

International Nuclear Information System (INIS)

De Visscher, Alex; Vanderdeelen, Jan

2012-01-01

The alkaline earth carbonates are an important class of minerals. This article is part of a volume in the IUPAC-NIST Solubility Data Series that compiles and critically evaluates solubility data of the alkaline earth carbonates in water and in simple aqueous electrolyte solutions. Part 1 outlined the procedure adopted in this volume, and presented the beryllium and magnesium carbonates. Part 2, the current paper, compiles and critically evaluates the solubility data of calcium carbonate. The chemical forms included are the anhydrous CaCO 3 types calcite, aragonite, and vaterite, the monohydrate monohydrocalcite (CaCO 3 · H 2 O), the hexahydrate ikaite (CaCO 3 ·6H 2 O), and an amorphous form. The data were analyzed with two model variants, and thermodynamic data of each form consistent with each of the models and with the CODATA key values for thermodynamics are presented.

Revisiting Pocos de Caldas. Application of the co-precipitation approach to establish realistic solubility limits for performance assessment

International Nuclear Information System (INIS)

Bruno, J.; Duro, L.; Jordana, S.; Cera, E.

1996-02-01

Solubility limits constitute a critical parameter for the determination of the mobility of radionuclides in the near field and the geosphere, and consequently for the performance assessment of nuclear waste repositories. Mounting evidence from natural system studies indicate that trace elements, and consequently radionuclides, are associated to the dynamic cycling of major geochemical components. We have recently developed a thermodynamic approach to take into consideration the co-precipitation and co-dissolution processes that mainly control this linkage. The approach has been tested in various natural system studies with encouraging results. The Pocos de Caldas natural analogue was one of the sites where a full testing of our predictive geochemical modelling capabilities were done during the analogue project. We have revisited the Pocos de Caldas data and expanded the trace element solubility calculations by considering the documented trace metal/major ion interactions. This has been done by using the co-precipitation/co-dissolution approach. The outcome is as follows: A satisfactory modelling of the behaviour of U, Zn and REEs is achieved by assuming co-precipitation with ferrihydrite. Strontium concentrations are apparently controlled by its co-dissolution from Sr-rich fluorites. From the performance assessment point of view, the present work indicates that calculated solubility limits using the co-precipitation approach are in close agreement with the actual trace element concentrations. Furthermore, the calculated radionuclide concentrations are 2-4 orders of magnitude lower than conservative solubility limits calculated by assuming equilibrium with individual trace element phases. 34 refs, 18 figs, 13 tabs

Revisiting Pocos de Caldas. Application of the co-precipitation approach to establish realistic solubility limits for performance assessment

Energy Technology Data Exchange (ETDEWEB)

Bruno, J.; Duro, L.; Jordana, S.; Cera, E. [QuantiSci, Barcelona (Spain)

1996-02-01

Solubility limits constitute a critical parameter for the determination of the mobility of radionuclides in the near field and the geosphere, and consequently for the performance assessment of nuclear waste repositories. Mounting evidence from natural system studies indicate that trace elements, and consequently radionuclides, are associated to the dynamic cycling of major geochemical components. We have recently developed a thermodynamic approach to take into consideration the co-precipitation and co-dissolution processes that mainly control this linkage. The approach has been tested in various natural system studies with encouraging results. The Pocos de Caldas natural analogue was one of the sites where a full testing of our predictive geochemical modelling capabilities were done during the analogue project. We have revisited the Pocos de Caldas data and expanded the trace element solubility calculations by considering the documented trace metal/major ion interactions. This has been done by using the co-precipitation/co-dissolution approach. The outcome is as follows: A satisfactory modelling of the behaviour of U, Zn and REEs is achieved by assuming co-precipitation with ferrihydrite. Strontium concentrations are apparently controlled by its co-dissolution from Sr-rich fluorites. From the performance assessment point of view, the present work indicates that calculated solubility limits using the co-precipitation approach are in close agreement with the actual trace element concentrations. Furthermore, the calculated radionuclide concentrations are 2-4 orders of magnitude lower than conservative solubility limits calculated by assuming equilibrium with individual trace element phases. 34 refs, 18 figs, 13 tabs.

Actinide solution equlibria and solubilities in geologic systems

International Nuclear Information System (INIS)

Allard, B.

1983-04-01

Stability constants and solubility products for actinide (Th, U, Np, Pu and Am) hydroxide and carbonate complexes have been collected, and total solubilities have been calculated under conditions representative of deep granitic groundwaters (pH 7-9.5; high total carbonate concentration according to log (CO 3 )=0.76pH-10.83; redox potentials corresponding to oxic systems, Eh>0.8-0.06pH, and reducing systems, Eh 2 (s), UO 2 (s), NpO 2 (s), PuO 2 (s) and Am 2 (CO 3 ) 3 (s)m, respectively, and the corresponding calculated maximum solubilities are 3 times 10- 10 M(0.07 μg/1) for Th, 0.3-250 times 10- 10 M (0.01-6 μg/1) for U (depending on the carbonate concentration), 1 times 10- 10 M(0.03 μg/1) for Np, 1-3 times 10- 9 M (0.2-0.7 μg/1) for Pu and 0.6-2 times 10- 7 M (15-50 μg/1) for Am. The calculated solubilities for U are in fair agreement with observed uranium concentrations in natural deep groundwaters. Hexavalent uranium carbonate species would dominate in solution except under highly reducing conditions (Eh 5 -10- 6 M (mg/1-level). (author)

A molecular study of gas solubility in nitrile rubber

Science.gov (United States)

Khawaja, Musab; Mostofi, Arash; Sutton, Adrian

2015-03-01

One of the most important uses of elastomers in the oil industry is for seals to encase and protect sensitive monitoring equipment from contamination by gases and liquids at the high pressures and temperatures in the well. Failure of such seals sometimes occurs on decompression when they are returned to the surface. The conditions in the well lead to gases being absorbed by Nitrile rubber (NBR) seals. NBR exhibits a strong permselectivity towards CO2 compared to other gases; something attributed experimentally to the enhanced solubility of CO2. In this study an explanation is sought at the molecular level for this phenomenon. A series of molecular mechanics calculations are performed to compute solubilities of different gases in NBR. The effect of acrylonitrile content on their solubilities is studied for the first time by simulation, and we discuss the important issue of convergence with respect to the sampling of different elastomer configurations. It is observed that the presence of cyano groups has a marked impact on the solubility of CO2 and an explanation is offered.

Mega-solubility of quartz resulting from highly alkaline fluids produced by dissolved albite in H2O at deep crustal conditions

Science.gov (United States)

Makhluf, A. R.; Manning, C. E.

2017-12-01

Models of H2O-rich fluids equilibrated with rocks at high P and T fail to predict the high solubilities observed experimentally, chiefly because thermodynamic data for the most abundant solutes is lacking. We investigated the effects of dissolved albite (Ab) on the solubility of quartz (Qz) at 1.0 GPa and 675-900 °C using a piston-cylinder apparatus to quantify possible mineral buffering or enhancement effects. We found a very large enhancement effect on the solubility of Qz when dissolved in dilute aqueous Ab solutions. SiO2 concentrations are similar to Qz solubility in strongly alkaline KOH solutions. At the highest temperature of 900 °C, we found that the solubility of Qz in 1.0 molal Ab solution increases by of factor of 4.5 over that in pure H2O, which corresponds to 10.7 molal SiO2. The nearly identical solubility of Qz in KOH(aq) and Ab solutions of the same concentration, P, and T, strongly suggest that NaOH(aq) liberated from NaAlSi3O8 in H2O fluids effects SiO2 solubility in a similar manner to that of KOH(aq). The deprotonated silica dimer was found to be a key species responsible for the high solubility of Qz in KOH(aq) and is likely responsible for the high solubility of Qz in Ab solutions. While the binaries Qz-H2O, Ab-H2O, and Qz-Ab are well known at 1.0 GPa, little data exists on the ternary system. The new results help quantify the ternary relations in the Ab-Qz-H2O system, which can be used as a simple model for liquid-vapor immiscibility granitic magmas. In addition, these highly alkaline solute-rich aqueous fluids suggest a mechanism for Ab-Qz metasomatism in subduction zones, such as in the Catalina schist (Bebout and Barton 1993), which provides an alternative to high P-T magmas. Our results show that subduction zone and metasomatic fluids may be much more alkaline and have significantly higher dissolving power than previously thought.

Growth under elevated atmospheric CO(2) concentration accelerates leaf senescence in sunflower (Helianthus annuus L.) plants.

Science.gov (United States)

de la Mata, Lourdes; Cabello, Purificación; de la Haba, Purificación; Agüera, Eloísa

2012-09-15

Some morphogenetic and metabolic processes were sensitive to a high atmospheric CO(2) concentration during sunflower primary leaf ontogeny. Young leaves of sunflower plants growing under elevated CO(2) concentration exhibited increased growth, as reflected by the high specific leaf mass referred to as dry weight in young leaves (16 days). The content of photosynthetic pigments decreased with leaf development, especially in plants grown under elevated CO(2) concentrations, suggesting that high CO(2) accelerates chlorophyll degradation, and also possibly leaf senescence. Elevated CO(2) concentration increased the oxidative stress in sunflower plants by increasing H(2)O(2) levels and decreasing activity of antioxidant enzymes such as catalase and ascorbate peroxidase. The loss of plant defenses probably increases the concentration of reactive oxygen species in the chloroplast, decreasing the photosynthetic pigment content as a result. Elevated CO(2) concentration was found to boost photosynthetic CO(2) fixation, especially in young leaves. High CO(2) also increased the starch and soluble sugar contents (glucose and fructose) and the C/N ratio during sunflower primary leaf development. At the beginning of senescence, we observed a strong increase in the hexoses to sucrose ratio that was especially marked at high CO(2) concentration. These results indicate that elevated CO(2) concentration could promote leaf senescence in sunflower plants by affecting the soluble sugar levels, the C/N ratio and the oxidative status during leaf ontogeny. It is likely that systemic signals produced in plants grown with elevated CO(2), lead to early senescence and a higher oxidation state of the cells of these plant leaves. Copyright © 2012 Elsevier GmbH. All rights reserved.

Vertically averaged approaches for CO 2 migration with solubility trapping

KAUST Repository

Gasda, S. E.; Nordbotten, J. M.; Celia, M. A.

2011-01-01

The long-term storage security of injected carbon dioxide (CO2) is an essential component of geological carbon sequestration operations. In the postinjection phase, the mobile CO2 plume migrates in large part because of buoyancy forces, following

IUPAC-NIST Solubility Data Series. 95. Alkaline Earth Carbonates in Aqueous Systems. Part 2. Ca

Energy Technology Data Exchange (ETDEWEB)

De Visscher, Alex; Vanderdeelen, Jan [Department of Chemical and Petroleum Engineering, and Centre for Environmental Engineering Research and Education (CEERE), Schulich School of Engineering, University of Calgary, Calgary, Alberta, T2N 1N4 (Canada); Department of Applied Analytical and Physical Chemistry, Faculty of Bioscience Engineering, Ghent University, B-9000 Ghent (Belgium)

2012-06-15

The alkaline earth carbonates are an important class of minerals. This article is part of a volume in the IUPAC-NIST Solubility Data Series that compiles and critically evaluates solubility data of the alkaline earth carbonates in water and in simple aqueous electrolyte solutions. Part 1 outlined the procedure adopted in this volume, and presented the beryllium and magnesium carbonates. Part 2, the current paper, compiles and critically evaluates the solubility data of calcium carbonate. The chemical forms included are the anhydrous CaCO{sub 3} types calcite, aragonite, and vaterite, the monohydrate monohydrocalcite (CaCO{sub 3}{center_dot} H{sub 2}O), the hexahydrate ikaite (CaCO{sub 3}{center_dot}6H{sub 2}O), and an amorphous form. The data were analyzed with two model variants, and thermodynamic data of each form consistent with each of the models and with the CODATA key values for thermodynamics are presented.

High spin-polarization in ultrathin Co2MnSi/CoPd multilayers

Science.gov (United States)

Galanakis, I.

2015-03-01

Half-metallic Co2MnSi finds a broad spectrum of applications in spintronic devices either in the form of thin films or as spacer in multilayers. Using state-of-the-art ab-initio electronic structure calculations we exploit the electronic and magnetic properties of ultrathin Co2MnSi/CoPd multilayers. We show that these heterostructures combine high values of spin-polarization at the Co2MnSi spacer with the perpendicular magnetic anisotropy of binary compounds such as CoPd. Thus they could find application in spintronic/magnetoelectronic devices.

VOLATILECALC: A silicate melt-H2O-CO2 solution model written in Visual Basic for excel

Science.gov (United States)

Newman, S.; Lowenstern, J. B.

2002-01-01

We present solution models for the rhyolite-H2O-CO2 and basalt-H2O-CO2 systems at magmatic temperatures and pressures below ~ 5000 bar. The models are coded as macros written in Visual Basic for Applications, for use within MicrosoftR Excel (Office'98 and 2000). The series of macros, entitled VOLATILECALC, can calculate the following: (1) Saturation pressures for silicate melt of known dissolved H2O and CO2 concentrations and the corresponding equilibrium vapor composition; (2) open- and closed-system degassing paths (melt and vapor composition) for depressurizing rhyolitic and basaltic melts; (3) isobaric solubility curves for rhyolitic and basaltic melts; (4) isoplethic solubility curves (constant vapor composition) for rhyolitic and basaltic melts; (5) polybaric solubility curves for the two end members and (6) end member fugacities of H2O and CO2 vapors at magmatic temperatures. The basalt-H2O-CO2 macros in VOLATILECALC are capable of calculating melt-vapor solubility over a range of silicate-melt compositions by using the relationships provided by Dixon (American Mineralogist 82 (1997) 368). The output agrees well with the published solution models and experimental data for silicate melt-vapor systems for pressures below 5000 bar. ?? 2002 Elsevier Science Ltd. All rights reserved.

Development of high power pulsed CO2 laser

International Nuclear Information System (INIS)

Nakai, Sadao; Matoba, Masafumi; Fujita, Hisanori; Daido, Hiroyuki; Inoue, Mitsuo

1982-01-01

The inertial nuclear fusion research using pellet implosion has rapidly progressed accompanying laser technique improvement and output increase. As the high output lasers for this purpose, Nd glass lasers or CO 2 lasers are used. The CO 2 lasers possess the characteristics required as reactor lasers, i.e., high efficiency, high frequency repetition, possibility of scale-up and economy. So, the technical development of high power CO 2 lasers assuming also as reactor drivers has been performed at a quick pace together with the research on the improvement of efficiency of pellet implosion by 10 μm laser beam. The Institute of Laser Engineering, Osaka University, stated to build a laser system LEKKO No. 8 of 8 beams and 10 kJ based on the experiences in laser systems LEKKO No. 1 and LEKKO No. 2, and the system LEKKO No. 8 was completed in March, 1981. The operation tests for one year since then has indicated as the laser characteristics that the system performance was as designed initially. This paper reviews the structure, problems and present status of the large scale CO 2 lasers. In other words, the construction of laser system, CO 2 laser proper, oscillator, booster amplifier, prevention of parasitic oscillation, non-linear pulse propagation and fairing of output pulse form, system control and beam alignment, and high power problems are described. The results obtained are to be reported in subsequent issues. (Wakatsuki, Y.)

High spin-polarization in ultrathin Co2MnSi/CoPd multilayers

International Nuclear Information System (INIS)

Galanakis, I.

2015-01-01

Half-metallic Co 2 MnSi finds a broad spectrum of applications in spintronic devices either in the form of thin films or as spacer in multilayers. Using state-of-the-art ab-initio electronic structure calculations we exploit the electronic and magnetic properties of ultrathin Co 2 MnSi/CoPd multilayers. We show that these heterostructures combine high values of spin-polarization at the Co 2 MnSi spacer with the perpendicular magnetic anisotropy of binary compounds such as CoPd. Thus they could find application in spintronic/magnetoelectronic devices. - Highlights: • Ab-initio study of ultrathin Co 2 MnSi/CoPd multilayers. • Large values of spin-polarization at the Fermi are retained. • Route for novel spintronic/magnetoelectronic devices

Measurement and correlation of solubility of carbon dioxide in triglycerides

International Nuclear Information System (INIS)

Howlader, Md Shamim; French, William Todd; Toghiani, Hossein; Hartenbower, Ben; Pearson, Larry; DuBien, Janice; Rai, Neeraj

2017-01-01

Graphical abstract: Comparison of experimental results with correlation for solubility of CO 2 in triglycerides as a function pressure at two different temperatures of 289.15 and 303.15 K, respectively. - Highlights: • New pressure drop gas apparatus was developed to determine the solubility of gases in liquids. • Solubility of CO 2 in triglycerides was measured at different temperatures and pressures. • Experimental solubility data were correlated using three thermodynamic models. • Enthalpy, entropy and Gibbs energy of dissolution for CO 2 -triglyceride were determined. - Abstract: A new pressure drop solubility gas apparatus was developed to determine the solubility of carbon dioxide in canola oil, a triglyceride consisting primarily of oleic, linoleic, and alpha linoleic acid radicals. Solubility of CO 2 in triglycerides was determined at different temperatures (283.2–303.2 K) and pressures (600–2450 kPa). It was found that the solubility of CO 2 in triglycerides is higher than that of pure water because triglycerides lack strong hydrogen bond networks that exist in liquid water at the ambient conditions. The experimental solubility was correlated using Krichevsky–Kasarnovsky (KK), Mather-Jou (MJ), and Carvalho-Coutinho (CC) correlations. We find that KK and MJ equations can predict the solubility with higher accuracy. The enthalpy and entropy of absorption of CO 2 were calculated using the van’t Hoff plot and were found to be −7.165 kJ.mol −1 , and −28.791 J.mol −1 .K −1 , respectively.

Solubility comparison and partial molar volumes of 1,2-hexanediol before and after end-group modification by methyl oxalyl chloride and ethyl oxalyl monochloride in supercritical CO2

International Nuclear Information System (INIS)

Zhao, Lu; Yang, Hai-Jian; Cai, Zhuofu

2013-01-01

Highlights: ► Two new “CO 2 -philic” compounds were designed and synthesized. ► The tested solubility data were calculated and correlated with two models. ► Satisfactory agreements were obtained between the tested and calculated data. ► The partial molar volumes V ¯ 2 for three compounds were estimated. - Abstract: Bis(methoxy oxalic)-1,2-haxenediester and bis(ethoxy oxalic)-1,2-haxenediester were synthesized by modifying the end groups of 1,2-hexanediol with methyl oxalyl chloride and ethyl oxalyl monochloride. The solubilities of all three compounds in supercritical carbon dioxide were determined at different conditions of pressures (8.8 to 18.8) MPa and temperatures (313, 333, and 353) K. Then, the solubility data were correlated with the Bartle model and the Chrastil model. The average absolute relative deviation (AARD) for the Bartle model was in the range of (3.89 to 25.46)% which is within a good approximation. The Chrastil model also showed satisfactory agreement and the AARD was in the range of (3.70 to 16.92)%. Furthermore, the partial molar volumes of those compounds were estimated following the theory developed by Kumar and Johnston.

Synthesis, characterization and application of 1-(2-cyanoethyl-3-(3-methoxypropaneimidazolium bromide for CO2 capture

Directory of Open Access Journals (Sweden)

Ravichandar Shantini

2017-01-01

Full Text Available Amine scrubbing is dominating in carbon dioxide (CO2 capturing technology because of its high affinity towards CO2. However, the drawbacks of amine solvents are its high corrosivity and volatility. Ionic liquids (ILs have gained a lot of attention in recent years for CO2 capturing and have been proposed to be one of the promising alternative to the conventional solvents. The objective of this research is to design a new imidazolium based ether-nitrile functionalized ionic liquid of low viscosity to improve CO2 capturing. The molecular structure of the ionic liquid were confirmed by 1H NMR, 13C NMR and FTIR. The thermal properties; glass transition temperature, thermal decomposition temperature, and their physical properties; water content and density were determined. The solubility of CO2 in the synthesized ionic liquid was measured using pressure drop method. They showed high thermal stability above 200°C and the glass transition temperature was -49.80°C. The CO2 sorption in the newly synthesized IL was 0.08, 0.12, 0.29, 1.01, 2.30 mol of CO2/mol of IL at pressures 1, 5, 10, 15 and 20 bar respectively.

Role of Biotic and Abiotic Processes on Soil CO2 Dynamics in the McMurdo Dry Valleys, Antarctica

Science.gov (United States)

Risk, D. A.; Macintyre, C. M.; Lee, C.; Cary, C.; Shanhun, F.; Almond, P. C.

2016-12-01

In the harsh conditions of the Antarctic Dry Valleys, microbial activity has been recorded via measurements of soil carbon dioxide (CO2) concentration and surface efflux. However, high temporal resolution studies in the Dry Valleys have also shown that abiotic solubility-driven processes can strongly influence (and perhaps even dominate) the CO2 dynamics in these low flux environments and suggests that biological activity may be lower than previously thought. In this study, we aim to improve our understanding of CO2 dynamics (biotic and abiotic) in Antarctic Dry Valley soils using long-term automated measurements of soil CO2 surface flux and soil profile concentration at several sites, often at sub-diel frequency. We hypothesize that soil CO2 variations are driven primarily by environmental factors affecting CO2 solubility in soil solution, mainly temperature, and that these processes may even overprint biologic production in representative Dry Valley soils. Monitoring of all sites revealed only one likely biotic CO2 production event, lasting three weeks during the Austral summer and reaching fluxes of 0.4 µmol/m2/s. Under more typical low flux conditions (sampling campaigns. Subsurface CO2 monitoring and a lab-controlled Antarctic soil simulation experiment confirmed that abiotic processes are capable of dominating soil CO2 variability. Diel temperature cycles crossing the freezing boundary revealed a dual abiotic cycle of solubility cycling and gas exclusion from ice formation observed only by high temporal frequency measurements (30 min). This work demonstrates a need for a numerical model to partition the dynamic abiotic processes underlying any biotic CO2 production in order to understand potential climate-change induced increases in microbial productivity in terrestrial Antarctica.

Effect of triolein addition on the solubility of capsanthin in supercritical carbon dioxide

International Nuclear Information System (INIS)

Araus, Karina A.; Valle, José M. del; Robert, Paz S.; Fuente, Juan C. de la

2012-01-01

Highlights: ► We isolated capsanthin from red pepper (Capsicum annuum L.). ► We measured its solubility in pure CO 2 and with triolein as cosolvent. ► We model the solubility of capsanthin in pure CO 2 and with triolein. ► Solubility of triolein in mixtures CO 2 + capsanthin was similar to pure CO 2 . ► Triolein has cosolvent effect over solubility of capsanthin in CO 2 . - Abstract: This manuscript presents new phase equilibrium data for capsanthin in pure and triolein-entrained Supercritical (SC) carbon dioxide (CO 2 ). The aim of the work was to determine the cosolvent effect of triolein on capsanthin by comparing solubility results in a ternary (CO 2 + triolein + capsanthin) system and binary (CO 2 + capsanthin) system at (313 or 333) K and (19 to 34) MPa. For this, authors isolated capsanthin from red pepper (Capsicum annuum L.) and tested it using a dynamic-analytical method in an apparatus with recirculation and online analysis of the CO 2 -rich phase. Within the experimental region, the solubility of capsanthin in pure SC–CO 2 increased with system temperature at isobaric conditions and also increased with pressure at isothermal conditions. Solubilities ranged from a minimal of 0.65 μmol/mol at 313 K and 19 MPa to a maximal of 1.97 μmol/mol at 333 K and 32 MPa. The concentration of triolein in the ternary system was equivalent to that its solubility in pure SC–CO 2 depending on system temperature and pressure conditions. Crossover pressure was determined experimentally at 29.6 MPa, below which solubility of triolein decreased with temperature (effect of density). Above the crossover pressure, solubility of triolein increased with temperature (vapor pressure effect). Values of solubility within this range were 0.16 mmol/mol at 19 MPa and 313 K to 0.41 mmol/mol at 33 MPa and 333 K. Independent of system temperature and pressure, capsanthin solubility in triolein-entrained SC–CO 2 increased by a factor of about 3 (triolein-induced enhancement

Ideal gas solubilities and solubility selectivities in a binary mixture of room-temperature ionic liquids.

Science.gov (United States)

Finotello, Alexia; Bara, Jason E; Narayan, Suguna; Camper, Dean; Noble, Richard D

2008-02-28

This study focuses on the solubility behaviors of CO2, CH4, and N2 gases in binary mixtures of imidazolium-based room-temperature ionic liquids (RTILs) using 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ([C2mim][Tf2N]) and 1-ethyl-3-methylimidazolium tetrafluoroborate ([C2mim][BF4]) at 40 degrees C and low pressures (approximately 1 atm). The mixtures tested were 0, 25, 50, 75, 90, 95, and 100 mol % [C2mim][BF4] in [C2mim][Tf2N]. Results show that regular solution theory (RST) can be used to describe the gas solubility and selectivity behaviors in RTIL mixtures using an average mixture solubility parameter or an average measured mixture molar volume. Interestingly, the solubility selectivity, defined as the ratio of gas mole fractions in the RTIL mixture, of CO2 with N2 or CH4 in pure [C2mim][BF4] can be enhanced by adding 5 mol % [C2mim][Tf2N].

Issues concerning the determination of solubility products of sparingly soluble crystalline solids. Solubility of HfO2(cr)

International Nuclear Information System (INIS)

Rai, Dhanpat; Kitamura, Akira; Rosso, Kevin M.; Sasaki, Takayuki; Kobayashi, Taishi

2016-01-01

Solubility studies were conducted with HfO 2 (cr) solid as a function HCl and ionic strength ranging from 2.0 to 0.004 mol kg -1 . These studies involved (1) using two different amounts of the solid phase, (2) acid washing the bulk solid phase, (3) preheating the solid phase to 1400 C, and (4) heating amorphous HfO 2 (am) suspensions to 90 C to ascertain whether the HfO 2 (am) converts to HfO 2 (cr) and to determine the solubility from the oversaturation direction. Based on the results of these treatments it is concluded that the HfO 2 (cr) contains a small fraction of less crystalline, but not amorphous, material [HfO 2 (lcr)] and this, rather than the HfO 2 (cr), is the solubility-controlling phase in the range of experimental variables investigated in this study. The solubility data are interpreted using both the Pitzer and SIT models and they provide log 10 K 0 values of -(59.75±0.35) and -(59.48±0.41), respectively, for the solubility product of HfO 2 (lcr)[HfO 2 (lcr) + 2H 2 O ↔ Hf 4+ + 4OH - ]. The log 10 of the solubility product of HfO 2 (cr) is estimated to be < -63. The observation of a small fraction of less crystalline higher solubility material is consistent with the general picture that mineral surfaces are often structurally and/or compositionally imperfect leading to a higher solubility than the bulk crystalline solid. This study stresses the urgent need, during interpretation of solubility data, of taking precautions to make certain that the observed solubility behavior for sparingly-soluble solids is assigned to the proper solid phase.

Multimodel Predictive System for Carbon Dioxide Solubility in Saline Formation Waters

Energy Technology Data Exchange (ETDEWEB)

Wang, Zan; Small, Mitchell J; Karamalidis, Athanasios K

2013-02-05

The prediction of carbon dioxide solubility in brine at conditions relevant to carbon sequestration (i.e., high temperature, pressure, and salt concentration (T-P-X)) is crucial when this technology is applied. Eleven mathematical models for predicting CO{sub 2} solubility in brine are compared and considered for inclusion in a multimodel predictive system. Model goodness of fit is evaluated over the temperature range 304–433 K, pressure range 74–500 bar, and salt concentration range 0–7 m (NaCl equivalent), using 173 published CO{sub 2} solubility measurements, particularly selected for those conditions. The performance of each model is assessed using various statistical methods, including the Akaike Information Criterion (AIC) and the Bayesian Information Criterion (BIC). Different models emerge as best fits for different subranges of the input conditions. A classification tree is generated using machine learning methods to predict the best-performing model under different T-P-X subranges, allowing development of a multimodel predictive system (MMoPS) that selects and applies the model expected to yield the most accurate CO{sub 2} solubility prediction. Statistical analysis of the MMoPS predictions, including a stratified 5-fold cross validation, shows that MMoPS outperforms each individual model and increases the overall accuracy of CO{sub 2} solubility prediction across the range of T-P-X conditions likely to be encountered in carbon sequestration applications.

Synthesis and electrochemical probing of water-soluble poly(sodium 4-styrenesulfonate-co-acrylic acid)-grafted multiwalled carbon nanotubes

International Nuclear Information System (INIS)

Du Feipeng; Yang Yingkui; Xie Xiaolin; Wu Kangbing; Gan Tian; Liu Lang

2008-01-01

Water-soluble poly(sodium 4-styrenesulfonate-co-acrylic acid)-grafted multiwalled carbon nanotubes (MWNT-g-P(SSS-co-AA)) with core-shell nanostructure were successfully synthesized by in situ free radical copolymerization of sodium 4-strenesulfonate (SSS) and acrylic acid (AA) in the presence of MWNTs terminated with vinyl groups; their structure was characterized by FTIR, 1 H NMR, Raman, TGA and TEM. The results showed that the thickness and content of the copolymer layer grafted onto the MWNT surface are about 7-12 nm and 82.3%, respectively. The P(SSS-co-AA) covalently grafted on MWNTs provides MWNT-g-P(SSS-co-AA) with good hydrophilicity and solubility in water. Then a novel MWNT-g-P(SSS-co-AA)-modified glassy carbon electrode was fabricated by coating; its electrochemical properties were evaluated by electrochemical probe of K 3 [Fe(CN) 6 ], and its catalytic behaviors to the electrochemical oxidation processes of dopamine (DA) and serotonin (5-HT) were investigated. Since the MWNT-g-P(SSS-co-AA)-modified electrode possesses strong electron transfer capability, high electrochemical activity and catalytic ability, it can be used in sensitive, selective, rapid and simultaneous monitoring of biomolecules

Synthesis and Evaluation of CO2 Thickeners Designed with Molecular Modeling

Energy Technology Data Exchange (ETDEWEB)

Robert Enick; Erick Beckman; J. Karl Johnson

2009-08-31

The objective of this research was to use molecular modeling techniques, coupled with our prior experimental results, to design, synthesize and evaluate inexpensive, non-fluorous carbon dioxide thickening agents. The first type of thickener that was considered was associating polymers. Typically, these thickeners are copolymers that contain a highly CO{sub 2}-philic monomer, and a small concentration of a CO{sub 2}-phobic associating monomer. Yale University was solely responsible for the synthesis of a second type of thickener; small, hydrogen bonding compounds. These molecules have a core that contains one or more hydrogen-bonding groups, such as urea or amide groups. Non-fluorous, CO{sub 2}-philic functional groups were attached to the hydrogen bonding core of the compound to impart CO{sub 2} stability and macromolecular stability to the linear 'stack' of these compounds. The third type of compound initially considered for this investigation was CO{sub 2}-soluble surfactants. These surfactants contain conventional ionic head groups and composed of CO{sub 2}-philic oligomers (short polymers) or small compounds (sugar acetates) previously identified by our research team. Mobility reduction could occur as these surfactant solutions contacted reservoir brine and formed mobility control foams in-situ. The vast majority of the work conducted in this study was devoted to the copolymeric thickeners and the small hydrogen-bonding thickeners; these thickeners were intended to dissolve completely in CO{sub 2} and increase the fluid viscosity. A small but important amount of work was done establishing the groundwork for CO{sub 2}-soluble surfactants that reduced mobility by generating foams in-situ as the CO{sub 2}+surfactant solution mixed with in-situ brine.

Highly Surface-Active Ca(OH)2 Monolayer as a CO2 Capture Material.

Science.gov (United States)

Özçelik, V Ongun; Gong, Kai; White, Claire E

2018-03-14

Greenhouse gas emissions originating from fossil fuel combustion contribute significantly to global warming, and therefore the design of novel materials that efficiently capture CO 2 can play a crucial role in solving this challenge. Here, we show that reducing the dimensionality of bulk crystalline portlandite results in a stable monolayer material, named portlandene, that is highly effective at capturing CO 2 . On the basis of theoretical analysis comprised of ab initio quantum mechanical calculations and force-field molecular dynamics simulations, we show that this single-layer phase is robust and maintains its stability even at high temperatures. The chemical activity of portlandene is seen to further increase upon defect engineering of its surface using vacancy sites. Defect-containing portlandene is capable of separating CO and CO 2 from a syngas (CO/CO 2 /H 2 ) stream, yet is inert to water vapor. This selective behavior and the associated mechanisms have been elucidated by examining the electronic structure, local charge distribution, and bonding orbitals of portlandene. Additionally, unlike conventional CO 2 capturing technologies, the regeneration process of portlandene does not require high temperature heat treatment because it can release the captured CO 2 by application of a mild external electric field, making portlandene an ideal CO 2 capturing material for both pre- and postcombustion processes.

Solubility and dissolution thermodynamics of N-(4-chlorophenyl)-2-(pyridin-4-ylcarbonyl)hydrazinecarbothioamide in PG + water co-solvent mixtures at (298.15 to 338.15) K

Energy Technology Data Exchange (ETDEWEB)

Bhat, Mashooq A. [Department of Pharmaceutical Chemistry, College of Pharmacy, King Saud University, P.O. Box 2457, Riyadh 11451 (Saudi Arabia); Haq, Nazrul [Center of Excellence in Biotechnology Research, College of Science, King Saud University, P.O. Box 2460, Riyadh 11451 (Saudi Arabia); Shakeel, Faiyaz, E-mail: faiyazs@fastmail.fm [Center of Excellence in Biotechnology Research, College of Science, King Saud University, P.O. Box 2460, Riyadh 11451 (Saudi Arabia)

2014-10-10

Highlights: • Solubility of isoniazid analog in various PG + water mixtures was measured. • The solubility was observed highest in pure PG. • Experimental solubilities were correlated well with Apelblat and Yalkowsky model. • Solubilities were increased with increase in temperature and mass fraction of PG. - Abstract: The objective of present investigation was to measure the solubility and dissolution thermodynamics of N-(4-chlorophenyl)-2-(pyridin-4-ylcarbonyl)hydrazinecarbothioamide [isoniazid (INH) analog] in various propylene glycol (PG) + water co-solvent mixtures from (298.15 to 338.15) K. The experimental solubilities of INH analog were correlated with Apelblat and Yalkowsky models. The root mean square deviations were found to be (1.13–3.98)% and (1.45–5.73)% for Apelblat equation and Yalkowsky model, respectively. Good correlation was observed between experimental and calculated solubilities of INH analog with correlation coefficients in the range of 0.995–0.999. The mole fraction solubility of INH analog was found to be highest and lowest in pure PG (7.38 × 10{sup −3} at 298.15 K) and pure water (5.17 × 10{sup −7} at 298.15 K), respectively. The results of dissolution thermodynamics indicated endothermic and non-spontaneous dissolution of INH analog.

Synthesis of polyglycocarbonates through polycondensation of glucopyranosides with CO2

KAUST Repository

Pati, Debasis

2017-03-17

Starting from α-methyl D-glucopyranoside (MDG), three strategies of synthesis of polyglycocarbonates through direct polycondensation with CO2 were tried. Using unprotected MDG for reaction with CO2, water soluble oligoglycocarbonates could be obtained; α-methyl-2,3-di-O-methyl D-glucopyranoside (MDMG) which had its hydroxyls in the C2 and C3 positions protected was also subjected to polycondensation with CO2, affording polyglycocarbonates of limited molar mass due to an equilibrium that prevented the progress of the condensation reaction as in the previous case. Lastly, the polycondensation of MDMG with CO2 and aliphatic or aromatic dihalides was carried out in the presence of Cs2CO3; this resulted in the formation of polyglycocarbonates of rather high molar mass containing either aliphatic or aromatic linkers. The structures of the synthesized monomers and polyglycocarbonates were thoroughly characterized. The thermal properties of the obtained polyglycocarbonates were further investigated by TGA and DSC.

Synthesis of polyglycocarbonates through polycondensation of glucopyranosides with CO2

KAUST Repository

Pati, Debasis; Chen, Zuliang; Feng, Xiaoshuang; Hadjichristidis, Nikolaos; Gnanou, Yves

2017-01-01

Starting from α-methyl D-glucopyranoside (MDG), three strategies of synthesis of polyglycocarbonates through direct polycondensation with CO2 were tried. Using unprotected MDG for reaction with CO2, water soluble oligoglycocarbonates could be obtained; α-methyl-2,3-di-O-methyl D-glucopyranoside (MDMG) which had its hydroxyls in the C2 and C3 positions protected was also subjected to polycondensation with CO2, affording polyglycocarbonates of limited molar mass due to an equilibrium that prevented the progress of the condensation reaction as in the previous case. Lastly, the polycondensation of MDMG with CO2 and aliphatic or aromatic dihalides was carried out in the presence of Cs2CO3; this resulted in the formation of polyglycocarbonates of rather high molar mass containing either aliphatic or aromatic linkers. The structures of the synthesized monomers and polyglycocarbonates were thoroughly characterized. The thermal properties of the obtained polyglycocarbonates were further investigated by TGA and DSC.

High spin-polarization in ultrathin Co{sub 2}MnSi/CoPd multilayers

Energy Technology Data Exchange (ETDEWEB)

Galanakis, I., E-mail: galanakis@upatras.gr

2015-03-01

Half-metallic Co{sub 2}MnSi finds a broad spectrum of applications in spintronic devices either in the form of thin films or as spacer in multilayers. Using state-of-the-art ab-initio electronic structure calculations we exploit the electronic and magnetic properties of ultrathin Co{sub 2}MnSi/CoPd multilayers. We show that these heterostructures combine high values of spin-polarization at the Co{sub 2}MnSi spacer with the perpendicular magnetic anisotropy of binary compounds such as CoPd. Thus they could find application in spintronic/magnetoelectronic devices. - Highlights: • Ab-initio study of ultrathin Co{sub 2}MnSi/CoPd multilayers. • Large values of spin-polarization at the Fermi are retained. • Route for novel spintronic/magnetoelectronic devices.

Comparison of a soluble co-formulation of insulin degludec/insulin aspart vs biphasic insulin aspart 30 in type 2 diabetes

DEFF Research Database (Denmark)

Niskanen, Leo; Leiter, Lawrence A; Franek, Edward

2012-01-01

Insulin degludec/insulin aspart (IDegAsp) is a soluble co-formulation of insulin degludec (70%) and insulin aspart (IAsp: 30%). Here, we compare the efficacy and safety of IDegAsp, an alternative IDegAsp formulation (AF: containing 45% IAsp), and biphasic IAsp 30 (BIAsp 30)....

Issues concerning the determination of solubility products of sparingly soluble crystalline solids. Solubility of HfO{sub 2}(cr)

Energy Technology Data Exchange (ETDEWEB)

Rai, Dhanpat [Rai Enviro-Chem, LLC, Yachats, OR (United States); Kitamura, Akira [Japan Atomic Energy Agency, Ibaraki (Japan); Rosso, Kevin M. [Pacific Northwest National Laboratory, Richland, WA (United States); Sasaki, Takayuki; Kobayashi, Taishi [Kyoto Univ. (Japan)

2016-11-01

Solubility studies were conducted with HfO{sub 2}(cr) solid as a function HCl and ionic strength ranging from 2.0 to 0.004 mol kg{sup -1}. These studies involved (1) using two different amounts of the solid phase, (2) acid washing the bulk solid phase, (3) preheating the solid phase to 1400 C, and (4) heating amorphous HfO{sub 2}(am) suspensions to 90 C to ascertain whether the HfO{sub 2}(am) converts to HfO{sub 2}(cr) and to determine the solubility from the oversaturation direction. Based on the results of these treatments it is concluded that the HfO{sub 2}(cr) contains a small fraction of less crystalline, but not amorphous, material [HfO{sub 2}(lcr)] and this, rather than the HfO{sub 2}(cr), is the solubility-controlling phase in the range of experimental variables investigated in this study. The solubility data are interpreted using both the Pitzer and SIT models and they provide log{sub 10} K{sup 0} values of -(59.75±0.35) and -(59.48±0.41), respectively, for the solubility product of HfO{sub 2}(lcr)[HfO{sub 2}(lcr) + 2H{sub 2}O ↔ Hf{sup 4+} + 4OH{sup -}]. The log{sub 10} of the solubility product of HfO{sub 2}(cr) is estimated to be < -63. The observation of a small fraction of less crystalline higher solubility material is consistent with the general picture that mineral surfaces are often structurally and/or compositionally imperfect leading to a higher solubility than the bulk crystalline solid. This study stresses the urgent need, during interpretation of solubility data, of taking precautions to make certain that the observed solubility behavior for sparingly-soluble solids is assigned to the proper solid phase.

Elevated CO{sub 2} and development of frost hardiness in Norway spruce (picea abies (L.) Karst.); Oekt CO{sub 2} og utvikling av frostherdighet i gran

Energy Technology Data Exchange (ETDEWEB)

Dalen, Lars Sandved

1998-09-01

This thesis discusses controlled laboratory experiments carried out to study the effects of CO{sub 2} pollution on Norwegian spruce. It was found that elevated CO{sub 2} increased height growth and biomass production. It slightly increased frost hardiness, but only at high nitrogen values. There was no evidence of adverse effects of elevated CO{sub 2} on the phenology of bud set and the development of frost hardiness. Although not statistically significant, there seemed to be a consistently higher concentration of soluble carbohydrates in one-season-old Norway spruce seedlings treated with elevated CO{sub 2}. This was not found in three-year-old seedlings grown in open top chambers, possibly indicating a down-regulation of photosynthesis or a transition from free to predetermined growth, and change in allocation of photosynthates with age. Treatment with high or low concentrations of CO{sub 2} and nitrogen fertilizer did not affect apoplastic chitinolytic activity during cold acclimation, nor were there any effects on antifreeze activity in these apoplastic extracts from cold acclimated needles. 149 refs., 21 figs., 8 tabs.

Synthesis and solubility measurement in supercritical carbon dioxide of two solid derivatives of 2-methylnaphthalene-1,4-dione (menadione): 2-(Benzylamino)-3-methylnaphthalene-1,4-dione and 3-(phenethylamino)-2-methylnaphthalene-1,4-dione

International Nuclear Information System (INIS)

Zacconi, Flavia C.; Nuñez, Olga N.; Cabrera, Adolfo L.; Valenzuela, Loreto M.

2016-01-01

Highlights: • Two menadione derivatives were synthesized, purified and characterized. • Solubility of menadione derivatives in SC-CO 2 was measured at T < 333 K, p < 28 MPa. • Thermodynamic consistency of solubility data measured was evaluated. • Solubility data was correlated in terms of temperature and CO 2 density. - Abstract: Synthesis of two solid derivatives of vitamin K 3 (2-methylnaphthalene-1,4-dione or menadione), 2-(benzylamino)-3-methylnaphthalene-1,4-dione and 3-(phenethylamino)-2-methylnaphthalene-1,4-dione was completed using a 1,4 Michael addition reaction at 323 K in an inert atmosphere, with reaction yields of 62% mol·mol −1 and 71% mol·mol −1 , respectively, and a purity grade of 98% mol·mol −1 for each component. Isothermal solubility (mole fraction) of each solid derivative in supercritical carbon dioxide was performed using an analytic-recirculation methodology, with direct determination of the molar composition of the carbon dioxide-rich phase by using high performance liquid chromatography, at temperatures of (313, 323 and 333) K and pressures from (8–28) MPa. Results indicated that the range of measured solubilities were from (59 × 10 −6 to 368 × 10 −6 ) mol·mol −1 for solid 2-(benzylamino)-3-methylnaphthalene-1,4-dione and from (40 × 10 −6 to 205 × 10 −6 ) mol·mol −1 for solid 3-(phenethylamino)-2-methylnaphthalene-1,4-dione. The experimental solubility was validated using three approaches, estimating the combined expanded uncertainty of measurement for each solubility data point, evaluating the thermodynamic consistency of the data utilizing a test based on the Gibbs–Duhem equation, and verifying the self-consistency by correlating the experimental solubility values with a semi-empirical model as a function of temperature, pressure and pure carbon dioxide density.

Atomistic simulation of CO 2 solubility in poly(ethylene oxide) oligomers

KAUST Repository

Hong, Bingbing

2013-10-02

We have performed atomistic molecular dynamics simulations coupled with thermodynamic integration to obtain the excess chemical potential and pressure-composition phase diagrams for CO2 in poly(ethylene oxide) oligomers. Poly(ethylene oxide) dimethyl ether, CH3O(CH 2CH2O)nCH3 (PEO for short) is a widely applied physical solvent that forms the major organic constituent of a class of novel nanoparticle-based absorbents. Good predictions were obtained for pressure-composition-density relations for CO2 + PEO oligomers (2 ≤ n ≤ 12), using the Potoff force field for PEO [J. Chem. Phys. 136, 044514 (2012)] together with the TraPPE model for CO2 [AIChE J. 47, 1676 (2001)]. Water effects on Henrys constant of CO2 in PEO have also been investigated. Addition of modest amounts of water in PEO produces a relatively small increase in Henrys constant. Dependence of the calculated Henrys constant on the weight percentage of water falls on a temperature-dependent master curve, irrespective of PEO chain length. © 2013 Taylor & Francis.

High temperature H2/CO2 separation using cobalt oxide silica membranes

Energy Technology Data Exchange (ETDEWEB)

Smart, S.; Diniz da Costa, J.C. [The University of Queensland, FIMLab - Films and Inorganic Membrane Laboratory, School of Chemical Engineering, Brisbane, Qld 4072 (Australia); Vente, J.F. [Energy research Centre of the Netherlands ECN, P.O. Box 1, 1755 ZG Petten (Netherlands)

2012-09-15

In this work high quality cobalt oxide silica membranes were synthesized on alumina supports using a sol-gel, dip coating method. The membranes were subsequently connected into a steel module using a graphite based proprietary sealing method. The sealed membranes were tested for single gas permeance of He, H2, N2 and CO2 at temperatures up to 600C and feed pressures up to 600 kPa. Pressure tests confirmed that the sealing system was effective as no gas leaks were observed during testing. A H2 permeance of 1.9 x 10{sup -7} mol m{sup -2} s{sup -1} Pa-1 was measured in conjunction with a H2/CO2 permselectivity of more than 1500, suggesting that the membranes had a very narrow pore size distribution and an average pore diameter of approximately 3 Angstrom. The high temperature testing demonstrated that the incorporation of cobalt oxide into the silica matrix produced a structure with a higher thermal stability, able to resist thermally induced densification up to at least 600C. Furthermore, the membranes were tested for H2/CO2 binary feed mixtures between 400 and 600C. At these conditions, the reverse of the water gas shift reaction occurred, inadvertently generating CO and water which increased as a function of CO2 feed concentration. The purity of H2 in the permeate stream significantly decreased for CO2 feed concentrations in excess of 50 vol%. However, the gas mixtures (H2, CO2, CO and water) had a more profound effect on the H2 permeate flow rates which significantly decreased, almost exponentially as the CO2 feed concentration increased.

Pressure, O2, and CO2, in aquatic Closed Ecological Systems

Science.gov (United States)

Taub, Frieda B.; McLaskey, Anna K.

2013-03-01

Pressure increased during net photosynthetic O2 production in the light and decreased during respiratory O2 uptake during the dark in aquatic Closed Ecological Systems (CESs) with small head gas volumes. Because most CO2 will be in the liquid phase as bicarbonate and carbonate anions, and CO2 is more soluble than O2, volumes of gaseous CO2 and gaseous O2 will not change in a compensatory manner, leading to the development of pressure. Pressure increases were greatest with nutrient rich medium with NaHCO3 as the carbon source. With more dilute media, pressure was greatest with NaHCO3, and less with cellulose or no-added carbon. Without adequate turbulence, pressure measurements lagged dissolved O2 concentrations by several hours and dark respiration would have been especially underestimated in our systems (250-1000 ml). With adequate turbulence (rotary shaker), pressure measurements and dissolved O2 concentrations generally agreed during lights on/off cycles, but O2 measurements provided more detail. At 20 °C, 29.9 times as much O2 will distribute into the gas phase as in the liquid, per unit volume, as a result of the limited solubility of O2 in water and according to Henry's Law. Thus even a small head gas volume can contain more O2 than a larger volume of water. When both dissolved and gaseous O2 and CO2 are summed, the changes in Total O2 and CO2 are in relatively close agreement when NaHCO3 is the carbon source. These findings disprove an assumption made in some of Taub's earlier research that aquatic CESs would remain at approximately atmospheric pressure because approximately equal molar quantities of O2 and CO2 would exchange during photosynthesis and respiration; this assumption neglected the distribution of O2 between water and gas phases. High pressures can occur when NaHCO3 is the carbon source in nutrient rich media and if head-gas volumes are small relative to the liquid volume; e.g., one "worse case" condition developed 800 mm Hg above atmospheric

Experimental measurements of vapor-liquid equilibria of the H2O + CO2 + CH4 ternary system

Science.gov (United States)

Qin, J.; Rosenbauer, R.J.; Duan, Zhenhao

2008-01-01

Reported are the experimental measurements on vapor-liquid equilibria in the H2O + CO2 + CH4 ternary system at temperatures from (324 to 375) K and pressures from (10 to 50) MPa. The results indicate that the CH4 solubility in the ternary mixture is about 10 % to 40 % more than that calculated by interpolation from the Henry's law constants of the binary system, H2O + CH4, and the solubility of CO2 is 6 % to 20 % more than what is calculated by the interpolation from the Henry's law constants of the binary mixture, H 2O + CO2. ?? 2008 American Chemical Society.

Sequestering CO2 by mineralization into useful nesquehonite-based products

Directory of Open Access Journals (Sweden)

Fredrik Paul Glasser

2016-02-01

Full Text Available The precipitation of magnesium hydroxy-carbonate hydrates has been suggested as a route to sequester CO2 into solids. We report the development of self-cementing compositions based on nesquehonite, MgCO3·3H2O, that are made from CO2-containing gas streams, the CO2 being separated from other gases by its high solubility in alkaline water, while magnesium is typically provided by waste desalination brines. Precipitation conditions are adjusted to optimize the formation of nesquehonite and the crystalline solid can readily be washed free of chloride. Products can be prepared to achieve self-cementation following two routes: (i thermal activation of the nesquehonite then rehydration of the precursor or (ii direct curing of a slurry of nesquehonite. The products thus obtained contain ~ 30 wt% CO2 and could form the basis for a new generation of lightweight, thermally insulating boards, blocks and panels, with sufficient strength for general construction.

Study of the synthesis and self-assembly of CO2-philic copolymers with complexing groups: application to decontamination in supercritical CO2 medium

International Nuclear Information System (INIS)

Ribaut, T.

2009-10-01

In the frame of sustainable development, a priority is to decrease the volume of nuclear wastes. The use of supercritical carbon dioxide (scCO 2 ) could allow to solve this problem. The aim of this study is to extract an ionic or particle cobalt contamination deposited on textile lab coats. The strategy uses CO 2 -philic/CO 2 -phobic copolymers soluble in scCO 2 and containing complexing groups. This approach combines the use of amphiphilic copolymers for steric stabilization of particles, of surfactants able to self-assemble to promote extraction and of ligands. Controlled radical polymerization is used to synthesize fluorinated gradient or block copolymers. Cloud point curves of the copolymers are determined experimentally in scCO 2 . Prediction of polymer/scCO 2 phase diagrams was assessed by Perturbed-Chain Statistical Associating Fluid Theory (PC-SAFT) modeling. Gradient copolymers appear more advantageous than block copolymers due to their solubility in much milder conditions of pressure and temperature. Small-angle neutron scattering (SANS) allowed us to evidence the pressure-induced aggregation of the gradient copolymers in scCO 2 . Their interface properties were demonstrated: they allow to form water-in-CO 2 microemulsions and to stabilize cobalt hydroxide dispersions in scCO 2 . Lastly, in presence of a very low quantity of water, Co 2+ ions were removed with a rate of 37 % from a cotton/polyester matrix by a gradient copolymer. (author)

High CO/sub 2/ partial pressure effects on dark and light CO/sub 2/ fixation and metabolism in Vicia faba leaves

Energy Technology Data Exchange (ETDEWEB)

Coudret, A.; Ferron, F.; Laffray, D.

1985-01-01

Stomatal opening on Vicia faba can be induced by high CO/sub 2/ partial pressures (10.2%) in dark as well as in light. Stomatal aperture was measured in both cases with a hydrogen porometer. The distribution of /sup 14/C among early products of photosynthesis was studied. Comparisons are made with carboxylations occurring when stomata were open in the dark with CO/sub 2/-free air and in light with 0.034% CO/sub 2/. Results showed that in high CO/sub 2/ partial pressure in light, less radioactivity was incorporated in Calvin cycle intermediates and more in sucrose. ..beta.. carboxylations and photorespiration seemed to be inhibited. In the dark in both CO/sub 2/ conditions, /sup 14/C incorporation was found in malate and aspartate but also in serine and glycerate in high CO/sub 2/ conditions. In light these changes in metabolic pathways may be related with the deleterious effects recorded on leaves after long-term expositions to high partial pressure of CO/sub 2/.

High-performance cobalt carbonate hydroxide nano-dot/NiCo(CO3)(OH)2 electrode for asymmetric supercapacitors

Science.gov (United States)

Lee, Damin; Xia, Qi Xun; Yun, Je Moon; Kim, Kwang Ho

2018-03-01

Binder-free mesoporous NiCo(CO3)(OH)2 nanowire arrays were grown using a facile hydrothermal technique. The Co2(CO3)(OH)2 in NiCo(CO3)(OH)2 nanowire arrays was well-decorated as nano-dot scale (a few nanometer). In addition, increasing cobalt content in nickel compound matrix, NiCo(CO3)(OH)2 nanowire arrays were separately uniformly grown without agglomeration on Ni foam, providing a high specific surface area to help electrolyte access and ion transfer. The enticing composition and morphology of the NiCo(CO3)(OH)2 nanowire exhibit a superior specific capacity of 1288.2 mAh g-1 at a current density of 3 A g-1 and excellent cycling stability with the capacity retention of 80.7% after 10,000 cycles. Furthermore, an asymmetric supercapacitor composed of the NiCo(CO3)(OH)2 composite as a positive electrode and the graphene as a negative electrode presented a high energy density of 35.5 W h kg-1 at a power density of 2555.6 W kg-1 and satisfactory cycling stability with 71.3% capacity retention after 10,000 cycles. The great combination of the active nano-dot Co2(CO3)(OH)2 and the individually grown NiCo(CO3)(OH)2 nanowires made it a promising electrode material for asymmetric supercapacitors. A well-developed nanoarchitecture of the nano-dot Co2(CO3)(OH)2 decorated NiCo(CO3)(OH)2 composite could pave the way for an excellent electrode design for high-performance supercapacitors.

Alkaline-earth metal bicarbonates as lixiviants for uranium (VI) under CO2 sparging

International Nuclear Information System (INIS)

Vaziri, F.; White, D.A.

1989-01-01

In recent years it has become apparent that uranium is significantly soluble in solutions of alkaline-earth metal bicarbonates -particularly those of magnesium and calcium. A system has been proposed by previous authors in which milled uranium ore is leached in a medium to which an oxidizing agent, the metal hydroxide and CO 2 are added. The alkaline-earth metal hydroxides are much more readily soluble in this medium than the corresponding carbonates. Magnesium and calcium bicarbonates are quite soluble in aqueous media at neutral or nearly neutral pH. The pH determines the relative quantities of bicarbonate and carbonate ions in the system. Even if the pH is quite low, small amounts of carbonate ion are present that can complex with the uranyl ion to produce anionic uranyl complexes. Both UO 2 (CO 3 ) 2 2- and UO 2 (CO 3 ) 3 4- complexes are known and both have a very high stability constant. Despite the appearance of several patents on the use of alkaline-earth metal ions in carbonate media as uranium lixiviants, little theoretical or experimental work on the system has been published. In view of the potential of these systems for cheap, large-scale dissolution of uranium the present contribution will discuss the theory behind this method and provide some experimental data to verify the theoretical treatment. (author)

Dual Phase Membrane for High Temperature CO2 Separation

Energy Technology Data Exchange (ETDEWEB)

Jerry Lin

2007-06-30

This project aimed at synthesis of a new inorganic dual-phase carbonate membrane for high temperature CO{sub 2} separation. Metal-carbonate dual-phase membranes were prepared by the direct infiltration method and the synthesis conditions were optimized. Permeation tests for CO{sub 2} and N{sub 2} from 450-750 C showed very low permeances of those two gases through the dual-phase membrane, which was expected due to the lack of ionization of those two particular gases. Permeance of the CO{sub 2} and O{sub 2} mixture was much higher, indicating that the gases do form an ionic species, CO{sub 3}{sup 2-}, enhancing transport through the membrane. However, at temperatures in excess of 650 C, the permeance of CO{sub 3}{sup 2-} decreased rapidly, while predictions showed that permeance should have continued to increase with temperature. XRD data obtained from used membrane indicated that lithium iron oxides formed on the support surface. This lithium iron oxide layer has a very low conductivity, which drastically reduces the flow of electrons to the CO{sub 2}/O{sub 2} gas mixture; thus limiting the formation of the ionic species required for transport through the membrane. These results indicated that the use of stainless steel supports in a high temperature oxidative environment can lead to decreased performance of the membranes. This revelation created the need for an oxidation resistant support, which could be gained by the use of a ceramic-type membrane. Work was extended to synthesize a new inorganic dual-phase carbonate membrane for high temperature CO{sub 2} separation. Helium permeance of the support before and after infiltration of molten carbonate are on the order of 10{sup -6} and 10{sup -10} moles/m{sup 2} {center_dot} Pa {center_dot} s respectively, indicating that the molten carbonate is able to sufficiently infiltrate the membrane. It was found that La{sub 0.6}Sr{sub 0.4}Co{sub 0.8}Fe{sub 0.2}O{sub 3-{delta}} (LSCF) was a suitable candidate for the support

Synthesis gas solubility in Fischer-Tropsch slurry: Final report

Energy Technology Data Exchange (ETDEWEB)

Chao, K.C.; Lin, H.M.

1988-01-01

The objective is to investigate the phase equilibrium behavior of synthesis gases and products in a Fischer-Tropsch slurry reactor. A semi-flow apparatus has been designed and constructed for this purpose. Measurements have been made for hydrogen, cabon monoxide, methane, ethane, ethylene, and carbon dioxide in a heavy n-paraffin at temperatures from 100 to 300)degree)C and pressures 10 to 50 atm. Three n-paraffin waxes: n-eicosane (n-C/sub 20/), n-octacosane )n-C/sub 28/), and n-hexatriacontane (n-C/sub 36/), were studied to model the industrial wax. Solubility of synthesis gas mixtures of H/sub 2/ and CO in n-C/sub 28/ was also determined at two temperatures (200 and 300)degree)C) for each of three gas compositions (40.01, 50.01, and 66.64 mol%) of hydrogen). Measurements were extended to investigate the gas solubility in two industrial Fischer-Tropsch waxes: Mobilwax and SASOL wax. Observed solubility increases in the order: H/sub 2/, CO, CH/sub 4/, CO/sub 2/, C/sub 2/H/sub 4/, C/sub 2/H/sub 6/, at a given temperature pressure, and in the same solvent. Solubility increases with increasing pressure for all the gases. Lighter gases H/sub 2/ and CO show increased solubility with increasing temperature, while the heavier gases CO/sub 2/, ethane, and ethylene show decreased solubility with increasing temperature. The solubility of methane, the intermediate gas, changes little with temperature, and shows a shallow minimum at about 200)degrees)C or somewhat above. Henry's constant and partial molal volume of the gas solute at infinite dilution are determinedfrom the gas solubility data. A correlation is developed from the experimental data in the form on an equation of state. A computer program has been prepared to implement the correlation. 19 refs., 66 figs., 39 tabs.

Phase Equilibria of Sn-Co-Cu Ternary System

Science.gov (United States)

Chen, Yu-Kai; Hsu, Chia-Ming; Chen, Sinn-Wen; Chen, Chih-Ming; Huang, Yu-Chih

2012-10-01

Sn-Co-Cu ternary alloys are promising lead-free solders, and isothermal sections of Sn-Co-Cu phase equilibria are fundamentally important for the alloys' development and applications. Sn-Co-Cu ternary alloys were prepared and equilibrated at 523 K, 1073 K, and 1273 K (250 °C, 800 °C, and 1000 °C), and the equilibrium phases were experimentally determined. In addition to the terminal solid solutions and binary intermetallic compounds, a new ternary compound, Sn3Co2Cu8, was found. The solubilities of Cu in the α-CoSn3 and CoSn2 phases at 523 K (250 °C) are 4.2 and 1.6 at. pct, respectively, while the Cu solubility in the α-Co3Sn2 phase is as high as 20.0 at. pct. The Cu solubility increases with temperature and is around 30.0 at. pct in the β-Co3Sn2 at 1073 K (800 °C). The Co solubility in the η-Cu6Sn5 phase is also significant and is 15.5 at. pct at 523 K (250 °C).

Influence of methane in CO2 transport and storage for CCS technology.

Science.gov (United States)

Blanco, Sofía T; Rivas, Clara; Fernández, Javier; Artal, Manuela; Velasco, Inmaculada

2012-12-04

CO(2) Capture and Storage (CCS) is a good strategy to mitigate levels of atmospheric greenhouse gases. The type and quantity of impurities influence the properties and behavior of the anthropogenic CO(2), and so must be considered in the design and operation of CCS technology facilities. Their study is necessary for CO(2) transport and storage, and to develop theoretical models for specific engineering applications to CCS technology. In this work we determined the influence of CH(4), an important impurity of anthropogenic CO(2), within different steps of CCS technology: transport, injection, and geological storage. For this, we obtained new pressure-density-temperature (PρT) and vapor-liquid equilibrium (VLE) experimental data for six CO(2) + CH(4) mixtures at compositions which represent emissions from the main sources in the European Union and United States. The P and T ranges studied are within those estimated for CO(2) pipelines and geological storage sites. From these data we evaluated the minimal pressures for transport, regarding the density and pipeline's capacity requirements, and values for the solubility parameter of the mixtures, a factor which governs the solubility of substances present in the reservoir before injection. We concluded that the presence of CH(4) reduces the storage capacity and increases the buoyancy of the CO(2) plume, which diminishes the efficiency of solubility and residual trapping of CO(2), and reduces the injectivity into geological formations.

High affinity soluble ILT2 receptor: a potent inhibitor of CD8(+) T cell activation.

Science.gov (United States)

Moysey, Ruth K; Li, Yi; Paston, Samantha J; Baston, Emma E; Sami, Malkit S; Cameron, Brian J; Gavarret, Jessie; Todorov, Penio; Vuidepot, Annelise; Dunn, Steven M; Pumphrey, Nicholas J; Adams, Katherine J; Yuan, Fang; Dennis, Rebecca E; Sutton, Deborah H; Johnson, Andy D; Brewer, Joanna E; Ashfield, Rebecca; Lissin, Nikolai M; Jakobsen, Bent K

2010-12-01

Using directed mutagenesis and phage display on a soluble fragment of the human immunoglobulin super-family receptor ILT2 (synonyms: LIR1, MIR7, CD85j), we have selected a range of mutants with binding affinities enhanced by up to 168,000-fold towards the conserved region of major histocompatibility complex (MHC) class I molecules. Produced in a dimeric form, either by chemical cross-linking with bivalent polyethylene glycol (PEG) derivatives or as a genetic fusion with human IgG Fc-fragment, the mutants exhibited a further increase in ligand-binding strength due to the avidity effect, with resident half-times (t(1/2)) on the surface of MHC I-positive cells of many hours. The novel compounds antagonized the interaction of CD8 co-receptor with MHC I in vitro without affecting the peptide-specific binding of T-cell receptors (TCRs). In both cytokine-release assays and cell-killing experiments the engineered receptors inhibited the activation of CD8(+) cytotoxic T lymphocytes (CTLs) in the presence of their target cells, with subnanomolar potency and in a dose-dependent manner. As a selective inhibitor of CD8(+) CTL responses, the engineered high affinity ILT2 receptor presents a new tool for studying the activation mechanism of different subsets of CTLs and could have potential for the development of novel autoimmunity therapies.

Pore scale study of multiphase multicomponent reactive transport during CO2 dissolution trapping

Science.gov (United States)

Chen, Li; Wang, Mengyi; Kang, Qinjun; Tao, Wenquan

2018-06-01

Solubility trapping is crucial for permanent CO2 sequestration in deep saline aquifers. For the first time, a pore-scale numerical method is developed to investigate coupled scCO2-water two-phase flow, multicomponent (CO2(aq), H+, HCO3-, CO32- and OH-) mass transport, heterogeneous interfacial dissolution reaction, and homogeneous dissociation reactions. Pore-scale details of evolutions of multiphase distributions and concentration fields are presented and discussed. Time evolutions of several variables including averaged CO2(aq) concentration, scCO2 saturation, and pH value are analyzed. Specific interfacial length, an important variable which cannot be determined but is required by continuum models, is investigated in detail. Mass transport coefficient or efficient dissolution rate is also evaluated. The pore-scale results show strong non-equilibrium characteristics during solubility trapping due to non-uniform distributions of multiphase as well as slow mass transport process. Complicated coupling mechanisms between multiphase flow, mass transport and chemical reactions are also revealed. Finally, effects of wettability are also studied. The pore-scale studies provide deep understanding of non-linear non-equilibrium multiple physicochemical processes during CO2 solubility trapping processes, and also allow to quantitatively predict some important empirical relationships, such as saturation-interfacial surface area, for continuum models.

Regional impacts of climate change and atmospheric CO2 on future ocean carbon uptake: a multi model linear feedback analysis

International Nuclear Information System (INIS)

Roy, Tilla; Bopp, Laurent; Gehlen, Marion; Cadule, Patricia; Schneider, Birgit; Frolicher, Thomas L.; Segschneider, Joachim; Tjiputra, Jerry; Heinze, Christoph; Joos, Fortunat

2011-01-01

The increase in atmospheric CO 2 over this century depends on the evolution of the oceanic air-sea CO 2 uptake, which will be driven by the combined response to rising atmospheric CO 2 itself and climate change. Here, the future oceanic CO 2 uptake is simulated using an ensemble of coupled climate-carbon cycle models. The models are driven by CO 2 emissions from historical data and the Special Report on Emissions Scenarios (SRES) A2 high-emission scenario. A linear feedback analysis successfully separates the regional future (2010-2100) oceanic CO 2 uptake into a CO 2 -induced component, due to rising atmospheric CO 2 concentrations, and a climate-induced component, due to global warming. The models capture the observation based magnitude and distribution of anthropogenic CO 2 uptake. The distributions of the climate-induced component are broadly consistent between the models, with reduced CO 2 uptake in the sub polar Southern Ocean and the equatorial regions, owing to decreased CO 2 solubility; and reduced CO 2 uptake in the mid-latitudes, owing to decreased CO 2 solubility and increased vertical stratification. The magnitude of the climate-induced component is sensitive to local warming in the southern extra-tropics, to large freshwater fluxes in the extra-tropical North Atlantic Ocean, and to small changes in the CO 2 solubility in the equatorial regions. In key anthropogenic CO 2 uptake regions, the climate-induced component offsets the CO 2 - induced component at a constant proportion up until the end of this century. This amounts to approximately 50% in the northern extra-tropics and 25% in the southern extra-tropics and equatorial regions. Consequently, the detection of climate change impacts on anthropogenic CO 2 uptake may be difficult without monitoring additional tracers, such as oxygen. (authors)

Regional impacts of climate change and atmospheric CO2 on future ocean carbon uptake: a multi model linear feedback analysis

International Nuclear Information System (INIS)

Roy, Tilla; Bopp, Laurent; Gehlen, Marion; Cadule, Patricia

2011-01-01

The increase in atmospheric CO 2 over this century depends on the evolution of the oceanic air-sea CO 2 uptake, which will be driven by the combined response to rising atmospheric CO 2 itself and climate change. Here, the future oceanic CO 2 uptake is simulated using an ensemble of coupled climate-carbon cycle models. The models are driven by CO 2 emissions from historical data and the Special Report on Emissions Scenarios (SRES) A2 high-emission scenario. A linear feedback analysis successfully separates the regional future (2010-2100) oceanic CO 2 uptake into a CO 2 -induced component, due to rising atmospheric CO 2 concentrations, and a climate-induced component, due to global warming. The models capture the observation based magnitude and distribution of anthropogenic CO 2 uptake. The distributions of the climate-induced component are broadly consistent between the models, with reduced CO 2 uptake in the sub-polar Southern Ocean and the equatorial regions, owing to decreased CO 2 solubility; and reduced CO 2 uptake in the mid latitudes, owing to decreased CO 2 solubility and increased vertical stratification. The magnitude of the climate-induced component is sensitive to local warming in the southern extra tropics, to large freshwater fluxes in the extra tropical North Atlantic Ocean, and to small changes in the CO 2 solubility in the equatorial regions. In key anthropogenic CO 2 uptake regions, the climate-induced component offsets the CO 2 - induced component at a constant proportion up until the end of this century. This amounts to approximately 50% in the northern extra tropics and 25% in the southern extra tropics and equatorial regions. Consequently, the detection of climate change impacts on anthropogenic CO 2 uptake may be difficult without monitoring additional tracers, such as oxygen. (authors)

Global high-resolution monthly pCO2 climatology for the coastal ocean derived from neural network interpolation

Directory of Open Access Journals (Sweden)

G. G. Laruelle

2017-10-01

temperature-induced changes in solubility but are also the result of seasonal changes in circulation, mixing and biological productivity. Our results also reveal that the amplitudes of both thermal and nonthermal seasonal variations in pCO2 are significantly larger at high latitudes. Finally, because this product's spatial extent includes parts of the open ocean as well, it can be readily merged with existing global open-ocean products to produce a true global perspective of the spatial and temporal variability of surface ocean pCO2.

Process for analyzing CO{sub 2} in seawater

Science.gov (United States)

Atwater, J.E.; Akse, J.R.; DeHart, J.

1997-07-01

The process of this invention comprises providing a membrane for separating CO{sub 2} into a first CO{sub 2} sample phase and a second CO{sub 2} analyte phase. CO{sub 2} is then transported through the membrane thereby separating the CO{sub 2} with the membrane into a first CO{sub 2} sample phase and a second CO{sub 2} analyte liquid phase including an ionized, conductive, dissociated CO{sub 2} species. Next, the concentration of the ionized, conductive, dissociated CO{sub 2} species in the second CO{sub 2} analyte liquid phase is chemically amplified using a water-soluble chemical reagent which reversibly reacts with undissociated CO{sub 2} to produce conductivity changes therein corresponding to fluctuations in the partial pressure of CO{sub 2} in the first CO{sub 2} sample phase. Finally, the chemically amplified, ionized, conductive, dissociated CO{sub 2} species is introduced to a conductivity measuring instrument. Conductivity changes in the chemically amplified, ionized, conductive, dissociated CO{sub 2} species are detected using the conductivity measuring instrument. 43 figs.

Process for analyzing CO.sub.2 in seawater

Science.gov (United States)

Atwater, James E.; Akse, James R.; DeHart, Jeffrey

1997-01-01

The process of this invention comprises providing a membrane for separating CO.sub.2 into a first CO.sub.2 sample phase and a second CO.sub.2 analyte phase. CO.sub.2 is then transported through the membrane thereby separating the CO.sub.2 with the membrane into a first CO.sub.2 sample phase and a second CO.sub.2 analyte liquid phase including an ionized, conductive, dissociated CO.sub.2 species. Next, the concentration of the ionized, conductive, dissociated CO.sub.2 species in the second CO.sub.2 analyte liquid phase is chemically amplified using a water-soluble chemical reagent which reversibly reacts with undissociated CO.sub.2 to produce conductivity changes therein corresponding to fluctuations in the partial pressure of CO.sub.2 in the first CO.sub.2 sample phase. Finally, the chemically amplified, ionized, conductive, dissociated CO.sub.2 species is introduced to a conductivity measuring instrument. Conductivity changes in the chemically amplified, ionized, conductive, dissociated CO.sub.2 species are detected using the conductivity measuring instrument.

Solubility of Tc(IV) oxides

International Nuclear Information System (INIS)

Liu, D.J.; Fan, X.H.

2005-01-01

Full text of publication follows: The deep geological disposal of the high level radioactive wastes is expected to be a safer disposal method in most countries. The long-lived fission product 99 Tc is present in large quantities in nuclear wastes and its chemical behavior in aqueous solution is of considerable interest. Under the reducing conditions, expected to exist in a deep geological repository, it is generally predicted that technetium will be present as TcO 2 .nH 2 O. The solubility of Tc(IV) is used as a source term in performance assessment of radioactive waste repository. Technetium oxide was prepared by reduction of a technetate solution with Sn 2+ . The solubility of Tc(IV) oxide has been determined in simulated groundwater and re-distilled water under aerobic and anaerobic conditions. The effects of pH and CO 3 2- concentration of solution on solubility of Tc(IV) oxide were studied. The concentration of total technetium and Tc(IV) species in the solutions were periodically determined by separating the oxidized and reduced technetium species using a solvent extraction procedure and counting the beta activity of the 99 Tc with a liquid scintillation counter. The experimental results show that the rate of oxidation of Tc(IV) in simulated groundwater and re-distilled water is about (1.49∼1.86) x 10 -9 mol/(L.d) under aerobic conditions, but Tc(IV) in simulated groundwater and re-distilled water is not oxidized under anaerobic conditions. Under aerobic or anaerobic conditions the solubility of Tc(IV) oxide in simulated groundwater and re-distilled water is equal on the whole after centrifugation or ultrafiltration. The solubility of Tc(IV) oxide decreases with the increase of pH at pH 10 and is pH independent in the range 2 -8 to 10 -9 mol/L at 2 3 2- concentration. These data could be used to estimate the Tc(IV) solubility for cases where solubility limits transport of technetium in reducing environments of high-level waste repositories. (authors)

Synthesis and characterization of water-soluble SiO{sub 1.5}/TiO{sub 2} hybrid nanoparticles by hydrolytic co-condensation of triethoxysilane containing hydroxyl groups

Energy Technology Data Exchange (ETDEWEB)

Mori, Hideharu [Department of Polymer Science and Engineering, Graduate School of Science and Engineering, Yamagata University, 4-3-16 Jonan, Yonezawa 992-8510 (Japan)], E-mail: h.mori@yz.yamagata-u.ac.jp; Miyamura, Yasushi [Department of Polymer Science and Engineering, Graduate School of Science and Engineering, Yamagata University, 4-3-16 Jonan, Yonezawa 992-8510 (Japan); Endo, Takeshi [Molecular Engineering Institute, Kinki University, Iizuka, Fukuoka 820-8555 (Japan)

2009-05-15

Novel R-SiO{sub 1.5}/TiO{sub 2} hybrid nanoparticles were synthesized by hydrolytic co-condensation of titanium alkoxides (Ti(OR'){sub 4}, R' = ethyl, isopropyl, and butyl) with a triethoxysilane precursor, R-Si(OCH{sub 2}CH{sub 3}){sub 3}, R = -CH{sub 2}CH{sub 2}CH{sub 2}N(CH{sub 2}CH{sub 2}COOCH{sub 2}CH{sub 2}OH){sub 2}, derived from 2-hydroxyethyl acrylate. Co-condensation of a titanium alkoxide with the triethoxysilane precursor was investigated at different feed ratios, suggesting that water-soluble nanoparticles were obtained only at less than 30% of Ti(OEt){sub 4} molar ratio in the feed. In contrast, the co-condensation of titanium tetraisopropoxide, Ti(O{sup i}Pr){sub 4}, with the triethoxysilane precursor in the presence of acetylacetone proceeded as a homogeneous system until 70% of Ti(O{sup i}Pr){sub 4} molar ratio to afford water-soluble organic-inorganic hybrid nanoparticles containing titania-silica mixed oxides, as confirmed by NMR, FT-IR, elemental and ICP analyses. Scanning force microscopy (SFM) measurements of the product prepared at Ti(O{sup i}Pr){sub 4}/triethoxysilane = 50/50 mol% with acetylacetone indicated the formation of the nanoparticles having relatively narrow size distribution with average particle diameter less than 2.0 nm without aggregation. The refractive index of the hybrid nanoparticle was 1.571. The isolated nanoparticles distributed homogeneously were visualized by transmission electron microscopy (TEM), and the size of the hybrid nanoparticle (1.9 nm) was determined by X-ray diffraction (XRD)

Sequestering CO{sub 2} by Mineralization into Useful Nesquehonite-Based Products

Energy Technology Data Exchange (ETDEWEB)

Glasser, Fredrik Paul, E-mail: f.p.glasser@abdn.ac.uk; Jauffret, Guillaume; Morrison, Jennie [Department of Chemistry, University of Aberdeen, Aberdeen (United Kingdom); Galvez-Martos, Jose-Luis; Patterson, Naomi; Imbabi, Mohammed Salah-Eldin [School of Engineering, University of Aberdeen, Aberdeen (United Kingdom)

2016-02-11

The precipitation of magnesium hydroxy-carbonate hydrates has been suggested as a route to sequester CO{sub 2} into solids. We report the development of self-cementing compositions based on nesquehonite, MgCO{sub 3}⋅3H{sub 2}O, that are made from CO{sub 2}-containing gas streams, the CO{sub 2} being separated from other gases by its high solubility in alkaline water, while magnesium is typically provided by waste desalination brines. Precipitation conditions are adjusted to optimize the formation of nesquehonite and the crystalline solid can readily be washed free of chloride. Products can be prepared to achieve self-cementation following two routes: (i) thermal activation of the nesquehonite then rehydration of the precursor or (ii) direct curing of a slurry of nesquehonite. The products thus obtained contain ~30 wt% CO{sub 2} and could form the basis for a new generation of lightweight, thermally insulating boards, blocks, and panels, with sufficient strength for general construction.

CO2-Philic polymer membrane with extremely high separation performance

KAUST Repository

Yave, Wilfredo

2010-01-12

Polymeric membranes are attractive for CO2 separation and concentration from different gas streams because of their versatility and energy efficiency; they can compete with, and they may even replace, traditional absorption processes. Here we describe a simple and powerful method for developing nanostructured and CO2-philic polymer membranes for CO2 separation. A poly(ethylene oxide)-poly(butylene terephthalate) multiblock copolymer is used as membrane material. Smart additives such as polyethylene glycol dibutyl ether are incorporated as spacers or fillers for producing nanostructured materials. The addition of these specific additives produces CO2-philic membranes and increases the CO2 permeability (750 barrer) up to five-fold without the loss of selectivity. The membranes present outstanding performance for CO2 separation, and the measured CO2 flux is extremely high ( > 2 m3 m -2 h-1 bar-1) with selectivity over H2 and N2 of 10 and 40, respectively, making them attractive for CO 2 capture. © 2009 American Chemical Society.

CO2-Philic polymer membrane with extremely high separation performance

KAUST Repository

Yave, Wilfredo; Car, Anja; Funari, S.; Nunes, Suzana Pereira; Peinemann, Klaus-Viktor

2010-01-01

Polymeric membranes are attractive for CO2 separation and concentration from different gas streams because of their versatility and energy efficiency; they can compete with, and they may even replace, traditional absorption processes. Here we describe a simple and powerful method for developing nanostructured and CO2-philic polymer membranes for CO2 separation. A poly(ethylene oxide)-poly(butylene terephthalate) multiblock copolymer is used as membrane material. Smart additives such as polyethylene glycol dibutyl ether are incorporated as spacers or fillers for producing nanostructured materials. The addition of these specific additives produces CO2-philic membranes and increases the CO2 permeability (750 barrer) up to five-fold without the loss of selectivity. The membranes present outstanding performance for CO2 separation, and the measured CO2 flux is extremely high ( > 2 m3 m -2 h-1 bar-1) with selectivity over H2 and N2 of 10 and 40, respectively, making them attractive for CO 2 capture. © 2009 American Chemical Society.

Physiological effects on fishes in a high-CO2 world

Science.gov (United States)

Ishimatsu, Atsushi; Hayashi, Masahiro; Lee, Kyoung-Seon; Kikkawa, Takashi; Kita, Jun

2005-09-01

Fish are important members of both freshwater and marine ecosystems and constitute a major protein source in many countries. Thus potential reduction of fish resources by high-CO2 conditions due to the diffusion of atmospheric CO2 into the surface waters or direct CO2 injection into the deep sea can be considered as another potential threat to the future world population. Fish, and other water-breathing animals, are more susceptible to a rise in environmental CO2 than terrestrial animals because the difference in CO2 partial pressure (PCO2) of the body fluid of water-breathing animals and ambient medium is much smaller (only a few torr (1 torr = 0.1333 kPa = 1316 μatm)) than in terrestrial animals (typically 30-40 torr). A survey of the literature revealed that hypercapnia acutely affects vital physiological functions such as respiration, circulation, and metabolism, and changes in these functions are likely to reduce growth rate and population size through reproduction failure and change the distribution pattern due to avoidance of high-CO2 waters or reduced swimming activities. This paper reviews the acute and chronic effects of CO2 on fish physiology and tries to clarify necessary areas of future research.

The influence of supercritical carbon dioxide (SC-CO2) processing conditions on drug loading and physicochemical properties.

Science.gov (United States)

Ahern, Robert J; Crean, Abina M; Ryan, Katie B

2012-12-15

Poor water solubility of drugs can complicate their commercialisation because of reduced drug oral bioavailability. Formulation strategies such as increasing the drug surface area are frequently employed in an attempt to increase dissolution rate and hence, improve oral bioavailability. Maximising the drug surface area exposed to the dissolution medium can be achieved by loading drug onto a high surface area carrier like mesoporous silica (SBA-15). The aim of this work was to investigate the impact of altering supercritical carbon dioxide (SC-CO(2)) processing conditions, in an attempt to enhance drug loading onto SBA-15 and increase the drug's dissolution rate. Other formulation variables such as the mass ratio of drug to SBA-15 and the procedure for combining the drug and SBA-15 were also investigated. A model drug with poor water solubility, fenofibrate, was selected for this study. High drug loading efficiencies were obtained using SC-CO(2), which were influenced by the processing conditions employed. Fenofibrate release rate was enhanced greatly after loading onto mesoporous silica. The results highlighted the potential of this SC-CO(2) drug loading approach to improve the oral bioavailability of poorly water soluble drugs. Copyright © 2012 Elsevier B.V. All rights reserved.

Soluble Polymers with Intrinsic Porosity for Flue Gas Purification and Natural Gas Upgrading

KAUST Repository

Wang, Xinbo

2017-01-23

A soluble polymer with intrinsic microporosity, 2,4-diamino-1,3,5-triazine-functionalized organic polymer, is used for the first time as a solid adsorbent which provides an easy solution to overcome the fouling issue. Promising adsorption performances including good CO2 adsorption capacity, excellent CO2 /N2 and CO2 /CH4 selectivities, high chemical and thermal stabilities, and easiness of preparation and regeneration are shown.

Soluble Polymers with Intrinsic Porosity for Flue Gas Purification and Natural Gas Upgrading

KAUST Repository

Wang, Xinbo; Liu, Yang; Ma, Xiaohua; Das, Swapan Kumar; Ostwal, Mayur; Gadwal, Ikhlas; Yao, Kexin; Dong, Xinglong; Han, Yu; Pinnau, Ingo; Huang, Kuo-Wei; Lai, Zhiping

2017-01-01

A soluble polymer with intrinsic microporosity, 2,4-diamino-1,3,5-triazine-functionalized organic polymer, is used for the first time as a solid adsorbent which provides an easy solution to overcome the fouling issue. Promising adsorption performances including good CO2 adsorption capacity, excellent CO2 /N2 and CO2 /CH4 selectivities, high chemical and thermal stabilities, and easiness of preparation and regeneration are shown.

Oysters and eelgrass: potential partners in a high pCO2 ocean.

Science.gov (United States)

Groner, Maya L; Burge, Colleen A; Cox, Ruth; Rivlin, Natalie; Turner, Mo; Van Alstyne, Kathryn L; Wyllie-Echeverria, Sandy; Bucci, John; Staudigel, Philip; Friedman, Carolyn S

2018-05-25

Climate change is affecting the health and physiology of marine organisms and altering species interactions. Ocean acidification (OA) threatens calcifying organisms such as the Pacific oyster, Crassostrea gigas. In contrast, seagrasses, such as the eelgrass Zostera marina, can benefit from the increase in available carbon for photosynthesis found at a lower seawater pH. Seagrasses can remove dissolved inorganic carbon from OA environments, creating local daytime pH refugia. Pacific oysters may improve the health of eelgrass by filtering out pathogens such as Labyrinthula zosterae (LZ), which causes eelgrass wasting disease (EWD). We examined how co-culture of eelgrass ramets and juvenile oysters affected the health and growth of eelgrass and the mass of oysters under different pCO 2 exposures. In Phase I, each species was cultured alone or in co-culture at 12°C across ambient, medium, and high pCO 2 conditions, (656, 1158 and1606 μatm pCO 2 , respectively). Under high pCO 2 , eelgrass grew faster and had less severe EWD (contracted in the field prior to the experiment). Co-culture with oysters also reduced the severity of EWD. While the presence of eelgrass decreased daytime pCO 2 , this reduction was not substantial enough to ameliorate the negative impact of high pCO 2 on oyster mass. In Phase II, eelgrass alone or oysters and eelgrass in co-culture were held at 15°C under ambient and high pCO 2 conditions, (488 and 2013 μatm pCO 2 , respectively). Half of the replicates were challenged with cultured LZ. Concentrations of defensive compounds in eelgrass (total phenolics and tannins), were altered by LZ exposure and pCO 2 treatments. Greater pathogen loads and increased EWD severity were detected in LZ exposed eelgrass ramets; EWD severity was reduced at high relative to low pCO 2 . Oyster presence did not influence pathogen load or EWD severity; high LZ concentrations in experimental treatments may have masked the effect of this treatment. Collectively, these

The 2ν2 bands of H212CO and H213CO by high-resolution FTIR spectroscopy

Science.gov (United States)

Tan, T. L.; A'dawiah, Rabia'tul; Ng, L. L.

2017-10-01

The Fourier transform infrared (FTIR) absorption spectra of the 2ν2 overtone bands of formaldehyde H212CO and its isotopologue H213CO were recorded at an unapodized resolution of 0.0063 cm-1 in the 3300-3540 cm-1 region. Upper state (v2 = 2) rovibrational up to two sextic centrifugal distortion constants were accurately determined for both H212CO and H213CO. A total of 533 unperturbed infrared transitions of H212CO and 466 unperturbed infrared transitions of H212CO were assigned and fitted with rms deviations of 0.0012 cm-1 and 0.00084 cm-1 respectively using Watson's A-reduced Hamiltonian in the Ir representation. Analysis of new transitions for H212CO measured in this work yielded upper state constants with greater accuracy than previously reported. The infrared transitions of the 2ν2 band of H213CO were measured for the first time. The band center of the A-type 2ν2 band of H212CO was found to be 3471.71403 ± 0.00012 cm-1 and that of H213CO was 3396.628983 ± 0.000083 cm-1. Furthermore, the newly assigned high-resolution infrared lines of the 2ν2 bands in the 3300-3540 cm-1 region can be useful in detecting the H212CO and H213CO molecules in this IR region.

Tetraphenylborate Solubility in High Ionic Strength Salt Solutions

International Nuclear Information System (INIS)

Serkiz, S.M.; Ginn, J.D.; Jurgensen, A.R.

1998-04-01

Solubility of sodium and potassium salts of the tetraphenylborate ion (TPB) in simulated Savannah River Site High Level Waste was investigated. Data generated from this study allow more accurate predictions of TPB solubility at the In-Tank Precipitation (ITP) facility. Because previous research showed large deviations in the observed solubility of TPB salts when compared with model predictions, additional data were generated to better understand the solubility of TPB in more complex systems of high ionic strength and those containing both potassium and sodium. These data allow evaluation of the ability of current models to accurately predict equilibrium TPB concentrations over the range of experimental conditions investigated in this study

In-operando elucidation of bimetallic CoNi nanoparticles during high-temperature CH 4 /CO 2 reaction

KAUST Repository

Al-Sabban, Bedour

2017-05-02

Dry reforming of methane (DRM) proceeds via CH4 decomposition to leave surface carbon species, followed by their removal with CO2-derived species. Reactivity tuning for stoichiometric CH4/CO2 reactants was attempted by alloying the non-noble metals Co and Ni, which have high affinity with CO2 and high activity for CH4 decomposition, respectively. This study was focused on providing evidence of the capturing surface coverage of the reactive intermediates and the associated structural changes of the metals during DRM at high temperature using in-operando X-ray absorption spectroscopy (XAS). On the Co catalysts, the first-order effects with respect to CH4 pressure and negative-order effects with respect to CO2 pressure on the DRM rate are consistent with the competitive adsorption of the surface oxygen species on the same sites as the CH4 decomposition reaction. The Ni surface provides comparatively higher rates of CH4 decomposition and the resultant DRM than the Co catalyst but leaves some deposited carbon on the catalyst surface. In contrast, the bimetallic CoNi catalyst exhibits reactivity towards the DRM but with kinetic orders resembling Co catalyst, producing negligible carbon deposition by balancing CH4 and CO2 activation. The in-operando X-ray absorption near edge structure (XANES) and extended X-ray absorption fine structure (EXAFS) measurements confirmed that the Co catalyst was progressively oxidized from the surface to the bulk with reaction time, whereas CoNi and Ni remained relatively reduced during DRM. Density functional theory (DFT) calculation considering the high reaction temperature for DRM confirmed the unselective site arrangement between Co and Ni atoms in both the surface and bulk of the alloy nanoparticle (NP). The calculated heat of oxygen chemisorption became more exothermic in the order of Ni, CoNi, Co, consistent with the catalytic behavior. The comprehensive experimental and theoretical evidence provided herein clearly suggests

Iron solubility in highly boron-doped silicon

International Nuclear Information System (INIS)

McHugo, S.A.; McDonald, R.J.; Smith, A.R.; Hurley, D.L.; Weber, E.R.

1998-01-01

We have directly measured the solubility of iron in high and low boron-doped silicon using instrumental neutron activation analysis. Iron solubilities were measured at 800, 900, 1000, and 1100thinsp degree C in silicon doped with either 1.5x10 19 or 6.5x10 14 thinspboronthinspatoms/cm 3 . We have measured a greater iron solubility in high boron-doped silicon as compared to low boron-doped silicon, however, the degree of enhancement is lower than anticipated at temperatures >800thinsp degree C. The decreased enhancement is explained by a shift in the iron donor energy level towards the valence band at elevated temperatures. Based on this data, we have calculated the position of the iron donor level in the silicon band gap at elevated temperatures. We incorporate the iron energy level shift in calculations of iron solubility in silicon over a wide range of temperatures and boron-doping levels, providing a means to accurately predict iron segregation between high and low boron-doped silicon. copyright 1998 American Institute of Physics

Solubilities of ferrocene and acetylferrocene in supercritical carbon dioxide

DEFF Research Database (Denmark)

Kazemi, Somayeh; Belandria, Veronica; Janssen, Nico

2012-01-01

In this work, the solubilities of ferrocene and acetylferrocene in supercritical carbon dioxide (scCO2) were measured using an analytical method in a quasi-flow apparatus. High-performance liquid chromatography was applied through an online sampling procedure to determine the concentration...

Cofactor and CO2 donor regulation involved in reductive routes for polymalic acid production by Aureobasidium pullulans CCTCC M2012223.

Science.gov (United States)

Zou, Xiang; Tu, Guangwei; Zan, Zhanquan

2014-10-01

Polymalic acid (PMA) is a water-soluble polyester with many attractive properties for biomedical application. Its monomer L-malic acid is widely used in the food industry and also a potential C4 platform chemical. Cofactor and CO2 donor involved in the reductive routes were investigated for PMA production by Aureobasidium pullulans. Biotin as the key cofactor of pyruvate carboxylase was favor for the PMA biosynthesis. Na2CO3 as CO2 donor can obviously improved PMA titer when compared with no CO2 supplier NaOH, and also exhibit more advantages than the other donor CaCO3 because of its water-soluble characteristic. A combinational process with addition of biotin 70 mg/L and Na2CO3 as the CO2 donor was scaled-up in 50 L fermentor, achieving the high product 34.3 g/L of PMA and productivity of 0.41 g/L h. This process provides an efficient and economical way for PMA and malic acid production, and is promising for industrial application.

Simplified Method for Rapid Purification of Soluble Histones

Directory of Open Access Journals (Sweden)

Nives Ivić

2016-06-01

Full Text Available Functional and structural studies of histone-chaperone complexes, nucleosome modifications, their interactions with remodelers and regulatory proteins rely on obtaining recombinant histones from bacteria. In the present study, we show that co-expression of Xenopus laevis histone pairs leads to production of soluble H2AH2B heterodimer and (H3H42 heterotetramer. The soluble histone complexes are purified by simple chromatographic techniques. Obtained H2AH2B dimer and H3H4 tetramer are proficient in histone chaperone binding and histone octamer and nucleosome formation. Our optimized protocol enables rapid purification of multiple soluble histone variants with a remarkable high yield and simplifies histone octamer preparation. We expect that this simple approach will contribute to the histone chaperone and chromatin research. This work is licensed under a Creative Commons Attribution 4.0 International License.

Annual CO2 budget and seasonal CO2 exchange signals at a High Arctic permafrost site on Spitsbergen, Svalbard archipelago

Science.gov (United States)

Lüers, J.; Westermann, S.; Piel, K.; Boike, J.

2014-01-01

The annual variability of CO2 exchange in most ecosystems is primarily driven by the activities of plants and soil microorganisms. However, little is known about the carbon balance and its controlling factors outside the growing season in arctic regions dominated by soil freeze/thaw-processes, long-lasting snow cover, and several months of darkness. This study presents a complete annual cycle of the CO2 net ecosystem exchange (NEE) dynamics for a High Arctic tundra area on the west coast of Svalbard based on eddy-covariance flux measurements. The annual cumulative CO2 budget is close to zero grams carbon per square meter per year, but shows a very strong seasonal variability. Four major CO2 exchange seasons have been identified. (1) During summer (ground snow-free), the CO2 exchange occurs mainly as a result of biological activity, with a predominance of strong CO2 assimilation by the ecosystem. (2) The autumn (ground snow-free or partly snow-covered) is dominated by CO2 respiration as a result of biological activity. (3) In winter and spring (ground snow-covered), low but persistent CO2 release occur, overlain by considerable CO2 exchange events in both directions associated with changes of air masses and air and atmospheric CO2 pressure. (4) The snow melt season (pattern of snow-free and snow-covered areas), where both, meteorological and biological forcing, resulting in a visible carbon uptake by the high arctic ecosystem. Data related to this article are archived under: http://doi.pangaea.de/10.1594/PANGAEA.809507.

A DC excited waveguide multibeam CO2 laser using high frequency ...

Indian Academy of Sciences (India)

High power industrial multibeam CO2 lasers consist of a large number of closely packed ... by producing pre-ionization using an auxiliary high frequency pulsed ... of few kilowatts output power, multibeam technique is used [2]. .... gas mixture of CO2, N2 and He enters in each discharge tube individually from .... Commercial.

High temperature CO2 capture of hydroxyapatite extracted from tilapia scales

Directory of Open Access Journals (Sweden)

Oscar H. Ojeda-Niño

2017-11-01

Full Text Available Hydroxyapatite (HAp was obtained from tilapia scales by two extraction methods: direct calcination and acid-base treatment. The physicochemical characteristics of the obtained HAps were evaluated by thermogravimetric analysis, X-ray fluorescence, X-ray diffraction, scanning electron microscopy, surface area, infrared spectroscopy, and basicity measurement at 298 K by CO2-pulse titration. Furthermore, the CO2 capture capacity of the solids at high temperature was also determined. Both methods showed the presence of a HAp phase although significant differences in the properties of the solids were found. The HAp obtained by direct calcination exhibited a lower crystallinity and a greater surface area and basicity than the HAp obtained by the acid-base treatment. These features were correlated with the solid’s CO2 capture capacity. In this work, CO2 capture capacity values for HAp yielded by calcination ranged from 2.5 to 3.2 mg CO2 /g captured at 973 K, and for the acid-base treatment-derived HAp, CO2 capture capacity values between 1.2 to 2.5 mg CO2 /g were recorded. These results reveal the potential of HAps extracted from tilapia scales as solids with high CO2 capture capacity, thermal stability, and capture/release cycles reversibility.

Solubility of carbon dioxide in the ionic liquid 1-ethyl-3-methylimidazolium tris(pentafluoroethyl)trifluorophosphate

NARCIS (Netherlands)

Althuluth, M.A.M.; Mota Martinez, M.T.; Kroon, M.C.; Peters, C.J.

2012-01-01

Recently, the use of ionic liquids (ILs) for gas separation processes has attracted much attention because of the high solubility of different gaseous species in ILs. This contribution presents new experimental measurements of the carbon dioxide (CO2) solubility in the IL 1-ethyl-3 methylimidazolium

Solubility correlation of anthraquinone derivatives in supercritical carbon dioxide

Science.gov (United States)

Alwi, Ratna Surya; Tamura, Kazuhiro; Tanaka, Tatsuro; Shimizu, Keisuke

2017-05-01

In this work, solubilites of anthraquinone dyestuffs in supercritical carbon dioxide (sc-CO2) were correlated by semiempirical models, expressed in terms of CO2 density. All solubility data used, experimentally measured by us, and were described in details elsewhere; namely, 1,4-diaminoanthraquinone and 1,4-bis(ethylamino)anthraquinone [J. Chem. Thermo-dyn. 74, 119-125 (2014)]; 1-amino-4-hydroxyanthraquinone and 1-hydroxy-4-nitroanthraquionone [Dyes Pigm.113, 351-356 (2015)]; 1,4-diamino-2,3-dichloroanthraquinone and 1,8-dihydroxy-4,5-dinitroanthraquinone [J. Chem. Eng. Data 60, 3046-3052 (2015)], and 1-aminoanthraquinone and 1-nitroanthraquinone [J. Chem. Thermodyn. 104, 162-168 (2017)]. It was found that 1-aminoanthraquinone shows the highest solubility at 383,15 K and pressure of 25 MPa, and the solubility of anthraquinone derivatives in sc-CO2 changed by the substituent groups. Satisfactory agreement between the experimental data used and calculated solubilities of the anthraquinone derivatives was obtained.

Investigation of attractive and repulsive interactions associated with ketones in supercritical CO2, based on Raman spectroscopy and theoretical calculations.

Science.gov (United States)

Kajiya, Daisuke; Saitow, Ken-ichi

2013-08-07

Carbonyl compounds are solutes that are highly soluble in supercritical CO2 (scCO2). Their solubility governs the efficiency of chemical reactions, and is significantly increased by changing a chromophore. To effectively use scCO2 as solvent, it is crucial to understand the high solubility of carbonyl compounds, the solvation structure, and the solute-solvent intermolecular interactions. We report Raman spectroscopic data, for three prototypical ketones dissolved in scCO2, and four theoretical analyses. The vibrational Raman spectra of the C=O stretching modes of ketones (acetone, acetophenone, and benzophenone) were measured in scCO2 along the reduced temperature Tr = T∕Tc = 1.02 isotherm as a function of the reduced density ρr = ρ∕ρc in the range 0.05-1.5. The peak frequencies of the C=O stretching modes shifted toward lower energies as the fluid density increased. The density dependence was analyzed by using perturbed hard-sphere theory, and the shift was decomposed into attractive and repulsive energy components. The attractive energy between the ketones and CO2 was up to nine times higher than the repulsive energy, and its magnitude increased in the following order: acetone attractive energy and optimized the relative configuration between each solute and CO2. According to theoretical calculations for the dispersion energy, the dipole-induced-dipole interaction energy, and the frequency shift due to their interactions, the experimentally determined attractive energy differences in the three solutes were attributed to the dispersion energies that depended on a chromophore attached to the carbonyl groups. It was found that the major intermolecular interaction with the attractive shift varied from dipole-induced dipole to dispersion depending on the chromophore in the ketones in scCO2. As the common conclusion for the Raman spectral measurements and the four theoretical calculations, solute polarizability, modified by the chromophore, was at the core of

Experimental Study of CO2 Solubility in Ionic Liquids and Polyethylene Glycols

OpenAIRE

Huang, Huang

2015-01-01

The parameter of density, viscosity are tested and fitted with the result of solubility measurement. With series of experiments, this chemical blend is considered with a good effect. The mixture of 50% tetrabutylphosphonium glycine with 50% polyethylene glycol (molecular weight: 400) is the suggested blend, and the most suitable temperature is absorption in 120C and desorption in 60C. But the solubility reduced rapidly from the second cycle of experiment, thus recycled use is not recommended.

A study of structure–activity relationships of commercial tertiary amines for post-combustion CO_2 capture

International Nuclear Information System (INIS)

Xiao, Min; Liu, Helei; Idem, Raphael; Tontiwachwuthikul, Paitoon; Liang, Zhiwu

2016-01-01

Highlights: • Ethyl group is beneficial for tertiary amines of CO_2 absorption. • The existence of side carbon chain may promote the activity of tertiary amine. • Hydroxyl group reduces the equilibrium CO_2 solubility, k_2 and pKa. • Heterocyclic structure decrease the equilibrium CO_2 solubility, k_2 and pKa. • Hydroxyl group results in higher CO_2 absorption heat. - Abstract: This work examined the relationship between the structure of various commercial tertiary amines and their activity in CO_2 absorption/desorption in terms of rate of CO_2 absorption, equilibrium CO_2 loading, pKa and heat of CO_2 absorption in order to establish possible guidelines for selection of tertiary amine components for amine blends. Results show that any electron donating group linked directly to the nitrogen atom increases their reactivity with CO_2. In addition, the presence of steric hindrance effect and good water solubility also show enhancements in activity. In contrast, the existence of a hydroxyl group leads to a decrease in all the activity of the tertiary amine. The heat of CO_2 absorption of tertiary amines, which is closely related to the regeneration energy, can be reduced by decreasing the number of hydroxyethyl groups or by positing the hydroxyl group at the proper carbon relative to the nitrogen atom.

Effects of elevated CO2 on the photosynthesis and nitrate reductase activity of Pyropia haitanensis (Bangiales, Rhodophyta) grown at different nutrient levels

Science.gov (United States)

Liu, Chunxiang; Zou, Dinghui

2015-03-01

Pyropia haitanensis, a commercially important species, was cultured at two CO2 concentrations (390×10-6 and 700×10-6 (parts per million)) and at low and high nutrient levels, to explore the effect of elevated CO2 on the species under nutrient enrichment. Results show that in CO2-enriched thalli, relative growth rate (RGR) was enhanced under nutrient enrichment. Elevated CO2 decreased phycobiliprotein (PB) contents, but increased the contents of soluble carbohydrates. Nutrient enrichment increased the contents of chlorophyll a (Chl a) and PB, while soluble carbohydrate content decreased. CO2 enrichment enhanced the relative maximum electronic transport rate and light saturation point. In nutrient-enriched thalli the activity of nitrate reductase (NRA) increased under elevated CO2. An instantaneous pH change in seawater (from 8.1 to 9.6) resulted in reduction of NRA, and the thalli grown under both elevated CO2 and nutrient enrichment exhibited less pronounced reduction than in algae grown at the ambient CO2. The thermal optima of NRA under elevated CO2 and/or nutrient enrichment shifted to a lower temperature (10-15°C) compared to that in ambient conditions (20°C). We propose that accelerated photosynthesis could result in growth increment. N assimilation remained high in acidified seawater and reflected increased temperature sensitivity in response to elevated CO2 and eutrophication.

Metallic CoS2 nanowire electrodes for high cycling performance supercapacitors

Science.gov (United States)

Ren, Ren; Faber, Matthew S.; Dziedzic, Rafal; Wen, Zhenhai; Jin, Song; Mao, Shun; Chen, Junhong

2015-12-01

We report metallic cobalt pyrite (CoS2) nanowires (NWs) prepared directly on current collecting electrodes, e.g., carbon cloth or graphite disc, for high-performance supercapacitors. These CoS2 NWs have a variety of advantages for supercapacitor applications. Because the metallic CoS2 NWs are synthesized directly on the current collector, the good electrical connection enables efficient charge transfer between the active CoS2 materials and the current collector. In addition, the open spaces between the sea urchin structure NWs lead to a large accessible surface area and afford rapid mass transport. Moreover, the robust CoS2 NW structure results in high stability of the active materials during long-term operation. Electrochemical characterization reveals that the CoS2 NWs enable large specific capacitance (828.2 F g-1 at a scan rate of 0.01 V s-1) and excellent long term cycling stability (0-2.5% capacity loss after 4250 cycles at 5 A g-1) for pseudocapacitors. This example of metallic CoS2 NWs for supercapacitor applications expands the opportunities for transition metal sulfide-based nanostructures in emerging energy storage applications.

High CO2 Primes Plant Biotic Stress Defences through Redox-Linked Pathways.

Science.gov (United States)

Mhamdi, Amna; Noctor, Graham

2016-10-01

Industrial activities have caused tropospheric CO 2 concentrations to increase over the last two centuries, a trend that is predicted to continue for at least the next several decades. Here, we report that growth of plants in a CO 2 -enriched environment activates responses that are central to defense against pathogenic attack. Salicylic acid accumulation was triggered by high-growth CO 2 in Arabidopsis (Arabidopsis thaliana) and other plants such as bean (Phaseolus vulgaris). A detailed analysis in Arabidopsis revealed that elevated CO 2 primes multiple defense pathways, leading to increased resistance to bacterial and fungal challenge. Analysis of gene-specific mutants provided no evidence that activation of plant defense pathways by high CO 2 was caused by stomatal closure. Rather, the activation is partly linked to metabolic effects involving redox signaling. In support of this, genetic modification of redox components (glutathione contents and NADPH-generating enzymes) prevents full priming of the salicylic acid pathway and associated resistance by high CO 2 The data point to a particularly influential role for the nonphosphorylating glyceraldehyde-3-phosphate dehydrogenase, a cytosolic enzyme whose role in plants remains unclear. Our observations add new information on relationships between high CO 2 and oxidative signaling and provide novel insight into plant stress responses in conditions of increased CO 2 . © 2016 American Society of Plant Biologists. All Rights Reserved.

High-powered CO2 -lasers and noise control

Science.gov (United States)

Honkasalo, Antero; Kuronen, Juhani

High-power CO2 -lasers are being more and more widely used for welding, drilling and cutting in machine shops. In the near future, different kinds of surface treatments will also become routine practice with laser units. The industries benefitting most from high power lasers will be: the automotive industry, shipbuilding, the offshore industry, the aerospace industry, the nuclear and the chemical processing industries. Metal processing lasers are interesting from the point of view of noise control because the working tool is a laser beam. It is reasonable to suppose that the use of such laser beams will lead to lower noise levels than those connected with traditional metal processing methods and equipment. In the following presentation, the noise levels and possible noise-control problems attached to the use of high-powered CO2 -lasers are studied.

Intertidal oysters reach their physiological limit in a future high-CO2 world.

Science.gov (United States)

Scanes, Elliot; Parker, Laura M; O'Connor, Wayne A; Stapp, Laura S; Ross, Pauline M

2017-03-01

Sessile marine molluscs living in the intertidal zone experience periods of internal acidosis when exposed to air (emersion) during low tide. Relative to other marine organisms, molluscs have been identified as vulnerable to future ocean acidification; however, paradoxically it has also been shown that molluscs exposed to high CO 2 environments are more resilient compared with those molluscs naive to CO 2 exposure. Two competing hypotheses were tested using a novel experimental design incorporating tidal simulations to predict the future intertidal limit of oysters in a high-CO 2 world; either high-shore oysters will be more tolerant of elevated P CO 2 because of their regular acidosis, or elevated P CO 2  will cause high-shore oysters to reach their limit. Sydney rock oysters, Saccostrea glomerata , were collected from the high-intertidal and subtidal areas of the shore and exposed in an orthogonal design to either an intertidal or a subtidal treatment at ambient or elevated P CO 2 , and physiological variables were measured. The combined treatment of tidal emersion and elevated P CO 2  interacted synergistically to reduce the haemolymph pH (pH e ) of oysters, and increase the P CO 2  in the haemolymph ( P e,CO 2 ) and standard metabolic rate. Oysters in the intertidal treatment also had lower condition and growth. Oysters showed a high degree of plasticity, and little evidence was found that intertidal oysters were more resilient than subtidal oysters. It is concluded that in a high-CO 2 world the upper vertical limit of oyster distribution on the shore may be reduced. These results suggest that previous studies on intertidal organisms that lacked tidal simulations may have underestimated the effects of elevated P CO 2 . © 2017. Published by The Company of Biologists Ltd.

Solubility of radionuclides in a concrete environment for provisional safety analyses for SGT-E2

International Nuclear Information System (INIS)

Berner, U.

2014-08-01

environment has been produced in 2002, based on the PSI/Nagra Thermodynamic database 01/01. A comparison of the solubility limits with results from this former report and with regulatory recommendations to the values in this former report was made. With the criterion of a threshold value of ±0.5 log_1_0-units (a factor of 3.2) the evaluated solubilities were classified into lower, similar, and higher recommended values. With this classification 14 elements fall into the class of lower recommended solubilities (Be, C_i_n_o_r_g, Se, Zr, Mo, Te, I, Sm, Ho, Po, Ra, Np, Pu, Am) and 15 elements (Cl, K, Ca, Co, Sr, Nb, Pd, Sn, Cs, Eu, Pb, Ac, Th, U, Cm) into the class of similar recommended solubilities. Only four elements (Ni with a factor of 10, U with a factor of 70, Pa with a factor of 200 and Ag with a factor 'high' exhibit higher recommended solubilities than evaluated in the former report. A specific request concerned the potential impact of isosaccharinic acid (ISA) on the solubility of the elements. ISA is at elevated pH a strongly complexing product of cellulose degradation. The isosaccharininate anion (ISA"-) is known to form strong complexes with di-, tri- and tetravalent cations and therefore to stabilise increased concentrations in solution. Thermodynamic complex formation data for relevant elements were collected from a recent NEA review. Solubility calculations were repeated for these elements in the presence of 5 x 10"-"3 [mol/kg H_2O] of ISA"- and a solubility enhancement factor was established. Low solubility enhancement factors were found for Ca (1.1), Ni (1.2), Pa (1.3), U (1.2), Np (3.5) and Pu (3.5). Considerable enhancement factors were found for Zr (109), Sm (630), Eu (263), Ho (632), Po (731), Ac (263), Th (731), Am (165) and Cm (165), where the ISA"--complexes strongly dominate the speciation in solution. Since rather high ISA"- concentrations were selected to study their impact on solubility, it can be concluded that in the worst case dissolved I SA has

Solubility of radionuclides in a concrete environment for provisional safety analyses for SGT-E2

Energy Technology Data Exchange (ETDEWEB)

Berner, U.

2014-08-15

environment has been produced in 2002, based on the PSI/Nagra Thermodynamic database 01/01. A comparison of the solubility limits with results from this former report and with regulatory recommendations to the values in this former report was made. With the criterion of a threshold value of ±0.5 log{sub 10}-units (a factor of 3.2) the evaluated solubilities were classified into lower, similar, and higher recommended values. With this classification 14 elements fall into the class of lower recommended solubilities (Be, C{sub inorg}, Se, Zr, Mo, Te, I, Sm, Ho, Po, Ra, Np, Pu, Am) and 15 elements (Cl, K, Ca, Co, Sr, Nb, Pd, Sn, Cs, Eu, Pb, Ac, Th, U, Cm) into the class of similar recommended solubilities. Only four elements (Ni with a factor of 10, U with a factor of 70, Pa with a factor of 200 and Ag with a factor 'high' exhibit higher recommended solubilities than evaluated in the former report. A specific request concerned the potential impact of isosaccharinic acid (ISA) on the solubility of the elements. ISA is at elevated pH a strongly complexing product of cellulose degradation. The isosaccharininate anion (ISA{sup -}) is known to form strong complexes with di-, tri- and tetravalent cations and therefore to stabilise increased concentrations in solution. Thermodynamic complex formation data for relevant elements were collected from a recent NEA review. Solubility calculations were repeated for these elements in the presence of 5 x 10{sup -3} [mol/kg H{sub 2}O] of ISA{sup -} and a solubility enhancement factor was established. Low solubility enhancement factors were found for Ca (1.1), Ni (1.2), Pa (1.3), U (1.2), Np (3.5) and Pu (3.5). Considerable enhancement factors were found for Zr (109), Sm (630), Eu (263), Ho (632), Po (731), Ac (263), Th (731), Am (165) and Cm (165), where the ISA{sup -}-complexes strongly dominate the speciation in solution. Since rather high ISA{sup -} concentrations were selected to study their impact on solubility, it can be

Amino acids as co-amorphous stabilizers for poorly water soluble drugs--Part 1

DEFF Research Database (Denmark)

Löbmann, Korbinian; Grohganz, Holger; Laitinen, Riikka

2013-01-01

molecular weight excipients that form specific molecular interactions with the drug resulting in co-amorphous forms. The two poorly water soluble drugs carbamazepine and indomethacin were combined with amino acids from the binding sites of the biological receptors of these drugs. Mixtures of drug...

Measurement and modelling of urea solubility in aqueous propane-1,2,3-triol and prop-2-enoic acid solutions

International Nuclear Information System (INIS)

Santos, Jéssica dos J; Rocha, João A.A.B.; Costa, Glória M.N.; Cabral-Albuquerque, Elaine C.M.; Alves, Tito L.M.; Pinto, José C.; Fialho, Rosana L.

2016-01-01

Highlights: • Solubilities were shown to increase with temperature and to decrease with the increasing organic solvent content. • The UNIFAC method provided good fitting of the available data, after the estimation of a single model parameter. • The empirical method showed to be more efficient to describe several solution concentrations however, it is not predictive. - Abstract: The aim of the present study is to measure the solubility of urea in aqueous solutions of prop-2-enoic acid and propane-1,2,3-triol, as these compounds are used as co-monomers to produce urea base co-polymers. Experimental values have been obtained at several concentrations and temperatures. Solubility results were modelled with the help of an exponential empirical correlation, ideal solid-liquid equilibrium correlation and the Universal Functional Activity Coefficient (UNIFAC) method, used to describe the activity coefficient in the liquid phase. The empirical correlation requires two empirical parameters for each solvent and leads to the best fit for the available data. The UNIFAC method correlation also has a good numerical performance and is completely predictive, and it does not require the estimation of additional parameters.

Enhanced electrocatalytic CO2 reduction via field-induced reagent concentration

Science.gov (United States)

Liu, Min; Pang, Yuanjie; Zhang, Bo; de Luna, Phil; Voznyy, Oleksandr; Xu, Jixian; Zheng, Xueli; Dinh, Cao Thang; Fan, Fengjia; Cao, Changhong; de Arquer, F. Pelayo García; Safaei, Tina Saberi; Mepham, Adam; Klinkova, Anna; Kumacheva, Eugenia; Filleter, Tobin; Sinton, David; Kelley, Shana O.; Sargent, Edward H.

2016-09-01

Electrochemical reduction of carbon dioxide (CO2) to carbon monoxide (CO) is the first step in the synthesis of more complex carbon-based fuels and feedstocks using renewable electricity. Unfortunately, the reaction suffers from slow kinetics owing to the low local concentration of CO2 surrounding typical CO2 reduction reaction catalysts. Alkali metal cations are known to overcome this limitation through non-covalent interactions with adsorbed reagent species, but the effect is restricted by the solubility of relevant salts. Large applied electrode potentials can also enhance CO2 adsorption, but this comes at the cost of increased hydrogen (H2) evolution. Here we report that nanostructured electrodes produce, at low applied overpotentials, local high electric fields that concentrate electrolyte cations, which in turn leads to a high local concentration of CO2 close to the active CO2 reduction reaction surface. Simulations reveal tenfold higher electric fields associated with metallic nanometre-sized tips compared to quasi-planar electrode regions, and measurements using gold nanoneedles confirm a field-induced reagent concentration that enables the CO2 reduction reaction to proceed with a geometric current density for CO of 22 milliamperes per square centimetre at -0.35 volts (overpotential of 0.24 volts). This performance surpasses by an order of magnitude the performance of the best gold nanorods, nanoparticles and oxide-derived noble metal catalysts. Similarly designed palladium nanoneedle electrocatalysts produce formate with a Faradaic efficiency of more than 90 per cent and an unprecedented geometric current density for formate of 10 milliamperes per square centimetre at -0.2 volts, demonstrating the wider applicability of the field-induced reagent concentration concept.

CO₂ Capture from Flue gas using Amino acid salt solutions

DEFF Research Database (Denmark)

Lerche, Benedicte Mai

to storage. Typical solvents for the process are based on aqueous solutions of alkanolamines, such as mono-ethanolamine (MEA), but their use implies economic disadvantages and environmental complications. Amino acid salt solutions have emerged as an alternative to the alkanolamines, partlybecause...... for measuring of CO2 solubility based on the semi-flow method. A validation study of CO2 solubility in aqueous solutions of MEA is presented. Chapter 5 focuses on the determination of the chemical compositions of the precipitations, which arise in the five amino acid salt solutions upon CO2 absorption...

High temperature stability of surfactant capped CoFe2O4 nanoparticles

International Nuclear Information System (INIS)

Ayyappan, S.; Panneerselvam, G.; Antony, M.P.; Philip, John

2011-01-01

Highlights: → Self-assembled molecular layers of surfactant on nanoparticles are often used to modify surface properties. → We demonstrate that a surfactant nanolayer on CoFe 2 O 4 nanoparticles can act as a strong reducing agent under high temperature vacuum annealing. → We propose a possible reduction mechanism of CoFe 2 O 4 nanoparticles under air and vacuum annealing. → Our results are important in the understanding of the stability of nanoparticles at high temperatures. - Abstract: We investigate the effect of adsorbed surfactant on the structural stability of CoFe 2 O 4 nanoparticles during vacuum thermal annealing. In-situ high temperature X-ray diffraction studies show a reduction of oleic acid coated CoFe 2 O 4 nanoparticles into α-Fe and CoO under annealing at 800 deg. C. On the contrary, the uncoated CoFe 2 O 4 nanoparticles remains stable, with its cubic phase intact, even at 1000 deg. C. Thermo-gravimetric analysis coupled mass spectra reveals that the evolved carbon from the surfactant aids the removal of oxygen atom from CoFe 2 O 4 lattice thereby reducing it to α-Fe and CoO phases. These results are important in tailoring stable CoFe 2 O 4 nanostructures for various applications.

Hydrogen production from food wastes and gas post-treatment by CO2 adsorption

International Nuclear Information System (INIS)

Redondas, V.; Gómez, X.; García, S.; Pevida, C.; Rubiera, F.; Morán, A.; Pis, J.J.

2012-01-01

Highlights: ► The dark fermentation process of food wastes was studied over an extended period. ► Decreasing the HRT of the process negatively affected the specific gas production. ► Adsorption of CO 2 was successfully attained using a biomass type activated carbon. ► H 2 concentration in the range of 85–95% was obtained for the treated gas-stream. - Abstract: The production of H 2 by biological means, although still far from being a commercially viable proposition, offers great promise for the future. Purification of the biogas obtained may lead to the production of highly concentrated H 2 streams appropriate for industrial application. This research work evaluates the dark fermentation of food wastes and assesses the possibility of adsorbing CO 2 from the gas stream by means of a low cost biomass-based adsorbent. The reactor used was a completely stirred tank reactor run at different hydraulic retention times (HRTs) while the concentration of solids of the feeding stream was kept constant. The results obtained demonstrate that the H 2 yields from the fermentation of food wastes were affected by modifications in the hydraulic retention time (HRT) due to incomplete hydrolysis. The decrease in the duration of fermentation had a negative effect on the conversion of the substrate into soluble products. This resulted in a lower amount of soluble substrate being available for metabolisation by H 2 producing microflora leading to a reduction in specific H 2 production. Adsorption of CO 2 from a gas stream generated from the dark fermentation process was successfully carried out. The data obtained demonstrate that the column filled with biomass-derived activated carbon resulted in a high degree of hydrogen purification. Co-adsorption of H 2 S onto the activated carbon also took place, there being no evidence of H 2 S present in the bio-H 2 exiting the column. Nevertheless, the concentration of H 2 S was very low, and this co-adsorption did not affect the CO 2

Exploring the Phase Diagram SiO2-CO2 at High Pressures and Temperatures

Science.gov (United States)

Kavner, A.

2015-12-01

CO2 is an important volatile system relevant for planetary sciences and fundamental chemistry. Molecular CO2 has doubly bonded O=C=O units but high pressure-high temperature (HP-HT) studies have recently shown its transformation into a three-dimensional network of corner-linked [CO4] units analogous to the silica mineral polymorphs, through intermediate non-molecular phases. Here, we report P-V-T data on CO2-IV ice from time-of-flight neutron diffraction experiments, which allow determining the compressibility and thermal expansivity of this intermediate molecular-to-non-molecular phase.1 Aditionally, we have explored the SiO2-CO2 phase diagram and the potential formation of silicon carbonate compounds. New data obtained by laser-heating diamond-anvil experiments in CO2-filled microporous silica polymorphs will be shown. In particular, these HP-HT experiments explore the existence of potential CO2/SiO2 compounds with tetrahedrally-coordinated C/Si atoms by oxygens, which are predicted to be stable (or metastable) by state-of-the-art ab initio simulations.2,3 These theoretical predictions were supported by a recent study that reports the formation of a cristobalite-type Si0.4C0.6O2 solid solution at high-pressures and temperatures, which can be retained as a metastable solid down to ambient conditions.4 Entirely new families of structures could exist based on [CO4]4- units in various degrees of polymerisation, giving rise to a range of chain, sheet and framework solids like those found in silicate chemistry. References[1] S. Palaich et al., Am. Mineral. Submitted (2015) [2] A. Morales-Garcia et al., Theor. Chem. Acc. 132, 1308 (2013) [3] R. Zhou et al., Phys. Rev. X, 4, 011030 (2014) [4] M. Santoro et al. Nature Commun. 5, 3761 (2014)

Thermodynamic properties of CO2 absorption in hydroxyl ammonium ionic liquids at pressures of (100-1600) kPa

International Nuclear Information System (INIS)

Kurnia, K.A.; Harris, F.; Wilfred, C.D.; Abdul Mutalib, M.I.; Murugesan, T.

2009-01-01

Solubility of CO 2 in six hydroxyl ammonium ionic liquids 2-hydroxyethanaminium acetate [hea], bis(2-hydroxyethyl)ammonium acetate [bheaa], 2-hydroxy-N-(2-hydroxyethyl)-N-methylethanaminium acetate [hhemea], 2-hydroxyethanaminium lactate [hel], bis(2-hydroxyethyl)ammonium lactate [bheal], 2-hydroxy-N-(2-hydroxyethyl)-N-methylethanaminium lactate [hhemel] at temperatures (298.15, 313.15, and 328.16) K and pressures ranging from (100 to 1600) kPa was determined. From the experimental solubility data, the Henry's constant of CO 2 for each hydroxyl ammonium ionic liquids was estimated and reported as a function of temperature. Furthermore, enthalpy and entropy of absorption were obtained from estimated Henry's constant. The results showed that the solubility increase with increasing pressure and decrease with increasing temperature and the solubility of CO 2 in these six hydroxyl ammonium ionic liquids was in sequence: [hea] > [bheaa] > [hel] > [bheal] > [hhemel] > [hhemea].

Efeito de tratamentos com altas concentrações de CO2 sobre a qualidade de maçãs 'Golden delicious' armazenadas em atmosfera controlada Effect of treatment with high CO2 concentrations on quality of 'Golden delicious' apples stored in controlled atmosphere

Directory of Open Access Journals (Sweden)

Auri Brackmann

1996-08-01

Full Text Available O experimento teve por objetivo avaliar a influência das altas concentrações iniciais de CO2 sobre os aspectos físico-químicos de maçãs 'Golden Delicious' armazenadas em atmosfera controlada. Os tratamentos foram 10% de CO2 e 5% de O2 e 15% de CO2 e 5% de O2 durante 5, 10 e 15 dias, sendo que durante o restante do período de armazenamento os frutos foram armazenados em 4% de CO2 e 1,5% de O2, na temperatura de +0,5 °C e umidade relativa de 97%. Após 10 meses, não foi verificado diferenças significativas na firmeza de polpa, acidez titulável, sólidos solúveis totais e controle de podridões. Na abertura das câmaras os tratamentos iniciais com CO2 não mostraram influência na degenerescência da polpa e escaldadura, porém, após 14 dias todos os tratamentos com CO2 aumentaram a incidência de degenerescência interna e tratamentos com 15% de CO2 diminuíram ligeiramente a ocorrência da escaldadura.The aim of this experiment was to evaluate the effect of initial high CO2 concentrations on quality of 'Golden Delicious' apples stored in controlled atmosphere. The treatments were 10% of CO2, and 5% of O2, and 15% of CO2, and 5% of O2, during 5, 10 and 15 days but during the remaining of storage time fruits were kept in 4% of CO2, and 1.5% of O2, at +0,5 °C and 97% RH. After 10 months, no diferences in firmness, total soluble solids contents, acidity and decay were observed. At opening of controlled atmosphere chambers CO2 treatment had no influence in internal breakdown and scald, but after 14 days in shelf-life. all treatments with high CO2 increased internal breakdown and 15% of CO2 decreased scald incidence.

Carbon dioxide solubilities in decanoic acid-based hydrophobic deep eutectic solvents

NARCIS (Netherlands)

Zubeir, Lawien F.; Van Osch, Dannie J.G.P.; Rocha, Marisa A.A.; Banat, Fawzi; Kroon, Maaike C.

2018-01-01

The solubility of CO2 in hydrophobic deep eutectic solvents (DESs) has been measured for the first time. Six different hydrophobic DESs are studied in the temperature range from 298 to 323 K and at CO2 pressures up to 2 MPa. The results are evaluated by comparing the solubility data with existing

Porous carbon derived via KOH activation of a hypercrosslinked porous organic polymer for efficient CO_2, CH_4, H_2 adsorptions and high CO_2/N_2 selectivity

International Nuclear Information System (INIS)

Modak, Arindam; Bhaumik, Asim

2015-01-01

Microporous carbon having Brunauer-Emmett-Teller (BET) surface area of 2186 m"2 g"−"1 and micropore volume of 0.85 cm"3 g"−"1 has been synthesized via KOH induced high temperature carbonization of a non-conjugated hypercrosslinked organic polymer. Owing to the templating and activation by KOH, we have succeeded in making a microporous carbon from this porous polymer and the resultant carbon material showed high uptake for CO_2 (7.6 mmol g"−"1) and CH_4 (2.4 mmol g"−"1) at 1 atm, 273 K together with very good selectivity for the CO_2/N_2 (30.2) separation. Furthermore, low pressure (1 atm) H_2 (2.6 wt%, 77 K) and water uptake (57.4 wt%, 298 K) ability of this polymer derived porous activated carbon is noteworthy. - Graphical abstract: Microporous carbon with BET surface area of 2186 m"2 g"−"1 has been synthesized via KOH activation of a porous organic polymer and it showed high uptake for CO_2 (7.6 mmol g"−"1), CH_4 (2.4 mmol g"−"1) and H_2 (2.6 wt%) at 1 atm together with very good selectivity for CO_2. - Highlights: • Porous carbon from hypercrosslinked organic polymer. • KOH activated carbon with BET surface area 2186 m"2 g"−"1. • High CO2 uptake (7.6 mmol g"−"1) and CO_2/N_2 selectivity (30.2). • Porous carbon also showed high H_2 (2.6 wt%) and H_2O (57.4 wt%) uptakes.

Compact, High Accuracy CO2 Monitor, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — This Small Business Innovative Research Phase I proposal seeks to develop a low cost, robust, highly precise and accurate CO2 monitoring system. This system will...

Compact, High Accuracy CO2 Monitor, Phase II

Data.gov (United States)

National Aeronautics and Space Administration — This Small Business Innovative Research Phase II proposal seeks to develop a low cost, robust, highly precise and accurate CO2 monitoring system. This system will...

High plant species diversity indirectly mitigates CO 2- and N-induced effects on grasshopper growth

Science.gov (United States)

Strengbom, Joachim; Reich, Peter B.; Ritchie, Mark E.

2008-09-01

We examined how elevated atmospheric [CO 2] and higher rate of nitrogen (N) input may influence grasshopper growth by changing food plant quality and how such effects may be modified by species diversity of the plant community. We reared grasshopper nymphs ( Melanoplus femurrubrum) on Poa pratensis from field-grown monocultures or polycultures (16 species) that were subjected to either ambient or elevated levels of CO 2 and N. Grasshopper growth rate was higher on P. pratensis leaves grown in monocultures than in polycultures, higher on P. pratensis grown under elevated than under ambient [CO 2], and higher on P. pratensis grown under elevated than under ambient [N]. The higher growth rate observed on P. pratensis exposed to elevated [CO 2] was, however, less pronounced for polyculture- than monoculture-grown P. pratensis. Growth rate of the grasshoppers was positively correlated with leaf [N], [C], and concentration of soluble carbohydrates + lipids. Concentration of non-structural carbohydrates + lipids was higher in leaves grown under elevated than under ambient [CO 2], and the difference between P. pratensis grown under ambient and elevated [CO 2] was greater for monoculture- than polyculture-grown P. pratensis. In addition, leaf N concentration was higher in P. pratensis grown in monocultures than in polycultures, suggesting that plant species richness, indirectly, may influence insect performance by changed nutritional value of the plants. Because we found interactive effects between all factors included ([CO 2], [N], and plant species diversity), our results suggest that these parameters may influence plant-insect interactions in a complex way that is not predictable from the sum of single factor manipulations.

Solubility study of Tc(IV) oxides

International Nuclear Information System (INIS)

Liu, D.J.; Fan, X.H.

2005-01-01

The deep geological disposal of the high level radioactive wastes is expected to be a safer disposal method in most countries. The long-lived fission product 99 Tc is present in large quantities in nuclear wastes and its chemical behavior in aqueous solution is of considerable interest. Under oxidizing conditions technetium exists as the anionic species TcO 4 - whereas under the reducing conditions, expected to exist in a deep geological repository, it is generally predicted that technetium will be present as TcO 2 ·nH 2 O. Hence, the mobility of Tc(IV) in reducing groundwater may be limited by the solubility of TcO 2 ·nH 2 O under these conditions. Due to this fact it is important to investigate the solubility of TcO 2 ·nH 2 O. The solubility determines the release of radionuclides from waste form and is used as a source term in radionuclide migration analysis in performance assessment of radioactive waste repository. Technetium oxide was prepared by reduction of a technetate solution with Sn 2 + . The solubility of Tc(IV) oxide has been determined in simulated groundwater and redistilled water under aerobic and anaerobic conditions. The effects of pH and CO 3 2- concentration of solution on solubility of Tc(IV) oxide were studied. The concentration of total technetium and Tc(IV) species in the solutions were periodically determined by separating the oxidized and reduced technetium species using a solvent extraction procedure and counting the beta activity of the 99 Tc with a liquid scintillation counter. The experimental results show that the rate of oxidation of Tc(IV) in simulated groundwater and redistilled water is about (1.49-1.86) x 10 -9 mol/(L·d) under aerobic conditions, but Tc(IV) in simulated groundwater and redistilled water is not oxidized under anaerobic conditions. Under aerobic or anaerobic conditions the solubility of Tc(IV) oxide in simulated groundwater and redistilled water is equal on the whole after centrifugation or ultrafiltration. The

Recent Progress in the Development of Supercritical Carbon Dioxide-Soluble Metal Ion Extractants: Aggregation, Extraction, and Solubility Properties of Silicon-Substituted Alkylenediphosphonic Acids

Energy Technology Data Exchange (ETDEWEB)

Dietz, Mark L.; McAlister, Daniel R.; Stepinski, Dominique C.; Zalupski, Peter R.; Dzilawa, Julie A.; Barrans, Richard E.; Hess, J.N.; Rubas, Audris V.; Chiarizia, Renato; Lubbers, Christopher M.; Scurto, Aaron M.; Brennecke, Joan F.; Herlinger, Albert W.

2003-09-11

Partially esterified alkylenediphosphonic acids (DPAs) have been shown to be effective reagents for the extraction of actinide ions from acidic aqueous solution into conventional organic solvents. Efforts to employ these compounds in supercritical fluid extraction have been hampered by their modest solubility in unmodified supercritical carbon dioxide (SC-CO2). In an effort to design DPAs that are soluble in SC-CO2, a variety of silicon-substituted alkylenediphosphonic acids have been prepared and characterized, and their behavior compared with that of conventional alkyl-substituted reagents. Silicon substitution is shown to enhance the CO2-philicity of the reagents, while other structural features, in particular, the number of methylene groups bridging the phosphorus atoms of the extractant, are shown to exert a significant influence on their aggregation and extraction properties. The identification of DPAs combining desirable extraction properties with adequate solubility in SC-CO2 is shown to be facilitated by the application of molecular connectivity indices.

CO2 deficit in temperate forest soils receiving high atmospheric N-deposition.

Science.gov (United States)

Fleischer, Siegfried

2003-02-01

Evidence is provided for an internal CO2 sink in forest soils, that may have a potential impact on the global CO2-budget. Lowered CO2 fraction in the soil atmosphere, and thus lowered CO2 release to the aboveground atmosphere, is indicated in high N-deposition areas. Also at forest edges, especially of spruce forest, where additional N-deposition has occurred, the soil CO2 is lowered, and the gradient increases into the closed forest. Over the last three decades the capacity of the forest soil to maintain the internal sink process has been limited to a cumulative supply of approximately 1000 and 1500 kg N ha(-1). Beyond this limit the internal soil CO2 sink becomes an additional CO2 source, together with nitrogen leaching. This stage of "nitrogen saturation" is still uncommon in closed forests in southern Scandinavia, however, it occurs in exposed forest edges which receive high atmospheric N-deposition. The soil CO2 gradient, which originally increases from the edge towards the closed forest, becomes reversed.

Degradation Mechanism of Poly(Ether-Urethane) Estane Induced by High Energy Radiation (III) : Radiolytic Gases and Water Soluble Products

International Nuclear Information System (INIS)

Dannoux, A.

2006-01-01

Within the framework of nuclear waste management, there is interest in the prediction of long-term behaviour of organic materials subjected to high energy radiation. Once organic waste has been stored, gases and low molecular products might be generated from materials irradiated by radionuclides. Long-term behaviour of organic material in nuclear waste has several common concerns with radiation ageing of polymers. But a more detailed description of the chemical evolution is needed for nuclear waste management. In a first approach, an extensive work on radiation ageing is used to identify the different processes encountered during the degradation of a polyurethane, including oxidation dose rate-effects and influence of dose on the oxidation mechanism. In a second approach, a study is performed to identify and quantify gases and possible production of water soluble chemical complexing agents which might enhance radionuclides migration away from the repository. In this work, we present results concerning the production of radiolytic gases and the formation of water soluble oligomers reached with leaching tests Films were made from a poly(ether-urethane) synthesized from methylene bis(p-phenyl isocyanate) (MDI) and poly(tetramethylene glycol) (PTMG) with 1,4 butanediol (BD) and were irradiated by high-energy electron beam to cover a wide doses range and by γ rays to determine the formation/consumption yields of gases. They were measured by mass spectrometry and gas-chromatography/mass spectrometry (GC/MS). The migration of water soluble oligomers in water was reached by measuring the weight loss versus leaching time. The identification of oligomers was performed by using a mass spectrometry with an electrospray ionisation interface (ESI-MS-MS). The analysis of radiolytic gases indicates the formation of H 2 , CO 2 and CO with respective radiolytic yields of 1, 0.5 and 0.3 molecule/100 eV. The consumption of O 2 is evaluated to 6 molecules/100 eV. For absorbed doses

Physiological and molecular alterations in plants exposed to high [CO2] under phosphorus stress.

Science.gov (United States)

Pandey, Renu; Zinta, Gaurav; AbdElgawad, Hamada; Ahmad, Altaf; Jain, Vanita; Janssens, Ivan A

2015-01-01

Atmospheric [CO2] has increased substantially in recent decades and will continue to do so, whereas the availability of phosphorus (P) is limited and unlikely to increase in the future. P is a non-renewable resource, and it is essential to every form of life. P is a key plant nutrient controlling the responsiveness of photosynthesis to [CO2]. Increases in [CO2] typically results in increased biomass through stimulation of net photosynthesis, and hence enhance the demand for P uptake. However, most soils contain low concentrations of available P. Therefore, low P is one of the major growth-limiting factors for plants in many agricultural and natural ecosystems. The adaptive responses of plants to [CO2] and P availability encompass alterations at morphological, physiological, biochemical and molecular levels. In general low P reduces growth, whereas high [CO2] enhances it particularly in C3 plants. Photosynthetic capacity is often enhanced under high [CO2] with sufficient P supply through modulation of enzyme activities involved in carbon fixation such as ribulose-1,5-bisphosphate carboxylase/oxygenase (Rubisco). However, high [CO2] with low P availability results in enhanced dry matter partitioning towards roots. Alterations in below-ground processes including root morphology, exudation and mycorrhizal association are influenced by [CO2] and P availability. Under high P availability, elevated [CO2] improves the uptake of P from soil. In contrast, under low P availability, high [CO2] mainly improves the efficiency with which plants produce biomass per unit P. At molecular level, the spatio-temporal regulation of genes involved in plant adaptation to low P and high [CO2] has been studied individually in various plant species. Genome-wide expression profiling of high [CO2] grown plants revealed hormonal regulation of biomass accumulation through complex transcriptional networks. Similarly, differential transcriptional regulatory networks are involved in P

Elevated atmospheric CO2 affected photosynthetic products in wheat seedlings and biological activity in rhizosphere soil under cadmium stress.

Science.gov (United States)

Jia, Xia; Liu, Tuo; Zhao, Yonghua; He, Yunhua; Yang, Mingyan

2016-01-01

The objective of this study was to investigate the effects of elevated CO2 (700 ± 23 μmol mol(-1)) on photosynthetic products in wheat seedlings and on organic compounds and biological activity in rhizosphere soil under cadmium (Cd) stress. Elevated CO2 was associated with decreased quantities of reducing sugars, starch, and soluble amino acids, and with increased quantities of soluble sugars, total sugars, and soluble proteins in wheat seedlings under Cd stress. The contents of total soluble sugars, total free amino acids, total soluble phenolic acids, and total organic acids in the rhizosphere soil under Cd stress were improved by elevated CO2. Compared to Cd stress alone, the activity of amylase, phenol oxidase, urease, L-asparaginase, β-glucosidase, neutral phosphatase, and fluorescein diacetate increased under elevated CO2 in combination with Cd stress; only cellulase activity decreased. Bacterial abundance in rhizosphere soil was stimulated by elevated CO2 at low Cd concentrations (1.31-5.31 mg Cd kg(-1) dry soil). Actinomycetes, total microbial abundance, and fungi decreased under the combined conditions at 5.31-10.31 mg Cd kg(-1) dry soil. In conclusion, increased production of soluble sugars, total sugars, and proteins in wheat seedlings under elevated CO2 + Cd stress led to greater quantities of organic compounds in the rhizosphere soil relative to seedlings grown under Cd stress only. Elevated CO2 concentrations could moderate the effects of heavy metal pollution on enzyme activity and microorganism abundance in rhizosphere soils, thus improving soil fertility and the microecological rhizosphere environment of wheat under Cd stress.

A systematic evaluation of solubility enhancing excipients to enable the generation of permeability data for poorly soluble compounds in Caco-2 model.

Science.gov (United States)

Shah, Devang; Paruchury, Sundeep; Matta, Muralikrishna; Chowan, Gajendra; Subramanian, Murali; Saxena, Ajay; Soars, Matthew G; Herbst, John; Haskell, Roy; Marathe, Punit; Mandlekar, Sandhya

2014-01-01

The study presented here identified and utilized a panel of solubility enhancing excipients to enable the generation of flux data in the Human colon carcinoma (Caco-2) system for compounds with poor solubility. Solubility enhancing excipients Dimethyl acetamide (DMA) 1 % v/v, polyethylene glycol (PEG) 400 1% v/v, povidone 1% w/v, poloxamer 188 2.5% w/v and bovine serum albumin (BSA) 4% w/v did not compromise Caco-2 monolayer integrity as assessed by trans-epithelial resistance measurement (TEER) and Lucifer yellow (LY) permeation. Further, these excipients did not affect P-glycoprotein (P-gp) mediated bidirectional transport of digoxin, permeabilities of high (propranolol) or low permeability (atenolol) compounds, and were found to be inert to Breast cancer resistant protein (BCRP) mediated transport of cladribine. This approach was validated further using poorly soluble tool compounds, atazanavir (poloxamer 188 2.5% w/v) and cyclosporine A (BSA 4% w/v) and also applied to new chemical entity (NCE) BMS-A in BSA 4% w/v, for which Caco-2 data could not be generated using the traditional methodology due to poor solubility (solubility of atazanavir by >8 fold whereas BSA 4% w/v increased the solubility of cyclosporine A and BMS-A by >2-4 fold thereby enabling permeability as well as efflux liability estimation in the Caco-2 model with reasonable recovery values. To conclude, addition of excipients such as poloxamer 188 2.5% w/v and BSA 4% w/v to HBSS leads to a significant improvement in the solubility of the poorly soluble compounds resulting in enhanced recoveries without modulating transporter-mediated efflux, expanding the applicability of Caco-2 assays to poorly soluble compounds.

Investigational study of the CO2 balance in high temperature CO2 separation technology; Nisanka tanso koon bunri gijutsu ni okeru CO2 balance ni kansuru chosa kenkyu

Energy Technology Data Exchange (ETDEWEB)

NONE

1997-03-01

An investigational study was conducted to clarify the adaptable environment and effectivity of technologies of high temperature separation/recovery/reutilization of CO2. In the study, data collection, arrangement and comparison were made of various separation technologies such as the membrane method, absorption method, adsorption method, and cryogenic separation method. With the LNG-fired power generation as an example, the adaptable environment and effectivity were made clear by making models by a process simulator, ASPEN PLUS. Moreover, using this simulator, effects of replacing the conventional steam reforming of hydrocarbon with the CO2 reforming were made clear with the methanol synthesis as an example. As to the rock fixation treatment of high temperature CO2, collection/arrangement were made of the data on the fixation treatment of the CO2 separated at high temperature into basic rocks such as peridotite and serpentinite in order to clarify the adaptable environment and effectivity of the treatment. Besides, a potentiality of the fixation to concrete waste was made clear. 57 refs., 57 figs., 93 tabs.

CO2 CAPTURE BY ABSORPTION WITH POTASSIUM CARBONATE

Energy Technology Data Exchange (ETDEWEB)

Gary T. Rochelle; A. Frank Seibert; J. Tim Cullinane; Terraun Jones

2003-01-01

The objective of this work is to improve the process for CO{sub 2} capture by alkanolamine absorption/stripping by developing an alternative solvent, aqueous K{sub 2}CO{sub 3} promoted by piperazine. Progress has been made in this reporting period on three subtasks. The rigorous Electrolyte Non-Random Two-Liquid (electrolyte-NRTL) model has been regressed to represent CO{sub 2} solubility in potassium carbonate/bicarbonate solutions. An analytical method for piperazine has been developed using a gas chromatograph. Funding has been obtained and equipment has been donated to provide for modifications of the existing pilot plant system with stainless steel materials.

A microporous MOF with a polar pore surface exhibiting excellent selective adsorption of CO2 from CO2-N2 and CO2-CH4 gas mixtures with high CO2 loading.

Science.gov (United States)

Pal, Arun; Chand, Santanu; Elahi, Syed Meheboob; Das, Madhab C

2017-11-14

A microporous MOF {[Zn(SDB)(L) 0.5 ]·S} n (IITKGP-5) with a polar pore surface has been constructed by the combination of a V-shaped -SO 2 functionalized organic linker (H 2 SDB = 4,4'-sulfonyldibenzoic acid) with an N-rich spacer (L = 2,5-bis(3-pyridyl)-3,4-diaza-2,4-hexadiene), forming a network with sql(2,6L1) topology. IITKGP-5 is characterized by TGA, PXRD and single crystal X-ray diffraction. The framework exhibits lozenge-shaped channels of an approximate size of 4.2 × 5.6 Å 2 along the crystallographic b axis with a potential solvent accessible volume of 26%. The activated IITKGP-5a revealed a CO 2 uptake capacity of 56.4 and 49 cm 3 g -1 at 273 K/1 atm and 295 K/1 atm, respectively. On the contrary, it takes up a much smaller amount of CH 4 (17 cm 3 g -1 at 273 K and 13.6 cm 3 g -1 at 295 K) and N 2 (5.5 cm 3 g -1 at 273 K; 4 cm 3 g -1 at 295 K) under 1 atm pressure exhibiting its potential for a highly selective adsorption of CO 2 from flue gas as well as a landfill gas mixture. Based on the ideal adsorbed solution theory (IAST), a CO 2 /N 2 selectivity of 435.5 and a CO 2 /CH 4 selectivity of 151.6 have been realized at 273 K/100 kPa. The values at 295 K are 147.8 for CO 2 /N 2 and 23.8 for CO 2 /CH 4 gas mixtures under 100 kPa. In addition, this MOF nearly approaches the target values proposed for PSA and TSA processes for practical utility exhibiting its prospect for flue gas separation with a CO 2 loading capacity of 2.04 mmol g -1 .

Thermodynamics of poly(7-methoxy-2-acetylbenzofurane methyl methacrylate-co-styrene) and poly(2-acetylbenzofurane methyl methacrylate-co-styrene)-probe interactions at different temperatures by inverse gas chromatography

International Nuclear Information System (INIS)

İlter, Zülfiye; Demir, Abdullah; Kaya, İsmet

2016-01-01

Highlights: • Thermodynamic of methacrylate-co-styrene polymers were studied by the inverse gas chromatography. • The sorption parameters of polymer-solute systems were determined under glass transition temperature of polymers. • The solubility parameter (δ 2 ) of the polymer was obtained from the slope and intercepts. • Flory-Huggins interaction parameter (χ 12 ∞ ) were determined for polymer-solute systems. - Abstract: In this study, some thermodynamic properties of poly(7-methoxy-2-acetylbenzofurane methyl methacrylate-co-styrene) Poly(MABMM-co-St) and poly(2-acetylbenzofurane methyl methacrylate-co-styrene) Poly(ABMM-co-St) were studied by the inverse gas chromatography (IGC) technique. The retention times (t r ) of selected organic probes were determined from the interactions with Poly(MABMM-co-St) and Poly(ABMM-co-St) of four groups of solvents with different chemical natures and polarities. Then, specific volume (V g 0 ) values of probes were calculated at different column temperatures. The glass transition temperatures (T g ) of Poly(MABMM-co-St) and Poly(ABMM-co-St) were found as 393, 413 K from inverse gas chromatography measurements, respectively. Under the glass transition temperatures adsorption heat (ΔH a ) and above the glass transition molar heat (ΔH 1 S ), free energies (ΔG 1 S ) and entropies (ΔS 1 S ) belonging to sorption for every probe were calculated from inverse gas chromatography measurements. The partial molar heat (ΔH 1 ∞ ), partial molar free energy (ΔG 1 ∞ ), Flory-Huggins interaction parameter (χ 12 ∞ ) and weight fraction activity coefficient (a 1 /w 1 ) ∞ , values for infinite dilute solutions were calculated for polymer-probe systems. The solubility parameter (δ 2 ) of the polymer was obtained from the slope and intercepts of Flory-Huggins interaction parameter (χ 12 ∞ ) graphs with solubility parameters (δ 1 ) of probes.

Molecular Simulation of Gas Solubility in Nitrile Butadiene Rubber.

Science.gov (United States)

Khawaja, M; Sutton, A P; Mostofi, A A

2017-01-12

Molecular simulation is used to compute the solubility of small gases in nitrile butadiene rubber (NBR) with a Widom particle-insertion technique biased by local free volume. The convergence of the method is examined as a function of the number of snapshots upon which the insertions are performed and the number of insertions per snapshot and is compared to the convergence of the unbiased Widom insertion technique. The effect of varying the definition of local free volume is also investigated. The acrylonitrile content of the polymer is altered to examine its influence on the solubility of helium, CO 2 , and H 2 O, and the solubilities of polar gases are found to be enhanced relative to those of nonpolar gases, in qualitative agreement with experiment. To probe this phenomenon further, the solubilities are decomposed into contributions from the neighborhoods of different atoms, using a Voronoi cell construction, and a strong bias is found for CO 2 and H 2 O in particular to be situated near nitrogen sites in the elastomer. Temperature is shown to suppress the solubility of CO 2 and H 2 O but to increase that of helium. Increasing pressure is found to suppress the solubility of all gases but at different rates, according to a balance between their molecular sizes and electrostatic interactions with the polymer. These results are relevant to the use of NBR seals at elevated temperatures and pressures, such as in oil and gas wells.

CO2 uptake capacity of coal fly ash

DEFF Research Database (Denmark)

Mazzella, Alessandro; Errico, Massimiliano; Spiga, Daniela

2016-01-01

Coal ashes are normally considered as a waste obtained by the coal combustion in thermal power plants. Their utilization inside the site where are produced represents an important example of sustainable process integration. The present study was performed to evaluate the application of a gas......-solid carbonation treatment on coal fly ash in order to assess the potential of the process in terms of sequestration of CO2 as well as its influence on the leaching behavior of metals and soluble salts. Laboratory tests, performed under different pressure and temperature conditions, showed that in the pressure......% corresponding to a maximum carbonation efficiency of 74%, estimated on the basis of the initial CaO content. The high degree of ash carbonation achieved in the present research, which was conducted under mild conditions, without add of water and without stirring, showed the potential use of coal fly ash in CO2...

Synthesis of fluorinated ReCl(4,4'-R2-2,2'-bipyridine)(CO)3 complexes and their photophysical characterization in CH3CN and supercritical CO2.

Science.gov (United States)

Doherty, Mark D; Grills, David C; Fujita, Etsuko

2009-03-02

Two new CO(2)-soluble rhenium(I) bipyridine complexes bearing the fluorinated alkyl ligands 4,4'-(C(6)F(13)CH(2)CH(2)CH(2))(2)-2,2'-bipyridine (1a), and 4,4'-(C(8)F(17)CH(2)CH(2)CH(2))(2)-2,2'-bipyridine (1b) have been prepared and their photophysical properties investigated in CH(3)CN and supercritical CO(2). Electrochemical and spectroscopic characterization of these complexes in CH(3)CN suggests that the three methylene units effectively insulate the bipyridyl rings and the rhenium center from the electron-withdrawing effect of the fluorinated alkyl chains. Reductive quenching of the metal-to-ligand charge-transfer excited states with triethylamine reveals quenching rate constants in supercritical CO(2) that are only 6 times slower than those in CH(3)CN.

Solubility study of Tc(Ⅳ) in a granitic water

International Nuclear Information System (INIS)

Liu Dejun; Yao Jun; Wang Bo

2008-01-01

The deep geological disposal of the high level radioactive wastes is expected to be a safe disposal method in most countries. The long-lived fission product 99 Tc is present in large quantities in nuclear wastes and its chemical behavior in aqueous solution is of considerable interest. Under oxidizing conditions technetium exists as the anionic species TcO 4 - whereas under the reducing conditions, expected to exist in a deep geological repository, it is generally predicted that technetium will be present as TcO 2 -nH 2 O. Hence, the mobility of Tc(Ⅳ) in reducing groundwater may be limited by the solubility of TcO 2 ·nH 2 O under these conditions. Due to this fact it is important to investigate the solubility of TcO 2 ·nH 2 O. The solubility determines the release of radionuclides from waste form and is used as a source term in radionuclide migration analysis in performance assessment of radioactive waste repository. Technetium (Ⅳ) was prepared by reduction of a technetate solution with Sn 2+ . The solubility of Tc(Ⅳ) has been determined in simulated groundwater and redistilled water under aerobic and anaerobic conditions. The effects of pH and CO 3 2- concentration of solution on solubility of Tc(Ⅳ) were studied. The concentration of total technetium and Tc(Ⅳ) species in the solutions were periodically determined by separating the oxidized and reduced technetium species using a solvent extraction procedure and counting the beta activity of the 99 Tc with a liquid scintillation counter. The experimental results show that the rate of oxidation of Tc(Ⅳ) in simulated groundwater and redistilled water is about (1.49-1.86)x10 -9 mol·L -1 d -1 under aerobic conditions, while no Tc(Ⅳ) oxidation was detected in simulated groundwater and redistilled water under anaerobic conditions. Under aerobic or anaerobic conditions the solubility of Tc(Ⅳ) in simulated groundwater and redistilled water is equal on the whole after centrifugation or ultrafiltration. The

Solubility of natural gases in water under high pressure; Solubilite des gaz naturels dans l`eau a pression elevee

Energy Technology Data Exchange (ETDEWEB)

Dhima, A

1998-10-08

Under high pressure (up to 1200 bar) and high temperature (up to 200 deg C) petroleum reservoir conditions the hydrocarbon-water mutual solubilities may become important. Under such conditions, the prediction of hydrocarbon water solubilities is a challenge for petroleum engineers. Indeed, very few studies have been done ar pressures higher that 700 bars. New solubility data for methane, ethane, n-butane, CO{sub 2} and their mixtures in pure water were obtained at 344.25 K and from 2.5 to 100 MPa. The results agree very well with those of the literature in the case of pure hydrocarbons in water, but differ for the hydrocarbon mixtures. A rigorous thermodynamic analysis allows the elaboration of a model that combines a cubic equation of state (Peng-Robinson with k{sub ij} given in literature) with the Henry`s law approach. The (P,T) functional form of Henry`s constant is given by the Krichevsky-Kasarnovsky equation which involves two important parameters: partial molar volume at infinite dilution and Henry`s constant at the vapour pressure of water. For a given solute both parameters are only functions of temperature. A critical selection of binary solubility data for a large number of solutes has been used as a basis for a new correlation for calculating both this partial molar volume and the corresponding Henry`s constants as a function of temperature. (author) 169 refs.

Solubility of 1-aminoanthraquinone and 1-nitroanthraquinone in supercritical carbon dioxide

International Nuclear Information System (INIS)

Tamura, Kazuhiro; Alwi, Ratna Surya; Tanaka, Tatsuro; Shimizu, Keisuke

2017-01-01

Highlights: • Solubility of 1-aminoanthraquinone and 1-nitroanthraquinone in scCO 2 were measured. • Temperature ranges of (323.15–383.15) K and pressures of (12.5–25.0) MPa. • Solubility of 1-aminoanthraquinone was higher than that of 1-nitroanthraquinone. • Demonstrated effect of amino and nitro groups on the solubility of anthraquinones. • Correlated well by CO 2 density models and thermodynamic models. - Abstract: The solubility of 1-aminoanthraquinone (Smoke Orange G) and 1-nitroanthraquinone in supercritical carbon dioxide (scCO 2 ) was measured at the temperatures (323.15, 353.15 and 383.15) K and over the pressure range of (12.5–25.0) MPa by a flow type apparatus. Mole fraction solubility of 1-aminoanthraquinone, 3.51 × 10 −5 , was significantly higher than that of 1-nitroanthraquinone, 2.52 × 10 −5 , as compared at 383.15 K and 25 MPa. It was found that amino group in 1-aminoanthraquinone effects to enhance the solubility of anthraquinone derivatives in supercritical carbon dioxide in comparison with nitro group in 1-nitroanthraquinone. Seven different kinds of semi-empirical models, expressed in terms of CO 2 density, were used to correlate the experimental results. Moreover, the solubilities of anthraquinone derivatives were analysed thermodynamically by the regular solution model with the Flory–Huggins theory and by the Peng–Robinson equation of state with a modification of Stryjek and Vera (PRSV-EOS). Good agreement with slightly less than 15 per cent of relative deviation between the experimental and calculated solubilities of the anthraquinone derivatives was obtained.

A Nitrogen-Doped Carbon Catalyst for Electrochemical CO2 Conversion to CO with High Selectivity and Current Density.

Science.gov (United States)

Jhong, Huei-Ru Molly; Tornow, Claire E; Smid, Bretislav; Gewirth, Andrew A; Lyth, Stephen M; Kenis, Paul J A

2017-03-22

We report characterization of a non-precious metal-free catalyst for the electrochemical reduction of CO 2 to CO; namely, a pyrolyzed carbon nitride and multiwall carbon nanotube composite. This catalyst exhibits a high selectivity for production of CO over H 2 (approximately 98 % CO and 2 % H 2 ), as well as high activity in an electrochemical flow cell. The CO partial current density at intermediate cathode potentials (V=-1.46 V vs. Ag/AgCl) is up to 3.5× higher than state-of-the-art Ag nanoparticle-based catalysts, and the maximum current density is 90 mA cm -2 . The mass activity and energy efficiency (up to 48 %) were also higher than the Ag nanoparticle reference. Moving away from precious metal catalysts without sacrificing activity or selectivity may significantly enhance the prospects of electrochemical CO 2 reduction as an approach to reduce atmospheric CO 2 emissions or as a method for load-leveling in relation to the use of intermittent renewable energy sources. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Experimental and modeling investigations of solubility and saturated liquid densities and viscosities for binary systems (methane +, ethane +, and carbon dioxide + 2-propanol)

International Nuclear Information System (INIS)

Nourozieh, Hossein; Kariznovi, Mohammad; Abedi, Jalal

2013-01-01

Highlights: • Solubilities of CH 4 , C 2 H 6 , and CO 2 in 2-propanol and saturated density and viscosity. • Solubility of C 2 H 6 in 2-propanol is higher than CH 4 and CO 2 . • Dissolution of CO 2 increases liquid density and reduces liquid viscosity. • Liquid density and viscosity reduces with dissolution of CH 4 and C 2 H 6 . • Solubilities and saturated liquid densities were predicted with SRK and PR EOS. -- Abstract: Solubilities of methane, ethane, and carbon dioxide in 2-propanol have been measured at the temperatures (303 and 323) K and at the pressures up to 6 MPa using an in-house designed PVT apparatus. The saturated liquid properties, density and viscosity, were also measured in each experiment. Prior to the phase equilibrium measurements, the density and viscosity of pure 2-propanol were measured at the temperatures (303 and 323) K over the pressure range (0.1 to 10) MPa. The dissolution of carbon dioxide in 2-propanol caused a decline in the viscosity of saturated liquid phase while an increase in the density of gas-expanded liquid was observed. The viscosity-pressure trends for methane- and ethane-saturated liquid viscosities were similar to carbon dioxide, but the saturated liquid densities decreased with the dissolution of methane and ethane in 2-propanol. Solubility increased with pressure and decreased with temperature for all compressed gases (methane, ethane and carbon dioxide). The experimental data were well correlated using Soave–Redlich–Kwong and Peng–Robinson equations of state. The solubilities and saturated liquid densities were well represented with both equations of state, and there is no superior equation of state for the modeling of the phase compositions and saturated liquid densities

Change in cap rock porosity triggered by pressure and temperature dependent CO2–water–rock interactions in CO2 storage systems

Directory of Open Access Journals (Sweden)

Christina Hemme

2017-03-01

Full Text Available Carbon capture and storage in deep geological formations is a method to reduce greenhouse gas emissions. Supercritical CO2 is injected into a reservoir and dissolves in the brine. Under the impact of pressure and temperature (P–T the aqueous species of the CO2-acidified brine diffuse through the cap rock where they trigger CO2–water–rock interactions. These geochemical reactions result in mineral dissolution and precipitation along the CO2 migration path and are responsible for a change in porosity and therefore for the sealing capacity of the cap rock. This study focuses on the diffusive mass transport of CO2 along a gradient of decreasing P–T conditions. The process is retraced with a one-dimensional hydrogeochemical reactive mass transport model. The semi-generic hydrogeochemical model is based on chemical equilibrium thermodynamics. Based on a broad variety of scenarios, including different initial mineralogical, chemical and physical parameters, the hydrogeochemical parameters that are most sensitive for safe long-term CO2 storage are identified. The results demonstrate that P–T conditions have the strongest effect on the change in porosity and the effect of both is stronger at high P–T conditions because the solubility of the mineral phases involved depends on P–T conditions. Furthermore, modeling results indicate that the change in porosity depends strongly on the initial mineralogical composition of the reservoir and cap rock as well as on the brine compositions. Nevertheless, a wide range of conditions for safe CO2 storage is identified.

Solubility of corrosion products in high temperature water

International Nuclear Information System (INIS)

Srinivasan, M.P.; Narasimhan, S.V.

1995-01-01

A short review of solubility of corrosion products at high temperature in either neutral or alkaline water as encountered in BWR, PHWR and PWR primary coolant reactor circuits is presented in this report. Based on the available literature, various experimental techniques involved in the study of the solubility, theory for fitting the solubility data to the thermodynamic model and discussion of the published results with a scope for future work have been brought out. (author). 17 refs., 7 figs

Effects of high CO2 levels on dynamic photosynthesis: carbon gain, mechanisms, and environmental interactions.

Science.gov (United States)

Tomimatsu, Hajime; Tang, Yanhong

2016-05-01

Understanding the photosynthetic responses of terrestrial plants to environments with high levels of CO2 is essential to address the ecological effects of elevated atmospheric CO2. Most photosynthetic models used for global carbon issues are based on steady-state photosynthesis, whereby photosynthesis is measured under constant environmental conditions; however, terrestrial plant photosynthesis under natural conditions is highly dynamic, and photosynthetic rates change in response to rapid changes in environmental factors. To predict future contributions of photosynthesis to the global carbon cycle, it is necessary to understand the dynamic nature of photosynthesis in relation to high CO2 levels. In this review, we summarize the current body of knowledge on the photosynthetic response to changes in light intensity under experimentally elevated CO2 conditions. We found that short-term exposure to high CO2 enhances photosynthetic rate, reduces photosynthetic induction time, and reduces post-illumination CO2 burst, resulting in increased leaf carbon gain during dynamic photosynthesis. However, long-term exposure to high CO2 during plant growth has varying effects on dynamic photosynthesis. High levels of CO2 increase the carbon gain in photosynthetic induction in some species, but have no significant effects in other species. Some studies have shown that high CO2 levels reduce the biochemical limitation on RuBP regeneration and Rubisco activation during photosynthetic induction, whereas the effects of high levels of CO2 on stomatal conductance differ among species. Few studies have examined the influence of environmental factors on effects of high levels of CO2 on dynamic photosynthesis. We identified several knowledge gaps that should be addressed to aid future predictions of photosynthesis in high-CO2 environments.

Modeling gas solubilities in imidazolium based ionic liquids with the [Tf2N] anion using the GC-EoS

NARCIS (Netherlands)

Pereda, Selva; Raeissi, Sonia; Andreatta, A.E. (Alfonsina); Bottini, Susana B.; Kroon, Maaike; Peters, Cor

2016-01-01

The group contribution equation of state (GC-EoS) is extended to model gas solubilities in the homologous 1-alkyl-3-methylimidazolium bis(trifluoromethyl-sulfonyl) imide family. The gases considered in this work are CO2, CO, H2, CH4, and C2H6. The model parameters were estimated on the basis of 1400

Solubility behavior and biopharmaceutical classification of novel high-solubility ciprofloxacin and norfloxacin pharmaceutical derivatives.

Science.gov (United States)

Breda, Susana A; Jimenez-Kairuz, Alvaro F; Manzo, Ruben H; Olivera, María E

2009-04-17

The hydrochlorides of the 1:3 aluminum:norfloxacin and aluminum:ciprofloxacin complexes were characterized according to the Biopharmaceutics Classification System (BCS) premises in comparison with their parent compounds. The pH-solubility profiles of the complexes were experimentally determined at 25 and 37 degrees C in the range of pH 1-8 and compared to that of uncomplexed norfloxacin and ciprofloxacin. Both complexes are clearly more soluble than the antibiotics themselves, even at the lowest solubility pHs. The increase in solubility was ascribed to the species controlling solubility, which were analyzed in the solid phases at equilibrium at selected pHs. Additionally, permeability was set as low, based on data reported in the scientific literature regarding oral bioavailability, intestinal and cell cultures permeabilities and also considering the influence of stoichiometric amounts of aluminum. The complexes fulfill the BCS criterion to be classified as class 3 compounds (high solubility/low permeability). Instead, the active pharmaceutical ingredients (APIs) currently used in solid dosage forms, norfloxacin and ciprofloxacin hydrochloride, proved to be BCS class 4 (low solubility/low permeability). The solubility improvement turns the complexes as potential biowaiver candidates from the scientific point of view and may be a good way for developing more dose-efficient formulations. An immediate release tablet showing very rapid dissolution was obtained. Its dissolution profile was compared to that of the commercial ciprofloxacin hydrochloride tablets allowing to dissolution of the complete dose at a critical pH such as 6.8.

CO2/CH4 Separation by a Mixed Matrix Membrane of Polymethylpentyne/MIL-53 Particles

Directory of Open Access Journals (Sweden)

Reza Abedini

2014-10-01

Full Text Available The effect of Materials Institute Lavoisier-53 (MIL-53 particles on gas transport properties of polymethylpentyne (PMP was investigated. MIL-53 was added to the polymer matrix with different loadings of 10, 20 and 30 wt%. The properties of MIL-53 and prepared membranes were analyzed through FTIR, SEM and TGA methods. The adsorption of CO2 and CH4 was conducted and analyzed accurately through Langmuir equation to investigate the gas transport properties of membranes. The results from TGA showed that degradation temperature (Td increases significantly with increasing MIL-53 loading. SEM images demonstrated that MIL-53 particles dispersed well in polymer matrix with no considerable agglomeration and no non-selective void formation at polymer/filler interface. In addition, CO2 and CH4 permeability measurement along with calculation of CO2/CH4 selectivity were performed. The results showed that the permeability of gases (especially for CO2 increased significantly by increasing the MIL-53 loading. Additionally, CO2/CH4 selectivity showed an increasing trend with increasing the MIL-53 weight percent. Unlike CH4, the CO2 solubility coefficient increased with increasing the MIL-53 loading because of high free volume of membrane and selective adsorption of CO2 with MIL-53. Despite CO2 solubility enhancement its diffusivity coefficient remained more or less unchanged. The enhancement in CH4 permeability has been mainly attributed to its slight incremental diffusivity due to the membrane's increasingly higher free volume. Finally, a comparison between membranes performance and CO2/CH4 Robeson upper bound showed that, the performance of membranes improved due to the presence of MIL-53 which was very close to the Robeson bound.

Pressure Swing Absorption Device and Process for Separating CO{sub 2} from Shifted Syngas and its Capture for Subsequent Storage

Energy Technology Data Exchange (ETDEWEB)

Sirkar, Kamalesh; Jie, Xingming; Chau, John; Obuskovic, Gordana

2013-03-31

Using the ionic liquid (IL) 1-butyl-3-methylimidazolium dicyanamide ([bmim][DCA]) as the absorbent on the shell side of a membrane module containing either a porous hydrophobized ceramic tubule or porous hydrophobized polyether ether ketone (PEEK) hollow fiber membranes, studies for CO{sub 2} removal from hot simulated pre-combustion shifted syngas were carried out by a novel pressure swing membrane absorption (PSMAB) process. Helium was used as a surrogate for H{sub 2} in a simulated shifted syngas with CO{sub 2} around 40% (dry gas basis). In this cyclic separation process, the membrane module was used to achieve non-dispersive gas absorption from a high-pressure feed gas (689-1724 kPag; 100-250 psig) at temperatures between 25-1000C into a stationary absorbent liquid on the module shell side during a certain part of the cycle followed by among other cycle steps controlled desorption of the absorbed gases from the liquid in the rest of the cycle. Two product streams were obtained, one He-rich and the other CO{sub 2}-rich. Addition of polyamidoamine (PAMAM) dendrimer of generation 0 to IL [bmim][DCA] improved the system performance at higher temperatures. The solubilities of CO{sub 2} and He were determined in the ionic liquid with or without the dendrimer in solution as well as in the presence or absence of moisture; polyethylene glycol (PEG) 400 was also studied as a replacement for the IL. The solubility selectivity of the ionic liquid containing the dendrimer for CO{sub 2} over helium was considerably larger than that for the pure ionic liquid. The solubility of CO{sub 2} and CO{sub 2}-He solubility selectivity of PEG 400 and a solution of the dendrimer in PEG 400 were higher than the corresponding ones in the IL, [bmim][DCA]. A mathematical model was developed to describe the PSMAB process; a numerical solution of the governing equations described successfully the observed performance of the PSMAB process for the pure ionic liquid-based system.

Ring-opening polymerization of 19-electron [2]cobaltocenophanes: a route to high-molecular-weight, water-soluble polycobaltocenium polyelectrolytes.

Science.gov (United States)

Mayer, Ulrich F J; Gilroy, Joe B; O'Hare, Dermot; Manners, Ian

2009-08-05

Water-soluble, high-molecular-weight polycobaltocenium polyelectrolytes have been prepared by ring-opening polymerization (ROP) techniques. Anionic polymerization of a strained 19-electron dicarba[2]cobaltocenophane followed by oxidation in the presence of ammonium chloride resulted in the formation of oligomers with up to nine repeat units. Thermal ROP of dicarba[2]cobaltocenophane followed by oxidation in the presence of ammonium nitrate resulted in the formation of high-molecular-weight polycobaltocenium nitrate, a redox-active cobalt-containing polyelectrolyte.

Synergistic enhancement in the co-gelation of salt-soluble pea proteins and whey proteins.

Science.gov (United States)

Wong, Douglas; Vasanthan, Thava; Ozimek, Lech

2013-12-15

This paper investigated the enhancement of thermal gelation properties when salt-soluble pea proteins were co-gelated with whey proteins in NaCl solutions, using different blend ratios, total protein concentrations, pH, and salt concentrations. Results showed that the thermal co-gelation of pea/whey proteins blended in ratio of 2:8 in NaCl solutions showed synergistic enhancement in storage modulus, gel hardness, paste viscosity and minimum gelation concentrations. The highest synergistic enhancement was observed at pH 6.0 as compared with pH 4.0 and 8.0, and at the lower total protein concentration of 10% as compared with 16% and 22% (w/v), as well as in lower NaCl concentrations of 0.5% and 1.0% as compared with 1.5%, 2.0%, 2.5%, and 3.0% (w/v). The least gelation concentrations were also lower in the different pea/whey protein blend ratios than in pure pea or whey proteins, when dissolved in 1.0% or 2.5% (w/v) NaCl aqueous solutions. Copyright © 2013 Elsevier Ltd. All rights reserved.

The stability evaluation of lime mud as transesterification catalyst in resisting CO2 and H2O for biodiesel production

International Nuclear Information System (INIS)

Li, Hui; Niu, Sheng-li; Lu, Chun-mei; Cheng, Shi-qing

2015-01-01

Highlights: • Lime mud (LM) is pretreated with calcination, hydration and desiccation. • The alkali solubility is the amount of alkali compounds dissolved in methanol. • The soluble alkali amount in LM700-H is higher than that of CaO–H. • LM700 possesses a stronger capability than CaO in resisting H 2 O and CO 2 . - Abstract: The most outstanding property of the heterogeneous transesterification catalysts is recyclable, but their catalytic activity may be depressed for the absorption of moisture (H 2 O) and carbon dioxide (CO 2 ) in air, especially for the basic ones. Lime mud (LM) is effective in catalyzing transesterification, yet its property in resisting H 2 O and CO 2 is indistinct, which should be emphasized. In this study, the LM based transesterification catalyst is prepared through calcinations. Then, it is hydrated and desiccated to simulate the contamination by H 2 O and CO 2 . Further, the fresh and the contaminated catalysts are characterized by X-ray diffraction (XRD), thermogravimetric analysis (TGA), Fourier transform infrared spectroscopy (FTIR), Hammette indicator, Brunauer–Emmett–Teller (BET) surface area and soluble alkali examination, to reveal the mechanism of LM in resisting H 2 O and CO 2 . Meanwhile, the analytical grade calcium oxide (CaO) is chosen for comparison. Finally, to comprehensively investigate the influences of H 2 O and CO 2 on LM in catalyzing transesterification, the factors of the catalyst addition percentage, molar ratio of methanol to oil and transesterification temperature are evaluated

Synthesis, selective pH-sensing activity and logic behavior of highly water-soluble 1,8-naphthalimide and dihydroimidazonaphthalimide derivatives

International Nuclear Information System (INIS)

Georgiev, Nikolai I.; Dimov, Stefan M.; Asiri, Abdullah M.; Alamry, Khalid A.; Obaid, Abdullah Y.; Bojinov, Vladimir B.

2014-01-01

This paper reports on the design, synthesis and fluorescence pH-sensing activity of a novel highly water-soluble 1,8-naphthalimide and its 9,10-dihydro-7H-imidazo[1,2-b]benz[d,e]isoqionolin-7-one derivative. The changes in the photophysical properties of the compounds as a function of pH were investigated in 100% aqueous medium. The 1,8-naphthalimide dye manifests “off–on” pH sensing properties based on photoinduced electron transfer, while its condensed heterocyclic derivative revealed ratiometric “off–on–off” fluorescence pH probe activity. Due to the two different “off”-states the dihydroimidazonaphthalimide derivative is able to execute the logical functions INH and XNOR and as such, to act as a magnitude digital comparator. The synthesized compounds show excellent selectivity toward protons over the representative transition metal ions (Co 2+ , Cu 2+ , Fe 3+ , Ni 2+ , Cd 2+ , Pb 2+ , Zn 2+ , Hg 2+ and Ag + ) is commonly used buffer solutions. The high water solubility and excellent pH selectivity of both probes as well as the ratiometric pH sensitivity of dihydroimidazonaphthalimide derivative may be beneficially for monitoring pH variations in complex samples. - Highlights: • Two novel highly water-soluble fluorescent dihydroimidazonaphthalimide and 1,8-naphthalimide derivatives are synthesized. • Compounds are designed as fluorescent “off–on” and “off–on–off” molecular pH probes based on PET and ICT. • Probes manifest selective response to protons over representative transition metal ions in 100% aqueous medium. • Logic functions INH and XNOR are achieved for dihydroimidazonaphthalimide derivative. • A combinatorial logic circuit (magnitude digital comparator) is demonstrated

Measuring and validation for isothermal solubility data of solid 2-(3,4-Dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one (nobiletin) in supercritical carbon dioxide

International Nuclear Information System (INIS)

Cabrera, Adolfo L.; Toledo, Alma R.; Valle, José M. del; Fuente, Juan C. de la

2015-01-01

Highlights: • Solubility of nobiletin in supercritical carbon dioxide was obtained. • Measured at T = (313, 323, and 333) K and at (17.97 to 31.40) MPa. • Correlated with empirical equation expressed in terms of SC-CO_2 density. • Binary interaction parameters were fitted from experimental data using PR-EOS with Wong–Sandler mixing rule. • Thermodynamic consistency of phase equilibria data was evaluated using the G–D equation. - Abstract: Isothermal solubility of 2-(3,4-Dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one (nobiletin) in supercritical carbon dioxide at temperatures of (313, 323 and 333) K and pressures from (18 to 31) MPa was measured using an analytic-recirculation methodology, with direct determination of the molar composition of the carbon dioxide-rich phase by using high performance liquid chromatography. Results indicated that the range of the measured solubility of nobiletin was from 107 · 10"−"6 mol · mol"−"1 at T = 333 K and 18.35 MPa to 182 · 10"−"6 mol · mol"−"1 at T = 333 K and 31.40 MPa, with a temperature crossover around 18 MPa. The validation of the experimental solubility data was carried out by using three approaches, namely, estimation of combined expanded uncertainty for each solubility data point from experimental parameters values (⩽77 · 10"−"6 mol · mol"−"1); thermodynamic consistency, verified utilizing a test adapted from tools based on Gibbs–Duhem equation and solubility modelling results; and, self-consistency, proved by correlating the solubility data with a semi-empirical model as a function of temperature, pressure and pure CO_2 density.

Investigation of solubility of carbon dioxide in anhydrous milk fat by lab-scale manometric method.

Science.gov (United States)

Truong, Tuyen; Palmer, Martin; Bansal, Nidhi; Bhandari, Bhesh

2017-12-15

This study aims to examine the solubility of CO 2 in anhydrous milk fat (AMF) as functions of partial pressure, temperature, chemical composition and physical state of AMF. AMF was fractionated at 21°C to obtain stearin and olein fractions. The CO 2 solubility was measured using a home-made experimental apparatus based on changes of CO 2 partial pressures. The apparatus was found to be reliable as the measured and theoretical values based on the ideal gas law were comparable. The dissolved CO 2 concentration in AMF increased with an increase in CO 2 partial pressure (0-101kPa). The apparent CO 2 solubility coefficients (molkg -1 Pa -1 ) in the AMF were 5.75±0.16×10 -7 , 3.9±0.19×10 -7 and 1.19±0.14×10 -7 at 35, 24 and 4°C, respectively. Higher liquid oil proportions resulted in higher CO 2 solubility in the AMF. There was insignificant difference in the dissolved CO 2 concentration among the AMF, stearin and olein fractions in their liquid state at 40°C. Copyright © 2017 Elsevier Ltd. All rights reserved.

Annual CO2 budget and seasonal CO2 exchange signals at a high Arctic permafrost site on Spitsbergen, Svalbard archipelago

DEFF Research Database (Denmark)

Luërs, J.; Westermann, Signe; Piel, K.

2014-01-01

-lasting snow cover, and several months of darkness. This study presents a complete annual cycle of the CO2 net ecosystem exchange (NEE) dynamics for a high Arctic tundra area at the west coast of Svalbard based on eddy covariance flux measurements. The annual cumulative CO2 budget is close to 0 g C m-2 yr-1...

CO2 Capture by Absorption with Potassium Carbonate

Energy Technology Data Exchange (ETDEWEB)

Gary T. Rochelle; Marcus Hilliard; Eric Chen; Babatunde Oyenekan; Ross Dugas; John McLees; Andrew Sexton; Daniel Ellenberger

2005-10-26

The objective of this work is to improve the process for CO{sub 2} capture by alkanolamine absorption/stripping by developing an alternative solvent, aqueous K{sub 2}CO{sub 3} promoted by piperazine. Modeling of stripper performance suggests that vacuum stripping may be an attractive configuration for all solvents. Flexipac 1Y structured packing performs in the absorber as expected. It provides twice as much mass transfer area as IMTP No.40 dumped packing. Independent measurements of CO{sub 2} solubility give a CO{sub 2} loading that is 20% lower than that Cullinane's values with 3.6 m PZ at 100-120 C. The effective mass transfer coefficient (K{sub G}) in the absorber with 5 m K/2.5 m PZ appears to be 0 to 30% greater than that of 30 wt% MEA.

Hydrogen purification by selective methanation of CO in CO/CO2/H2

DEFF Research Database (Denmark)

Andersen, Anne Mette; Johannessen, Tue; Livbjerg, Hans

down through the reactor and inside the catalyst pellets/particles. The small particles, which have a rather high effectiveness factor with respect to methanation of CO, have a high CO selectivity, whereas the larger pellets have very low selectivity even at high CO inlet concentrations. Negative...... of reaction kinetics and pore diffusion is crucial for interpreting the experimental data. We have found that the selectivity decreases by increasing the reactor temperature or catalyst particle size and when the CO inlet concentration is reduced. As a result, the selectivity drops significantly...... in an integral reactor operating at high CO-conversion. The lower limit of CO concentration in the outlet is determined by the quasi-equilibrium between CO removal and CO production from CO2....

Modeling of fate and transport of co-injection of H2S with CO2 in deep saline formations

Energy Technology Data Exchange (ETDEWEB)

Zhang, W.; Xu, T.; Li, Y.

2010-12-15

The geological storage of CO{sub 2} in deep saline formations is increasing seen as a viable strategy to reduce the release of greenhouse gases into the atmosphere. However, costs of capture and compression of CO{sub 2} from industrial waste streams containing small quantities of sulfur and nitrogen compounds such as SO{sub 2}, H{sub 2}S and N{sub 2} are very expensive. Therefore, studies on the co-injection of CO{sub 2} containing other acid gases from industrial emissions are very important. In this paper, numerical simulations were performed to study the co-injection of H{sub 2}S with CO{sub 2} in sandstone and carbonate formations. Results indicate that the preferential dissolution of H{sub 2}S gas (compared with CO{sub 2} gas) into formation water results in the delayed breakthrough of H{sub 2}S gas. Co-injection of H{sub 2}S results in the precipitation of pyrite through interactions between the dissolved H{sub 2}S and Fe{sup 2+} from the dissolution of Fe-bearing minerals. Additional injection of H{sub 2}S reduces the capabilities for solubility and mineral trappings of CO{sub 2} compared to the CO{sub 2} only case. In comparison to the sandstone (siliciclastic) formation, the carbonate formation is less favorable to the mineral sequestration of CO{sub 2}. Different from CO{sub 2} mineral trapping, the presence of Fe-bearing siliciclastic and/or carbonate is more favorable to the H{sub 2}S mineral trapping.

Ionic Liquid Confined in Mesoporous Polymer Membrane with Improved Stability for CO2/N2 Separation

Directory of Open Access Journals (Sweden)

Ming Tan

2017-09-01

Full Text Available Supported ionic liquid membranes (SILMs have a promising prospect of application in flue gas separation, owing to its high permeability and selectivity of CO2. However, existing SILMs have the disadvantage of poor stability due to the loss of ionic liquid from the large pores of the macroporous support. In this study, a novel SILM with high stability was developed by confining ionic liquid in a mesoporous polymer membrane. First, a mesoporous polymer membrane derived from a soluble, low-molecular-weight phenolic resin precursor was deposited on a porous Al2O3 support, and then 1-ethyl-3-methylimidazolium tetrafluoroborate ([emim][BF4] was immobilized inside mesopores of phenolic resin, forming the SILM under vacuum. Effects of trans-membrane pressure difference on the SILM separation performance were investigated by measuring the permeances of CO2 and N2. The SILM exhibits a high ideal CO2/N2 selectivity of 40, and an actual selectivity of approximately 25 in a mixed gas (50% CO2 and 50% N2 at a trans-membrane pressure difference of 2.5 bar. Compared to [emim][BF4] supported by polyethersulfone membrane with a pore size of around 0.45 μm, the [emim][BF4] confined in a mesoporous polymer membrane exhibits an improved stability, and its separation performance remained stable for 40 h under a trans-membrane pressure difference of 1.5 bar in a mixed gas before the measurement was intentionally stopped.

Material Processing with High Power CO2-Lasers

Science.gov (United States)

Bakowsky, Lothar

1986-10-01

After a period of research and development lasertechnique now is regarded as an important instrument for flexible, economic and fully automatic manufacturing. Especially cutting of flat metal sheets with high power C02-lasers and CNC controlled two or three axes handling systems is a wide spread. application. Three dimensional laser cutting, laser-welding and -heat treatment are just at the be ginning of industrial use in production lines. The main. advantages of laser technology. are - high. accuracy - high, processing velocity - law thermal distortion. - no tool abrasion. The market for laser material processing systems had 1985 a volume of 300 Mio S with growth rates between, 20 % and 30 %. The topic of this lecture are hiTrh. power CO2-lasers. Besides this systems two others are used as machining tools, Nd-YAG- and Eximer lasers. All applications of high. power CO2-lasers to industrial material processing show that high processing velocity and quality are only guaranteed in case of a stable intensity. profile on the workpiece. This is only achieved by laser systems without any power and mode fluctuations and by handling systems of high accuracy. Two applications in the automotive industry are described, below as examples for laser cutting and laser welding of special cylindrical motor parts.

High power CO2 lasers and their applications in nuclear industry

International Nuclear Information System (INIS)

Nath, A.K.

2002-01-01

Carbon dioxide laser is one of the most popular lasers in industry for material processing applications. It has very high power capability and high efficiency, can be operated in continuous wave (CW), modulated and pulsed modes, and has relatively low cost. Due to these characteristics high power CO 2 lasers are being used worldwide in different industries for a wide variety of materials processing operations. In nuclear industry, CO 2 laser has made its way in many applications. Some of the tasks performed by multikilowatt CO 2 laser are cutting operations necessary to remove unprocessible hardware from reactor fuel assemblies, sealing/fixing/removing radioactive contaminations onto/from concrete surfaces and surface modification of engineering components for improved surface mechanical and metallurgical characteristics. We have developed various models of CW CO 2 lasers of power up to 12 kW and a high repetitive rate TEA (Transversely Excited Atmospheric pressure) CO 2 laser of 500 W average power operating at 500 Hz repetition rates. We have carried many materials processing applications of direct relevance to DAE. Recent work includes laser welding of end plug PFBR fuel tubes, martensitic stainless steel and titanium alloy, surface cladding of turbine blades made of Ni-super alloy with stellite 694, fabrication on graded material of stainless steel and stellite, and laser scabbling, drilling and cutting of concrete which have potential application in decontamination and decommissioning of nuclear facilities. A brief overview of these indigenous developments will be presented. (author)

Soluble histone H2AX is induced by DNA replication stress and sensitizes cells to undergo apoptosis

Directory of Open Access Journals (Sweden)

Duensing Stefan

2008-07-01

Full Text Available Abstract Background Chromatin-associated histone H2AX is a key regulator of the cellular responses to DNA damage. However, non-nucleosomal functions of histone H2AX are poorly characterized. We have recently shown that soluble H2AX can trigger apoptosis but the mechanisms leading to non-chromatin-associated H2AX are unclear. Here, we tested whether stalling of DNA replication, a common event in cancer cells and the underlying mechanism of various chemotherapeutic agents, can trigger increased soluble H2AX. Results Transient overexpression of H2AX was found to lead to a detectable fraction of soluble H2AX and was associated with increased apoptosis. This effect was enhanced by the induction of DNA replication stress using the DNA polymerase α inhibitor aphidicolin. Cells manipulated to stably express H2AX did not contain soluble H2AX, however, short-term treatment with aphidicolin (1 h resulted in detectable amounts of H2AX in the soluble nuclear fraction and enhanced apoptosis. Similarly, soluble endogenous H2AX was detected under these conditions. We found that excessive soluble H2AX causes chromatin aggregation and inhibition of ongoing gene transcription as evidenced by the redistribution and/or loss of active RNA polymerase II as well as the transcriptional co-activators CBP and p300. Conclusion Taken together, these results show that DNA replication stress rapidly leads to increased soluble H2AX and that non-chromatin-associated H2AX can sensitize cells to undergo apoptosis. Our findings encourage further studies to explore H2AX and the cellular pathways that control its expression as anti-cancer drug targets.

Dissolved CO2 Increases Breakthrough Porosity in Natural Porous Materials.

Science.gov (United States)

Yang, Y; Bruns, S; Stipp, S L S; Sørensen, H O

2017-07-18

When reactive fluids flow through a dissolving porous medium, conductive channels form, leading to fluid breakthrough. This phenomenon is caused by the reactive infiltration instability and is important in geologic carbon storage where the dissolution of CO 2 in flowing water increases fluid acidity. Using numerical simulations with high resolution digital models of North Sea chalk, we show that the breakthrough porosity is an important indicator of dissolution pattern. Dissolution patterns reflect the balance between the demand and supply of cumulative surface. The demand is determined by the reactive fluid composition while the supply relies on the flow field and the rock's microstructure. We tested three model scenarios and found that aqueous CO 2 dissolves porous media homogeneously, leading to large breakthrough porosity. In contrast, solutions without CO 2 develop elongated convective channels known as wormholes, with low breakthrough porosity. These different patterns are explained by the different apparent solubility of calcite in free drift systems. Our results indicate that CO 2 increases the reactive subvolume of porous media and reduces the amount of solid residual before reactive fluid can be fully channelized. Consequently, dissolved CO 2 may enhance contaminant mobilization near injection wellbores, undermine the mechanical sustainability of formation rocks and increase the likelihood of buoyance driven leakage through carbonate rich caprocks.

Micronization, characterization and in-vitro dissolution of shellac from PGSS supercritical CO2 technique.

Science.gov (United States)

Labuschagne, Philip W; Naicker, Brendon; Kalombo, Lonji

2016-02-29

The purpose of this investigation was to determine whether shellac, a naturally occurring material with enteric properties, could be processed in supercritical CO2 (sc-CO2) using the particles from gas saturated solution (PGSS) process and how process parameters affect the physico-chemical properties of shellac. In-situ attenuated total reflection fourier transform infra-red (ATR-FTIR) spectroscopy showed that CO2 dissolves in shellac with solubility reaching a maximum of 13% (w/w) at 300 bar pressure and 40 °C and maximum swelling of 28%. The solubility of sc-CO2 in shellac allowed for the formation of porous shellac structures of which the average pore diameter and pore density could be controlled by adjustment of operating pressure and temperature. In addition, it was possible to produce shellac microparticles ranging in average diameter from 180 to 300 μm. It was also shown that processing shellac in sc-CO2 resulted in accelerated esterification reactions, potentially limiting the extent of post-processing "ageing" and thus greater stability. Due to additional hydrolysis reactions enhanced by the presence of sc-CO2, the solubility of shellac at pH 7.5 was increased by between 4 and 7 times, while dissolution rates were also increased. It was also shown that the in-vitro dissolution profiles of shellac could be modified by slight adjustment in operating temperatures. Copyright © 2015 Elsevier B.V. All rights reserved.

CO2 as an Oxidant for High Temperature Reactions

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Sibudjing eKawi

2015-03-01

Full Text Available This paper presents a review on the developments in catalyst technology for the reactions utilizing CO2 for high temperature applications. These include dehydrogenation of alkanes to olefins, the dehydrogenation of ethylbenzene to styrene and finally CO2 reforming of hydrocarbon feedstock (i.e. methane and alcohols. Aspects on the various reaction pathways are also highlighted. The literature on the role of promoters and catalyst development is critically evaluated. Most of the reactions discussed in this review are exploited in industries and related to on-going processes, thus providing extensive data from literature. However some reactions, such as CO2 reforming of ethanol and glycerol which have not reached industrial scale are also reviewed owing to their great potential in terms of sustainability which are essential as energy for the future. This review further illustrates the building-up of knowledge which shows the role of support and catalysts for each reaction and the underlying linkage between certain catalysts which can be adapted for the multiple CO2-related reactions.

Pigments and their solubility in and extractability by supercritical CO2 - I: the case of curcumin

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Baumann W.

2000-01-01

Full Text Available A specially designed high-pressure cell was used simultaneously as extractor/autoclave and photometric cell in a Perkin Elmer Lambda 5 spectrophotometer. Based on this cell, a simple method was developed to determine the extractability of pigments by pure and by modified supercritical (sc CO2. The method is demonstrated with curcumin from turmeric. With sc CO2 modified by 10% ethanol, the extraction yield for curcumin from two commercial finely ground dry turmeric samples was about 100%, measured by reference to the (complete extraction of samples of the same charge with pure ethanol under standard conditions. Extractable curcumin content was from 1.8 to 2.5%, with three samples of turmeric of different origins.

COPPER RESISTANT STRAIN CANDIDA TROPICALIS RomCu5 INTERACTION WITH SOLUBLE AND INSOLUBLE COPPER COMPOUNDS

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Ie. P. Prekrasna

2015-10-01

Full Text Available The focus of the study was interaction of Candida tropicalis RomCu5 isolated from highland Ecuador ecosystem with soluble and insoluble copper compounds. Strain C. tropicalis RomCu5 was cultured in a liquid medium of Hiss in the presence of soluble (copper citrate and CuCl2 and insoluble (CuO and CuCO3 copper compounds. The biomass growth was determined by change in optical density of culture liquid, composition of the gas phase was measured on gas chromatograph, redox potential and pH of the culture fluid was defined potentiometrically. The concentration of soluble copper compounds was determined colorimetrically. Maximal permissible concentration of Cu2+ for C. tropicalis RomCu5 was 30 000 ppm of Cu2+ in form of copper citrate and 500 ppm of Cu2+ in form of CuCl2. C. tropicalis was metabolically active at super high concentrations of Cu2+, despite the inhibitory effect of Cu2+. C. tropicalis immobilized Cu2+ in the form of copper citrate and CuCl2 by it accumulation in the biomass. Due to medium acidification C. tropicalis dissolved CuO and CuCO3. High resistance of C. tropicalis to Cu2+ and ability to interact with soluble and insoluble copper compounds makes it biotechnologically perspective.

Light-Triggered CO2 Breathing Foam via Nonsurfactant High Internal Phase Emulsion.

Science.gov (United States)

Zhang, Shiming; Wang, Dingguan; Pan, Qianhao; Gui, Qinyuan; Liao, Shenglong; Wang, Yapei

2017-10-04

Solid materials for CO 2 capture and storage have attracted enormous attention for gaseous separation, environmental protection, and climate governance. However, their preparation and recovery meet the problems of high energy and financial cost. Herein, a controllable CO 2 capture and storage process is accomplished in an emulsion-templated polymer foam, in which CO 2 is breathed-in under dark and breathed-out under light illumination. Such a process is likely to become a relay of natural CO 2 capture by plants that on the contrary breathe out CO 2 at night. Recyclable CO 2 capture at room temperature and release under light irradiation guarantee its convenient and cost-effective regeneration in industry. Furthermore, CO 2 mixed with CH 4 is successfully separated through this reversible breathing in and out system, which offers great promise for CO 2 enrichment and practical methane purification.

Clozapine-carboxylic acid plasticized co-amorphous dispersions: Preparation, characterization and solution stability evaluation

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Ali Ahmed Mahmoud Abdelhaleem

2015-06-01

Full Text Available This study addressed the possibility of forming of co-amorphous systems between clozapine (CZ and various carboxylic acid plasticizers (CAPs. The aim was to improve the solubility and oral bioavailability of clozapine. Co-amorphous dispersions were prepared using modified solvent evaporation methodology at drug/plasticizer stoichiometric ratios of 1:1, 1:1.5 and 1:2. Solid state characterization was performed using differential scanning calorimetry, X-ray diffraction and infra red spectroscopy. Highly soluble homogeneous co-amorphous dispersions were formed between clozapine and CAPs via hydrogen bonding. The co-amorphous dispersions formed with tartaric acid (1:2 showed the highest dissolution percentage (> 95 % in 20 minutes compared to pure crystalline CZ (56 %. Highly stable solutions were obtained from co-amorphous CZ-citric and CZ-tartaric acid at 1:1.5 molar ratio. The prepared dispersions suggest the possibility of peroral or sublingual administration of highly soluble clozapine at a reduced dose with the great chance to bypass the first pass metabolism.

Highly Rechargeable Lithium-CO2 Batteries with a Boron- and Nitrogen-Codoped Holey-Graphene Cathode.

Science.gov (United States)

Qie, Long; Lin, Yi; Connell, John W; Xu, Jiantie; Dai, Liming

2017-06-06

Metal-air batteries, especially Li-air batteries, have attracted significant research attention in the past decade. However, the electrochemical reactions between CO 2 (0.04 % in ambient air) with Li anode may lead to the irreversible formation of insulating Li 2 CO 3 , making the battery less rechargeable. To make the Li-CO 2 batteries usable under ambient conditions, it is critical to develop highly efficient catalysts for the CO 2 reduction and evolution reactions and investigate the electrochemical behavior of Li-CO 2 batteries. Here, we demonstrate a rechargeable Li-CO 2 battery with a high reversibility by using B,N-codoped holey graphene as a highly efficient catalyst for CO 2 reduction and evolution reactions. Benefiting from the unique porous holey nanostructure and high catalytic activity of the cathode, the as-prepared Li-CO 2 batteries exhibit high reversibility, low polarization, excellent rate performance, and superior long-term cycling stability over 200 cycles at a high current density of 1.0 A g -1 . Our results open up new possibilities for the development of long-term Li-air batteries reusable under ambient conditions, and the utilization and storage of CO 2 . © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

High efficiency pump combiner fabricated by CO2 laser splicing system

Science.gov (United States)

Zhu, Gongwen

2018-02-01

High power combiners are of great interest for high power fiber lasers and fiber amplifiers. With the advent of CO2 laser splicing system, power combiners are made possible with low manufacturing cost, low loss, high reliability and high performance. Traditionally fiber optical components are fabricated with flame torch, electrode arc discharge or filament heater. However, these methods can easily leave contamination on the fiber, resulting inconsistent performance or even catching fire in high power operations. The electrodes or filaments also degrade rapidly during the combiner manufacturing process. The rapid degradation will lead to extensive maintenance, making it unpractical or uneconomic for volume production. By contrast, CO2 laser is the cleanest heating source which provides reliable and repeatable process for fabricating fiber optic components including high power combiners. In this paper we present an all fiber end pumped 7x1 pump combiner fabricated by CO2 laser splicing system. The input pump fibers are 105/125 (core/clad diameters in μm) fibers with a core NA of 0.22. The output fiber is a 300/320 fiber with a core NA of 0.22. The average efficiency is 99.4% with all 7 ports more than 99%. The process is contamination-free and highly repeatable. To our best knowledge, this is the first report in the literature on power combiners fabricated by CO2 laser splicing system. It also has the highest reported efficiency of its kind.

Measurement and modelling of the solubility of carbon dioxide in aqueous 1,8-p-menthane-diamine solution

International Nuclear Information System (INIS)

Li, Jie; Lin, Xiao; Ning, Peng-Ge; Cao, Hong-Bin; Zhang, Yi

2014-01-01

Highlights: • Solubility of CO 2 was measured in aqueous MDA up to 1.97 CO 2 loading. • KE model was used to correlate VLE data in α 1 regions separately. • Four chemical equilibrium constants were determined. • Sterically hindering effect for MDA in CO 2 absorption was demonstrated. • MDA absorption efficiency was compared with MEA, MDEA and PZ. -- Abstract: The solubility of CO 2 in aqueous 1,8-p-menthane-diamine (MDA) solution with substance concentrations of 0.625 and 1.25 mol · L −1 was measured at temperatures (313.15, 333.15 and 353.15) K with CO 2 partial pressures ranging from (0.55 to 776.0) kPa and CO 2 loading ranging from (0.120 to 1.97) mol CO 2 per mol MDA. The gas solubility results are expressed as the partial pressure of CO 2 (P CO 2 ) against its mole ratio, i.e.α CO 2 (mol CO 2 per mol MDA). The chemical absorption reaction and thermodynamic model have been proposed. The physicochemical Kent–Eisenberg model was used to correlate all the experimental results of the solubility of CO 2 in the aqueous MDA solutions under investigation. The chemical equilibrium constants and model parameters were determined by fitting the VLE data

Supercritical CO2 extraction of candlenut oil: process optimization using Taguchi orthogonal array and physicochemical properties of the oil.

Science.gov (United States)

Subroto, Erna; Widjojokusumo, Edward; Veriansyah, Bambang; Tjandrawinata, Raymond R

2017-04-01

A series of experiments was conducted to determine optimum conditions for supercritical carbon dioxide extraction of candlenut oil. A Taguchi experimental design with L 9 orthogonal array (four factors in three levels) was employed to evaluate the effects of pressure of 25-35 MPa, temperature of 40-60 °C, CO 2 flow rate of 10-20 g/min and particle size of 0.3-0.8 mm on oil solubility. The obtained results showed that increase in particle size, pressure and temperature improved the oil solubility. The supercritical carbon dioxide extraction at optimized parameters resulted in oil yield extraction of 61.4% at solubility of 9.6 g oil/kg CO 2 . The obtained candlenut oil from supercritical carbon dioxide extraction has better oil quality than oil which was extracted by Soxhlet extraction using n-hexane. The oil contains high unsaturated oil (linoleic acid and linolenic acid), which have many beneficial effects on human health.

Atomistic simulation of CO 2 solubility in poly(ethylene oxide) oligomers

KAUST Repository

Hong, Bingbing; Panagiotopoulos, Athanassios Z.

2013-01-01

We have performed atomistic molecular dynamics simulations coupled with thermodynamic integration to obtain the excess chemical potential and pressure-composition phase diagrams for CO2 in poly(ethylene oxide) oligomers. Poly(ethylene oxide

Contrasting Impact of Future CO2 Emission Scenarios on the Extent of CaCO3 Mineral Undersaturation in the Humboldt Current System

Science.gov (United States)

Franco, A. C.; Gruber, N.; Frölicher, T. L.; Kropuenske Artman, L.

2018-03-01

The eastern boundary upwelling systems are among those regions that are most vulnerable to an ocean acidification-induced transition toward undersaturated conditions with respect to mineral CaCO3, but no assessment exists yet for the Humboldt Current System. Here we use a high-resolution (˜7.5 km) regional ocean model to investigate past and future changes in ocean pH and CaCO3 saturation state in this system. We find that within the next few decades, the nearshore waters off Peru are projected to become corrosive year round with regard to aragonite, the more soluble form of CaCO3. The volume of aragonite undersaturated water off Peru will continue to increase in the future irrespective of the amount of CO2 emitted to the atmosphere. In contrast, the development of the saturation state with regard to calcite, a less soluble form of carbonate, depends strongly on the scenario followed. By 2050, calcite undersaturation appears in the nearshore waters off Peru occasionally, but by 2090 in a high-emission scenario (RCP8.5), ˜60% of the water in the euphotic zone will become permanently calcite undersaturated. Most of this calcite undersaturation off Peru can likely be avoided if a low emission scenario (RCP2.6) consistent with the Paris Agreement is followed. The progression of ocean acidification off Chile follows a similar pattern, except that the saturation states are overall higher. But also here, calcite undersaturated waters will become common in the subsurface waters under the RCP8.5 scenario by the end of this century, while this can be avoided under the RCP2.6 scenario.

Responses of Four Rice Varieties to Elevated CO2 and Different Salinity Levels

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Sheidollah Kazemi

2018-05-01

Full Text Available Abstract:: This study was carried out in 2014 at Isfahan University of Technology, Iran, to evaluate the responses of four rice varieties (Neda, Deylamani, Shiroudi and Domsorkh to ambient (360 ± 50 μmol/mol and elevated (700 ± 50 μmol/mol air carbon dioxide (CO2 concentrations under four salinity levels (0, 30, 60 and 90 mmol/L NaCl. There was significant variation among rice varieties in response to elevated CO2 concentration under the four salinity levels. Under non-saline condition, elevated CO2 increased the dry weight of Neda, Deylamani and Domsorkh by 8%, 50% and 8%, respectively, but reversely decreased that of Shiroudi by 34%. Increasing CO2 concentration significantly reduced the negative effects of salinity on Shiroudi, but these effects were even increased in Deylamani and Domsorkh under all the salinity levels and in Neda only under 30 and 60 mmol/L NaCl. Significant correlations were established between plant dry weight, SPAD value and leaf area under both CO2 levels. However, this trend was observed only at ambient CO2 concentration in the presence of soluble carbohydrates. The results revealed the genotype and salinity dependence of the effects of CO2 concentrations on the rice traits investigated. Key words: CO2 concentration, genetic diversity, salt tolerance, water soluble carbohydrate

Iron content and solubility in dust from high-alpine snow along a north-south transect of High Asia

Directory of Open Access Journals (Sweden)

Guangjian Wu

2012-04-01

Full Text Available This study describes the dissolved and insoluble iron fraction of dust (mineral aerosol in high-alpine snow samples collected along a north-south transect across High Asia (Eastern Tien Shan, Qilian Shan, and Southern Tibetan Plateau. This dust provides the basic chemical properties of mid- and high-level tropospheric Asian dust that can supply the limiting iron nutrient for phytoplankton growth in the North Pacific. The iron content in Asian dust averages 4.95% in Eastern Tien Shan, 3.38–5.41% along Qilian Shan and 3.85% in the Southern Tibetan Plateau. The iron fractional solubility averages about 0.25% in Eastern Tien Shan, 0.05–2% along Qilian Shan and 1.5% in the Southern Tibetan Plateau. Among the controlling factors that can affect iron solubility in Asian dust, such as dust composition and particle grain size, acidity seems to be the most significant and can increase the iron solubility by one or two orders of magnitude with acidification of pH=0.66. Our results reveal that iron solubility of dust in the remote downwind sites is higher than that in high-alpine snow, confirming the strong pH-dependence of iron solubility, and indicating that Asian dust shows a large variation in iron solubility on a regional scale.

Thermodynamic Approach to Boron Nitride Nanotube Solubility and Dispersion

Science.gov (United States)

Tiano, A. L.; Gibbons, L.; Tsui, M.; Applin, S. I.; Silva, R.; Park, C.; Fay, C. C.

2016-01-01

Inadequate dispersion of nanomaterials is a critical issue that significantly limits the potential properties of nanocomposites and when overcome, will enable further enhancement of material properties. The most common methods used to improve dispersion include surface functionalization, surfactants, polymer wrapping, and sonication. Although these approaches have proven effective, they often achieve dispersion by altering the surface or structure of the nanomaterial and ultimately, their intrinsic properties. Co-solvents are commonly utilized in the polymer, paint, and art conservation industries to selectively dissolve materials. These co-solvents are utilized based on thermodynamic interaction parameters and are chosen so that the original materials are not affected. The same concept was applied to enhance the dispersion of boron nitride nanotubes (BNNTs) to facilitate the fabrication of BNNT nanocomposites. Of the solvents tested, dimethylacetamide (DMAc) exhibited the most stable, uniform dispersion of BNNTs, followed by N,N-dimethylformamide (DMF), acetone, and N-methyl-2-pyrrolidone (NMP). Utilizing the known Hansen solubility parameters of these solvents in comparison to the BNNT dispersion state, a region of good solubility was proposed. This solubility region was used to identify co-solvent systems that led to improved BNNT dispersion in poor solvents such as toluene, hexane, and ethanol. Incorporating the data from the co-solvent studies further refined the proposed solubility region. From this region, the Hansen solubility parameters for BNNTs are thought to lie at the midpoint of the solubility sphere: 16.8, 10.7, and 9.0 MPa(exp 1/2) for delta d, delta p, and delta h, respectively, with a calculated Hildebrand parameter of 21.8 MPa)exp 1/2).

Starch and sucrose synthesis in Phaseolus vulgaris as affected by light, CO2, and abscisic acid

International Nuclear Information System (INIS)

Sharkey, T.D.; Berry, J.A.; Raschke, K.

1985-01-01

Phaseolus vulgaris L. leaves were subjected to various light, CO 2 , and O 2 levels and abscisic acid, then given a 10 minute pulse of 14 CO 2 followed by a 5 minute chase with unlabeled CO 2 . After the chase period, very little label remained in the ionic fractions except at low CO 2 partial pressure. Most label was found in the neutral, alcohol soluble fraction or in the insoluble fraction digestable by amyloglucosidase. Sucrose formation was linearly related to assimilation rate. Starch formation increased linearly with assimilation rate, but did not occur if the assimilation rate was below 4 micromoles per square meter per second. Neither abscisic acid, nor high CO 2 in combination with low O 2 caused significant perturbations of the sucrose/starch formation ratio. These studies indicate that the pathways for starch and sucrose synthesis both are controlled by the rate of net CO 2 assimilation, with sucrose the preferred product at very low assimilation rates

A new set-up for simultaneous high-precision measurements of CO2, δ13C-CO2 and δ18O-CO2 on small ice core samples

Science.gov (United States)

Jenk, Theo Manuel; Rubino, Mauro; Etheridge, David; Ciobanu, Viorela Gabriela; Blunier, Thomas

2016-08-01

Palaeoatmospheric records of carbon dioxide and its stable carbon isotope composition (δ13C) obtained from polar ice cores provide important constraints on the natural variability of the carbon cycle. However, the measurements are both analytically challenging and time-consuming; thus only data exist from a limited number of sampling sites and time periods. Additional analytical resources with high analytical precision and throughput are thus desirable to extend the existing datasets. Moreover, consistent measurements derived by independent laboratories and a variety of analytical systems help to further increase confidence in the global CO2 palaeo-reconstructions. Here, we describe our new set-up for simultaneous measurements of atmospheric CO2 mixing ratios and atmospheric δ13C and δ18O-CO2 in air extracted from ice core samples. The centrepiece of the system is a newly designed needle cracker for the mechanical release of air entrapped in ice core samples of 8-13 g operated at -45 °C. The small sample size allows for high resolution and replicate sampling schemes. In our method, CO2 is cryogenically and chromatographically separated from the bulk air and its isotopic composition subsequently determined by continuous flow isotope ratio mass spectrometry (IRMS). In combination with thermal conductivity measurement of the bulk air, the CO2 mixing ratio is calculated. The analytical precision determined from standard air sample measurements over ice is ±1.9 ppm for CO2 and ±0.09 ‰ for δ13C. In a laboratory intercomparison study with CSIRO (Aspendale, Australia), good agreement between CO2 and δ13C results is found for Law Dome ice core samples. Replicate analysis of these samples resulted in a pooled standard deviation of 2.0 ppm for CO2 and 0.11 ‰ for δ13C. These numbers are good, though they are rather conservative estimates of the overall analytical precision achieved for single ice sample measurements. Facilitated by the small sample requirement

High pressure X-ray preionized TEMA-CO2 laser

NARCIS (Netherlands)

Bonnie, R.J.M.; Witteman, W.J.

1987-01-01

The construction of a high-pressure (up to 20 atm) transversely excited CO2 laser using transverse X-ray preionization is described. High pressure operation was found to be greatly improved in comparison to UV-preionized systems. Homogeneous discharges have been achieved in the pressure range 5–20

Visible-light Homogeneous Photocatalytic Conversion of CO2 into CO in Aqueous Solutions with an Iron Catalyst.

Science.gov (United States)

Rao, Heng; Bonin, Julien; Robert, Marc

2017-11-23

An iron-substituted tetraphenyl porphyrin bearing positively charged trimethylammonio groups at the para position of each phenyl ring catalyzes the photoinduced conversion of CO 2 . This complex is water soluble and acts as a molecular catalyst to selectively reduce CO 2 into CO under visible-light irradiation in aqueous solutions (acetonitrile/water=1:9 v/v) with the assistance of purpurin, a simple organic photosensitizer. CO is produced with a catalytic selectivity of 95 % and turnover number up to 120, illustrating the possibility of photocatalyzing the reduction of CO 2 in aqueous solution by using visible light, a simple organic sensitizer coupled to an amine as a sacrificial electron donor, and an earth-abundant metal-based molecular catalyst. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Thermodynamic and Kinetic Response of Microbial Reactions to High CO2.

Science.gov (United States)

Jin, Qusheng; Kirk, Matthew F

2016-01-01

Geological carbon sequestration captures CO 2 from industrial sources and stores the CO 2 in subsurface reservoirs, a viable strategy for mitigating global climate change. In assessing the environmental impact of the strategy, a key question is how microbial reactions respond to the elevated CO 2 concentration. This study uses biogeochemical modeling to explore the influence of CO 2 on the thermodynamics and kinetics of common microbial reactions in subsurface environments, including syntrophic oxidation, iron reduction, sulfate reduction, and methanogenesis. The results show that increasing CO 2 levels decreases groundwater pH and modulates chemical speciation of weak acids in groundwater, which in turn affect microbial reactions in different ways and to different extents. Specifically, a thermodynamic analysis shows that increasing CO 2 partial pressure lowers the energy available from syntrophic oxidation and acetoclastic methanogenesis, but raises the available energy of microbial iron reduction, hydrogenotrophic sulfate reduction and methanogenesis. Kinetic modeling suggests that high CO 2 has the potential of inhibiting microbial sulfate reduction while promoting iron reduction. These results are consistent with the observations of previous laboratory and field studies, and highlight the complexity in microbiological responses to elevated CO 2 abundance, and the potential power of biogeochemical modeling in evaluating and quantifying these responses.

Thermodynamic and kinetic response of microbial reactions to high CO2

Directory of Open Access Journals (Sweden)

Qusheng Jin

2016-11-01

Full Text Available Geological carbon sequestration captures CO2 from industrial sources and stores the CO2 in subsurface reservoirs, a viable strategy for mitigating global climate change. In assessing the environmental impact of the strategy, a key question is how microbial reactions respond to the elevated CO2 concentration. This study uses biogeochemical modeling to explore the influence of CO2 on the thermodynamics and kinetics of common microbial reactions in subsurface environments, including syntrophic oxidation, iron reduction, sulfate reduction, and methanogenesis. The results show that increasing CO2 levels decreases groundwater pH and modulates chemical speciation of weak acids in groundwater, which in turn affect microbial reactions in different ways and to different extents. Specifically, a thermodynamic analysis shows that increasing CO2 partial pressure lowers the energy available from syntrophic oxidation and acetoclastic methanogenesis, but raises the available energy of microbial iron reduction, hydrogenotrophic sulfate reduction and methanogenesis. Kinetic modeling suggests that high CO2 has the potential of inhibiting microbial sulfate reduction while promoting iron reduction. These results are consistent with the observations of previous laboratory and field studies, and highlight the complexity in microbiological responses to elevated CO2 abundance, and the potential power of biogeochemical modeling in evaluating and quantifying these responses.

Synthesis, selective pH-sensing activity and logic behavior of highly water-soluble 1,8-naphthalimide and dihydroimidazonaphthalimide derivatives

Energy Technology Data Exchange (ETDEWEB)

Georgiev, Nikolai I.; Dimov, Stefan M. [Department of Organic Synthesis, University of Chemical Technology and Metallurgy, 8 Kliment Ohridsky Street, 1756 Sofia (Bulgaria); Asiri, Abdullah M. [Chemistry Department, Faculty of Sciences, King Abdulaziz University, P.O. Box 80203, Jeddah 21589 (Saudi Arabia); Center of Excellence for Advanced Materials Research (CEAMR), King Abdulaziz University, P.O. Box 80203, Jeddah 21589 (Saudi Arabia); Alamry, Khalid A.; Obaid, Abdullah Y. [Chemistry Department, Faculty of Sciences, King Abdulaziz University, P.O. Box 80203, Jeddah 21589 (Saudi Arabia); Bojinov, Vladimir B., E-mail: vlbojin@uctm.edu [Department of Organic Synthesis, University of Chemical Technology and Metallurgy, 8 Kliment Ohridsky Street, 1756 Sofia (Bulgaria); Chemistry Department, Faculty of Sciences, King Abdulaziz University, P.O. Box 80203, Jeddah 21589 (Saudi Arabia)

2014-05-01

This paper reports on the design, synthesis and fluorescence pH-sensing activity of a novel highly water-soluble 1,8-naphthalimide and its 9,10-dihydro-7H-imidazo[1,2-b]benz[d,e]isoqionolin-7-one derivative. The changes in the photophysical properties of the compounds as a function of pH were investigated in 100% aqueous medium. The 1,8-naphthalimide dye manifests “off–on” pH sensing properties based on photoinduced electron transfer, while its condensed heterocyclic derivative revealed ratiometric “off–on–off” fluorescence pH probe activity. Due to the two different “off”-states the dihydroimidazonaphthalimide derivative is able to execute the logical functions INH and XNOR and as such, to act as a magnitude digital comparator. The synthesized compounds show excellent selectivity toward protons over the representative transition metal ions (Co{sup 2+}, Cu{sup 2+}, Fe{sup 3+}, Ni{sup 2+}, Cd{sup 2+}, Pb{sup 2+}, Zn{sup 2+}, Hg{sup 2+} and Ag{sup +}) is commonly used buffer solutions. The high water solubility and excellent pH selectivity of both probes as well as the ratiometric pH sensitivity of dihydroimidazonaphthalimide derivative may be beneficially for monitoring pH variations in complex samples. - Highlights: • Two novel highly water-soluble fluorescent dihydroimidazonaphthalimide and 1,8-naphthalimide derivatives are synthesized. • Compounds are designed as fluorescent “off–on” and “off–on–off” molecular pH probes based on PET and ICT. • Probes manifest selective response to protons over representative transition metal ions in 100% aqueous medium. • Logic functions INH and XNOR are achieved for dihydroimidazonaphthalimide derivative. • A combinatorial logic circuit (magnitude digital comparator) is demonstrated.

Density Fluctuation in Aqueous Solutions and Molecular Origin of Salting-Out Effect for CO2

International Nuclear Information System (INIS)

Ho, Tuan Anh; Ilgen, Anastasia

2017-01-01

Using molecular dynamics simulation, we studied the density fluctuations and cavity formation probabilities in aqueous solutions and their effect on the hydration of CO 2 . With increasing salt concentration, we report an increased probability of observing a larger than the average number of species in the probe volume. Our energetic analyses indicate that the van der Waals and electrostatic interactions between CO 2 and aqueous solutions become more favorable with increasing salt concentration, favoring the solubility of CO 2 (salting in). However, due to the decreasing number of cavities forming when salt concentration is increased, the solubility of CO 2 decreases. The formation of cavities was found to be the primary control on the dissolution of gas, and is responsible for the observed CO 2 salting-out effect. Finally, our results provide the fundamental understanding of the density fluctuation in aqueous solutions and the molecular origin of the salting-out effect for real gas.

Effects of temperature and anion species on CO2 permeability and CO2/N2 separation coefficient through ionic liquid membranes

International Nuclear Information System (INIS)

Jindaratsamee, Pinyarat; Shimoyama, Yusuke; Morizaki, Hironobu; Ito, Akira

2011-01-01

The permeability of carbon dioxide (CO 2 ) through imidazolium-based ionic liquid membranes was measured by a sweep gas method. Six species of ionic liquids were studied in this work as follows: [emim][BF 4 ], [bmim][BF 4 ], [bmim][PF 6 ], [bmim][Tf 2 N], [bmim][OTf], and [bmim][dca]. The ionic liquids were supported with a polyvinylidene fluoride porous membrane. The measurements were performed at T = (303.15 to 343.15) K. The partial pressure difference between feed and permeate sides was 0.121 MPa. The permeability of the CO 2 increases with temperature for the all ionic liquid species. Base on solution diffusion theory, it can be explained that the diffusion coefficient of CO 2 in an ionic liquid affects the temperature dependence more strongly than the solubility coefficient. The greatest permeability was obtained with the [bmim][Tf 2 N] membrane. The membrane of [bmim][PF 6 ] presents the lowest permeability. The separation coefficient between CO 2 and N 2 through the ionic liquid membranes was also investigated at the volume fraction of CO 2 at feed side 0.10. The separation coefficient decreases with the increase of temperature for the all ionic liquid species. The membrane of [emim][BF 4 ] and [bmim][BF 4 ] gives the highest separation coefficient at constant temperature. The lowest separation coefficient was obtained from [bmim][Tf 2 N] membrane which presents the highest permeability of CO 2 .

Functional genetic divergence in high CO2 adapted Emiliania huxleyi populations.

Science.gov (United States)

Lohbeck, Kai T; Riebesell, Ulf; Collins, Sinéad; Reusch, Thorsten B H

2013-07-01

Predicting the impacts of environmental change on marine organisms, food webs, and biogeochemical cycles presently relies almost exclusively on short-term physiological studies, while the possibility of adaptive evolution is often ignored. Here, we assess adaptive evolution in the coccolithophore Emiliania huxleyi, a well-established model species in biological oceanography, in response to ocean acidification. We previously demonstrated that this globally important marine phytoplankton species adapts within 500 generations to elevated CO2 . After 750 and 1000 generations, no further fitness increase occurred, and we observed phenotypic convergence between replicate populations. We then exposed adapted populations to two novel environments to investigate whether or not the underlying basis for high CO2 -adaptation involves functional genetic divergence, assuming that different novel mutations become apparent via divergent pleiotropic effects. The novel environment "high light" did not reveal such genetic divergence whereas growth in a low-salinity environment revealed strong pleiotropic effects in high CO2 adapted populations, indicating divergent genetic bases for adaptation to high CO2 . This suggests that pleiotropy plays an important role in adaptation of natural E. huxleyi populations to ocean acidification. Our study highlights the potential mutual benefits for oceanography and evolutionary biology of using ecologically important marine phytoplankton for microbial evolution experiments. © 2012 The Author(s). Evolution © 2012 The Society for the Study of Evolution.

Low vapour pressure deficit reduces the beneficial effect of elevated CO{sub 2} on growth of N{sub 2}-fixing alfalfa plants

Energy Technology Data Exchange (ETDEWEB)

Luis, I. De; Irigoyen, J.J.; Sanchez-Diaz, M. [Univ. de Navarra, Dept. de Fisioligia Vegetal, Pamplona (Spain)

2002-11-01

Plant responses to elevated CO{sub 2} can be modified by many environmental factors, but very little attention has been paid to the interaction between CO{sub 2} and changes in vapour pressure deficit (VPD). Thirty-day-old alfalfa plants (Medicago sativa L. cv. Aragon), which were inoculated with Sinorhizobium meliloti 102F78 strain, were grown for 1 month in controlled environment chambers at 25/15 deg C, 14 h photoperiod, and 600 mol m{sup -2} s{sup -1} photosynthetic photon flux (PPF), using a factorial combination of CO{sub 2} concentration (400 mol mol{sup -1} or 700 mol mol{sup -1}) and vapour pressure deficit (0.48 kPa or 1.74 kPa, which corresponded to relative humidities of 85% and 45% at 25 deg C, respectively). Elevated CO{sub 2} strongly stimulated plant growth under high VPD conditions, but this beneficial effect was not observed under low VPD. Under low VPD, elevated CO{sub 2} also did not enhance plant photosynthesis, and plant water stress was greatest for plants grown at elevated CO{sub 2} and low VPD. Moreover, plants grown under elevated CO{sub 2} and low VPD had a lower leaf soluble protein and photosynthetic activity (photosynthetic rate and carboxylation efficiency) than plants grown under elevated CO{sub 2} and high VPD. Elevated CO{sub 2} significantly increased leaf adaxial and abaxial temperatures. Because the effects of elevated CO{sub 2} were dependent on vapour pressure deficit, VPD needs to be controlled in experiments studying the effect of elevated CO{sub 2} as well as considered in the extrapolations of results to a warmer, high-CO{sub 2} world. (au)

Painted Goby Larvae under High-CO2 Fail to Recognize Reef Sounds.

Directory of Open Access Journals (Sweden)

Joana M Castro

Full Text Available Atmospheric CO2 levels have been increasing at an unprecedented rate due to anthropogenic activity. Consequently, ocean pCO2 is increasing and pH decreasing, affecting marine life, including fish. For many coastal marine fishes, selection of the adult habitat occurs at the end of the pelagic larval phase. Fish larvae use a range of sensory cues, including sound, for locating settlement habitat. This study tested the effect of elevated CO2 on the ability of settlement-stage temperate fish to use auditory cues from adult coastal reef habitats. Wild late larval stages of painted goby (Pomatoschistus pictus were exposed to control pCO2 (532 μatm, pH 8.06 and high pCO2 (1503 μatm, pH 7.66 conditions, likely to occur in nearshore regions subjected to upwelling events by the end of the century, and tested in an auditory choice chamber for their preference or avoidance to nighttime reef recordings. Fish reared in control pCO2 conditions discriminated reef soundscapes and were attracted by reef recordings. This behaviour changed in fish reared in the high CO2 conditions, with settlement-stage larvae strongly avoiding reef recordings. This study provides evidence that ocean acidification might affect the auditory responses of larval stages of temperate reef fish species, with potentially significant impacts on their survival.

Co-precipitation and solubility studies of cesium, potassium and sodium tetraphenylborate

International Nuclear Information System (INIS)

Peterson, R.A.

2000-01-01

This report contains the results from a study requested by High Level Waste on the co-precipitation and solubility of cesium, potassium, and sodium tetraphenylborate. Co-precipitation of cesium (Cs), potassium (K), and sodium (Na) tetraphenylborate (TPB) helps determine the efficiency of reagent usage in the Small Tank Precipitation Process. This process uses NaTPB to remove cesium from waste by means of precipitation. Previous studies by McCabe suggested that if the sodium ion concentration [Na + ] increased the rate at which cesium tetraphenylborate (CsTPB) precipitates also increases. Serkiz also demonstrated that the precipitation of potassium tetraphenylborate (KTPB) in the presence of high [Na + ] (∼5M) appears to produce a mixed solid phase composed of NaTPB and KTPB together in the crystal lattice. In the crystallographic structure of these three tetraphenylborate salts (Cs,K,NaTPB), the tetraphenylborate ion dominates the size of the crystals. Also, note that the three crystals have nearly identical structures with the exception of two additional peaks in the cesium pattern. Given these similarities, TPB precipitation in the presence of Na + , Cs + and K + likely produces an impure isomorphic crystalline mixture of CsTPB, KTPB and NaTPB. The authors speculate that the primary crystalline structure resembles that of KTPB with NaTPB and CsTPB mixed throughout the crystal structure. The precipitation of NaTPB makes some of the anticipated excess tetraphenylborate relatively unavailable for precipitation of cesium. Thus, the amount of excess tetraphenylborate required to completely precipitate all of the potassium and cesium may increase significantly

High CO2 Primes Plant Biotic Stress Defences through Redox-Linked Pathways1[OPEN

Science.gov (United States)

2016-01-01

Industrial activities have caused tropospheric CO2 concentrations to increase over the last two centuries, a trend that is predicted to continue for at least the next several decades. Here, we report that growth of plants in a CO2-enriched environment activates responses that are central to defense against pathogenic attack. Salicylic acid accumulation was triggered by high-growth CO2 in Arabidopsis (Arabidopsis thaliana) and other plants such as bean (Phaseolus vulgaris). A detailed analysis in Arabidopsis revealed that elevated CO2 primes multiple defense pathways, leading to increased resistance to bacterial and fungal challenge. Analysis of gene-specific mutants provided no evidence that activation of plant defense pathways by high CO2 was caused by stomatal closure. Rather, the activation is partly linked to metabolic effects involving redox signaling. In support of this, genetic modification of redox components (glutathione contents and NADPH-generating enzymes) prevents full priming of the salicylic acid pathway and associated resistance by high CO2. The data point to a particularly influential role for the nonphosphorylating glyceraldehyde-3-phosphate dehydrogenase, a cytosolic enzyme whose role in plants remains unclear. Our observations add new information on relationships between high CO2 and oxidative signaling and provide novel insight into plant stress responses in conditions of increased CO2. PMID:27578552

Solubilities of iron and nickel oxides under high temperature and high pressure conditions

International Nuclear Information System (INIS)

Choi, Ke-Chon; Jung, Yong-Ju; Yeon, Jei-Won; Jee, Kwang-Yong

2007-01-01

The purposes of primary coolant chemistry are to assure fuel and material integrity and to minimize out of core radiation fields. During the PWR operation, crud deposits are expected on the cladding, leading to cladding failure and raising the radioactivity. Such deposits come from the corrosion products of system surface. To achieve optimal conditions for primary coolant, basic researches on mass transfer, deposition and solubility of corrosion products are needed. The initial stage of crud formation could be the studies on the solubility of a structural material. It has been known that the solubility of metal oxides in boric acid under high temperature and high pressure condition depends on the pH and dissolved hydrogen. Thus, the effect of various pH on the solubility of metal oxide in boric acid solution was investigated in this work

High-speed high-efficiency 500-W cw CO2 laser hermetization of metal frames of microelectronics devices

Science.gov (United States)

Levin, Andrey V.

1996-04-01

High-speed, efficient method of laser surface treatment has been developed using (500 W) cw CO2 laser. The principal advantages of CO2 laser surface treatment in comparison with solid state lasers are the basis of the method. It has been affirmed that high efficiency of welding was a consequence of the fundamental properties of metal-IR-radiation (10,6 mkm) interaction. CO2 laser hermetization of metal frames of microelectronic devices is described as an example of the proposed method application.

Investigation of anti-corrosive properties of poly(aniline-co-2-pyridylamine-co-2,3-xylidine) and its nanocomposite poly(aniline-co-2-pyridylamine-co-2,3-xylidine)/ZnO on mild steel in 0.1 M HCl

Science.gov (United States)

Alam, Ruman; Mobin, Mohammad; Aslam, Jeenat

2016-04-01

A soluble terpolymer of aniline (AN), 2-pyridylamine (PA) and 2,3-xylidine (XY), poly(AN-co-PA-co-XY) and its nanocomposite with ZnO nanoparticles namely, poly(AN-co-PA-co-XY)/ZnO were synthesized by chemical oxidative polymerization employing ammonium persulfate as an oxidant. Nanocomposites of homopolymers, polyaniline/ZnO, poly(XY)/ZnO and poly(PA)/ZnO were also synthesized by following similar synthesis route. FTIR, XRD and SEM techniques were used to characterize the synthesized compounds. The synthesized compounds were chemically deposited on mild steel specimens by solvent evaporation method using N-methyl-2-pyrrolidone (NMP) as solvent and 10% epoxy resin (by weight) as binder. Anticorrosive properties of homopolymer nanocomposites, terpolymer and its nanocomposite coatings were studied in 0.1 M HCl by subjecting them to various corrosion tests which includes: free corrosion potential measurement (OCP), weight loss measurements, potentiodynamic polarization, and AC impedance technique. The surface morphology of the corroded and uncorroded coated steel specimens was evaluated using SEM. The corrosion protection performance of terpolymer nanocomposite coating was compared to the terpolymer and individual homopolymers nanocomposites coatings after 30 days immersion in corrosive medium.

Pure Phase Solubility Limits: LANL

International Nuclear Information System (INIS)

C. Stockman

2001-01-01

The natural and engineered system at Yucca Mountain (YM) defines the site-specific conditions under which one must determine to what extent the engineered and the natural geochemical barriers will prevent the release of radioactive material from the repository. Most important mechanisms for retention or enhancement of radionuclide transport include precipitation or co-precipitation of radionuclide-bearing solid phases (solubility limits), complexation in solution, sorption onto surfaces, colloid formation, and diffusion. There may be many scenarios that could affect the near-field environment, creating chemical conditions more aggressive than the conditions presented by the unperturbed system (such as pH changes beyond the range of 6 to 9 or significant changes in the ionic strength of infiltrated waters). For an extended period of time, the near-field water composition may be quite different and more extreme in pH, ionic strength, and CO 2 partial pressure (or carbonate concentration) than waters at some distance from the repository. Reducing conditions, high pH (up to 11), and low carbonate concentration may be present in the near-field after reaction of infiltrating groundwater with engineered barrier systems, such as cementitious materials. In the far-field, conditions are controlled by the rock-mass buffer providing a near-neutral, oxidizing, low-ionic-strength environment that controls radionuclide solubility limits and sorption capacities. There is the need for characterization of variable chemical conditions that affect solubility, speciation, and sorption reactions. Modeling of the groundwater chemistry is required and leads to an understanding of solubility and speciation of the important radionuclides. Because experimental studies cannot be performed under the numerous potential chemical conditions, solubility limitations must rely on geochemical modeling of the radionuclide's chemistry. Fundamental thermodynamic properties, such as solubility products

Pure Phase Solubility Limits: LANL

Energy Technology Data Exchange (ETDEWEB)

C. Stockman

2001-01-26

The natural and engineered system at Yucca Mountain (YM) defines the site-specific conditions under which one must determine to what extent the engineered and the natural geochemical barriers will prevent the release of radioactive material from the repository. Most important mechanisms for retention or enhancement of radionuclide transport include precipitation or co-precipitation of radionuclide-bearing solid phases (solubility limits), complexation in solution, sorption onto surfaces, colloid formation, and diffusion. There may be many scenarios that could affect the near-field environment, creating chemical conditions more aggressive than the conditions presented by the unperturbed system (such as pH changes beyond the range of 6 to 9 or significant changes in the ionic strength of infiltrated waters). For an extended period of time, the near-field water composition may be quite different and more extreme in pH, ionic strength, and CO{sub 2} partial pressure (or carbonate concentration) than waters at some distance from the repository. Reducing conditions, high pH (up to 11), and low carbonate concentration may be present in the near-field after reaction of infiltrating groundwater with engineered barrier systems, such as cementitious materials. In the far-field, conditions are controlled by the rock-mass buffer providing a near-neutral, oxidizing, low-ionic-strength environment that controls radionuclide solubility limits and sorption capacities. There is the need for characterization of variable chemical conditions that affect solubility, speciation, and sorption reactions. Modeling of the groundwater chemistry is required and leads to an understanding of solubility and speciation of the important radionuclides. Because experimental studies cannot be performed under the numerous potential chemical conditions, solubility limitations must rely on geochemical modeling of the radionuclide's chemistry. Fundamental thermodynamic properties, such as solubility

Solubility of AnO{sub 2}.xH{sub 2}O(am) in carbonate solution and formation of ternary An(IV) hydroxide-carbonate complexes

Energy Technology Data Exchange (ETDEWEB)

Neck, V.; Altmaier, M. [Institut fuer Nukleare Entsorgung, Forschungszentrum Karlsruhe, Postfach 3640, D-76021 Karlsruhe (Germany); Fanghaenel, Th. [Institut fuer Nukleare Entsorgung, Forschungszentrum Karlsruhe, Postfach 3640, D-76021 Karlsruhe (Germany); Physikalisch-Chemisches Institut, Ruprecht-Karls-Universitaet, Im Neuenheimer Feld 253, D-69120 Heidelberg (Germany)

2005-07-01

Full text of publication follows: The solubility of amorphous An(IV) hydroxides or hydrous oxides is studied with Th(IV) as a redox-stable surrogate for the other tetravalent actinides at I = 0.1 - 4 M (NaHCO{sub 3}-Na{sub 2}CO{sub 3}-NaOHNaCl) and 22 deg. C. Several series of closed system experiments at total carbonate concentrations of C{sub tot} = [HCO{sub 3}{sup -}] + [CO{sub 3}{sup 2-}] = 0.02 and 0.1 M in the range pH{sub c} = 8 - 13 and in Na{sub 2}CO{sub 3}-NaOH mixtures are performed with Th(IV) and additionally with Pu(IV). In our recent study with Th(IV) at I = 0.5 M [1], the simultaneous evaluation of solubility data at widely varied pH and carbonate concentrations has shown that Th(OH)(CO{sub 3}){sub 4}{sup 5-}, Th(OH){sub 2}(CO{sub 3}){sub 2}{sup 2-} and Th(OH){sub 4}(CO{sub 3}){sup 2-} are the most important ternary complexes. The present results at I = 0.1 - 4 M are used to describe the ionic strength dependence of the equilibrium constants log K{sub s,1yz} = log K{sub sp} + log {beta}{sub 1yz} for the reactions An(OH){sub 4}(am) + z CO{sub 3}{sup 2-} {r_reversible} An(OH){sub y}(CO{sub 3}){sub z}{sup 4-y-2z} + (4-y) OH{sup -}. Using the evaluated ion interaction (SIT) coefficients, available solubility data for U(IV), Np(IV) and Pu(IV) in wide ranges of pH, carbonate concentration and ionic strength, in particular apparently conflicting literature data for Np(IV) [2, 3] and Pu(IV) [2, 4], can be described with a consistent set of equilibrium constants. The predominant complexes An(OH){sub y}(CO{sub 3}){sub z}{sup 4-y-2z} and their formation constants log {beta}{sup 0}{sub 1yz} show pronounced analogies and systematic tendencies in the series Th(IV)-U(IV)-Np(IV)-Pu(IV). [1] Altmaier, M., Neck, V., Mueller, R., Fanghaenel, Th., Radiochim. Acta 93 (2005), in press.; [2] Rai, D., Hess, N.J., Felmy, A.R., Moore, D.A., Yui, M., Vitorge, P., a) Radiochim. Acta 84 (1999), 159, b) Radiochim. Acta 86 (1999), 89.; [3] Kitamura, A., Kohara, Y., J. Nucl